data_2ezd_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 2ezd _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 ' B' B ' 201' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.145 0 O4'-C4'-C3' 107.605 2.005 . . . . 1.8100000000000001 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 202' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.13 0 C4'-C3'-C2' 105.115 1.915 . . . . 1.1299999999999999 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.99 0 O4'-C4'-C3' 107.888 2.288 . . . . 0.93000000000000005 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 204' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.037 0 O4'-C4'-C3' 107.941 2.341 . . . . 0.68000000000000005 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 205' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.094 0 C4'-C3'-C2' 105.52 2.32 . . . . 0.64000000000000001 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.102 0 O4'-C4'-C3' 107.659 2.059 . . . . 0.64000000000000001 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 207' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.019 0 C4'-C3'-C2' 105.396 2.196 . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.161 0 C4'-C3'-C2' 105.604 2.404 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 209' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.979 0 C4'-C3'-C2' 105.567 2.367 . . . . 0.44 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 210' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.145 0 C4'-C3'-C2' 105.493 2.293 . . . . 0.38 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 211' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.28 0 O4'-C4'-C3' 107.953 2.353 . . . . 1.22 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 212' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.142 0 O4'-C4'-C3' 107.859 2.259 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 213' ' ' ' DG' . . . . . 0.762 " O5'" ' H8 ' ' C' ' 213' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.528 2.153 0 O4'-C1'-C2' 109.044 2.676 . . . . 1.3500000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 214' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.073 0 O4'-C4'-C3' 107.516 1.916 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 215' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.025 0 O4'-C4'-C3' 107.753 2.153 . . . . 0.93000000000000005 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.967 0 O4'-C4'-C3' 107.576 1.976 . . . . 0.70999999999999996 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 217' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.109 0 O4'-C4'-C3' 107.503 1.903 . . . . 0.70999999999999996 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 218' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.102 0 O4'-C4'-C3' 107.681 2.081 . . . . 0.65000000000000002 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 219' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.054 0 O4'-C4'-C3' 107.749 2.149 . . . . 1.1299999999999999 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 220' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.163 0 C4'-C3'-C2' 105.4 2.2 . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 221' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.006 0 C4'-C3'-C2' 105.342 2.142 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 222' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.111 0 C4'-C3'-C2' 105.313 2.113 . . . . 0.45000000000000001 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 223' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.145 0 C4'-C3'-C2' 105.329 2.129 . . . . 0.68999999999999995 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 224' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.256 0 O4'-C4'-C3' 107.651 2.051 . . . . 1.3799999999999999 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 121.328 0.585 . . . . 6.6399999999999997 109.439 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.47 -20.46 20.73 Favored 'Trans proline' 0 N--CA 1.493 1.443 0 C-N-CA 122.601 2.201 . . . . 6.5 111.542 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.549 ' O ' ' N ' ' A' ' 7' ' ' LYS . 20.1 p -107.14 102.65 44.42 Favored Pre-proline 0 N--CA 1.495 1.814 0 N-CA-C 109.196 -0.668 . . . . 4.8300000000000001 109.196 179.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -49.94 81.01 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 121.619 1.546 . . . . 3.0800000000000001 111.803 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.549 ' N ' ' O ' ' A' ' 5' ' ' THR . 15.5 mttt -83.59 112.34 19.92 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.147 -0.971 . . . . 2.9900000000000002 109.349 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -85.72 144.55 39.92 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.178 -0.951 . . . . 3.4199999999999999 108.556 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -73.0 144.24 37.73 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.0 1.8 . . . . 1.1100000000000001 111.995 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -59.67 127.04 30.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.258 -0.901 . . . . 0.65000000000000002 108.749 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 174.34 173.37 40.29 Favored Glycine 0 N--CA 1.49 2.238 0 C-N-CA 119.271 -1.443 . . . . 0.46999999999999997 110.264 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.2 ttp180 -101.93 117.84 60.65 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.589 -0.948 . . . . 2.73 109.318 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_exo -42.71 153.61 0.15 Allowed 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 121.945 1.764 . . . . 0.76000000000000001 112.385 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -75.77 142.16 42.4 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.271 -0.893 . . . . 2.5699999999999998 109.575 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.97 9.69 84.98 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.636 -1.386 . . . . 0.73999999999999999 109.636 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 t -84.07 108.06 16.78 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.255 -1.144 . . . . 2.04 109.398 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -91.56 175.86 6.76 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.237 -0.914 . . . . 2.1800000000000002 108.902 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.1 m-20 -75.35 133.74 41.15 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.09 -1.006 . . . . 1.9399999999999999 108.616 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -82.22 -3.24 54.67 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.276 -0.89 . . . . 3.3599999999999999 111.243 -178.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 170.76 -157.69 28.89 Favored Glycine 0 N--CA 1.491 2.33 0 C-N-CA 118.733 -1.698 . . . . 2.8999999999999999 110.837 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.39 102.45 10.49 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.585 -0.95 . . . . 3.4900000000000002 110.169 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.99 103.33 7.86 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.182 -0.949 . . . . 3.0099999999999998 108.724 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.244 -0.91 . . . . 7.5099999999999998 109.395 -179.395 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 201' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.145 0 O4'-C4'-C3' 107.605 2.005 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 202' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.13 0 C4'-C3'-C2' 105.115 1.915 . . . . 1.1299999999999999 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.99 0 O4'-C4'-C3' 107.888 2.288 . . . . 0.93000000000000005 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 204' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.037 0 O4'-C4'-C3' 107.941 2.341 . . . . 0.68000000000000005 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 205' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.094 0 C4'-C3'-C2' 105.52 2.32 . . . . 0.64000000000000001 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.102 0 O4'-C4'-C3' 107.659 2.059 . . . . 0.64000000000000001 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 207' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.019 0 C4'-C3'-C2' 105.396 2.196 . . . . 0.59999999999999998 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.161 0 C4'-C3'-C2' 105.604 2.404 . . . . 0.47999999999999998 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 209' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.979 0 C4'-C3'-C2' 105.567 2.367 . . . . 0.44 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 210' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.145 0 C4'-C3'-C2' 105.493 2.293 . . . . 0.38 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 211' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.28 0 O4'-C4'-C3' 107.953 2.353 . . . . 0.52000000000000002 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 212' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.142 0 O4'-C4'-C3' 107.859 2.259 . . . . 0.84999999999999998 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 213' ' ' ' DG' . . . . . 0.811 HO5' ' H8 ' ' C' ' 213' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.528 2.153 0 O4'-C1'-C2' 109.044 2.676 . . . . 1.28 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 214' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.073 0 O4'-C4'-C3' 107.516 1.916 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 215' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.025 0 O4'-C4'-C3' 107.753 2.153 . . . . 0.93000000000000005 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.967 0 O4'-C4'-C3' 107.576 1.976 . . . . 0.70999999999999996 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 217' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.109 0 O4'-C4'-C3' 107.503 1.903 . . . . 0.70999999999999996 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 218' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.102 0 O4'-C4'-C3' 107.681 2.081 . . . . 0.65000000000000002 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 219' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.054 0 O4'-C4'-C3' 107.749 2.149 . . . . 0.52000000000000002 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 220' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.163 0 C4'-C3'-C2' 105.4 2.2 . . . . 0.47999999999999998 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 221' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.006 0 C4'-C3'-C2' 105.342 2.142 . . . . 0.46000000000000002 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 222' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.111 0 C4'-C3'-C2' 105.313 2.113 . . . . 0.45000000000000001 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 223' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.145 0 C4'-C3'-C2' 105.329 2.129 . . . . 0.68999999999999995 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 224' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.256 0 O4'-C4'-C3' 107.651 2.051 . . . . 1.02 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.483 HG13 ' O ' ' A' ' 3' ' ' VAL . 7.4 p . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 121.328 0.585 . . . . 6.2999999999999998 109.439 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.47 -20.46 20.73 Favored 'Trans proline' 0 N--CA 1.493 1.443 0 C-N-CA 122.601 2.201 . . . . 5.8200000000000003 111.542 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.549 ' O ' ' N ' ' A' ' 7' ' ' LYS . 20.1 p -107.14 102.65 44.42 Favored Pre-proline 0 N--CA 1.495 1.814 0 N-CA-C 109.196 -0.668 . . . . 4.3899999999999997 109.196 179.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -49.94 81.01 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 121.619 1.546 . . . . 2.6099999999999999 111.803 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.549 ' N ' ' O ' ' A' ' 5' ' ' THR . 15.5 mttt -83.59 112.34 19.92 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.147 -0.971 . . . . 2.6000000000000001 109.349 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -85.72 144.55 39.92 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.178 -0.951 . . . . 2.9399999999999999 108.556 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -73.0 144.24 37.73 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.0 1.8 . . . . 0.79000000000000004 111.995 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -59.67 127.04 30.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.258 -0.901 . . . . 0.56999999999999995 108.749 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 174.34 173.37 40.29 Favored Glycine 0 N--CA 1.49 2.238 0 C-N-CA 119.271 -1.443 . . . . 0.46000000000000002 110.264 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.2 ttp180 -101.93 117.84 60.65 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.589 -0.948 . . . . 1.99 109.318 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_exo -42.71 153.61 0.15 Allowed 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 121.945 1.764 . . . . 0.59999999999999998 112.385 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -75.77 142.16 42.4 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.271 -0.893 . . . . 2.0899999999999999 109.575 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.97 9.69 84.98 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.636 -1.386 . . . . 0.66000000000000003 109.636 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 t -84.07 108.06 16.78 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.255 -1.144 . . . . 1.5800000000000001 109.398 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -91.56 175.86 6.76 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.237 -0.914 . . . . 1.6100000000000001 108.902 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.1 m-20 -75.35 133.74 41.15 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.09 -1.006 . . . . 1.6899999999999999 108.616 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -82.22 -3.24 54.67 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.276 -0.89 . . . . 2.8599999999999999 111.243 -178.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 170.76 -157.69 28.89 Favored Glycine 0 N--CA 1.491 2.33 0 C-N-CA 118.733 -1.698 . . . . 2.3900000000000001 110.837 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.39 102.45 10.49 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.585 -0.95 . . . . 3.0899999999999999 110.169 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.99 103.33 7.86 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.182 -0.949 . . . . 3.0099999999999998 108.724 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.244 -0.91 . . . . 7.2300000000000004 109.395 -179.395 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 201' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.145 0 O4'-C4'-C3' 107.605 2.005 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 202' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.13 0 C4'-C3'-C2' 105.115 1.915 . . . . 1.13 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 203' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.99 0 O4'-C4'-C3' 107.888 2.288 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 204' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.037 0 O4'-C4'-C3' 107.941 2.341 . . . . 0.68 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 205' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.094 0 C4'-C3'-C2' 105.52 2.32 . . . . 0.64 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 206' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.102 0 O4'-C4'-C3' 107.659 2.059 . . . . 0.64 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 207' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.019 0 C4'-C3'-C2' 105.396 2.196 . . . . 0.6 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 208' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.161 0 C4'-C3'-C2' 105.604 2.404 . . . . 0.48 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 209' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.979 0 C4'-C3'-C2' 105.567 2.367 . . . . 0.44 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 210' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.145 0 C4'-C3'-C2' 105.493 2.293 . . . . 0.38 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 211' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.28 0 O4'-C4'-C3' 107.953 2.353 . . . . 0.52 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 212' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.142 0 O4'-C4'-C3' 107.859 2.259 . . . . 0.85 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 213' ' ' ' DG' . . . . . 0.811 ' H8 ' HO5' ' C' ' 213' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.528 2.153 0 O4'-C1'-C2' 109.044 2.676 . . . . 1.28 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 214' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.073 0 O4'-C4'-C3' 107.516 1.916 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 215' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.025 0 O4'-C4'-C3' 107.753 2.153 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 216' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.967 0 O4'-C4'-C3' 107.576 1.976 . . . . 0.71 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 217' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.109 0 O4'-C4'-C3' 107.503 1.903 . . . . 0.71 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 218' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.102 0 O4'-C4'-C3' 107.681 2.081 . . . . 0.65 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 219' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.054 0 O4'-C4'-C3' 107.749 2.149 . . . . 0.52 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 220' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.163 0 C4'-C3'-C2' 105.4 2.2 . . . . 0.48 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 221' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.006 0 C4'-C3'-C2' 105.342 2.142 . . . . 0.46 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 222' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.111 0 C4'-C3'-C2' 105.313 2.113 . . . . 0.45 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 223' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.145 0 C4'-C3'-C2' 105.329 2.129 . . . . 0.69 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 224' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.256 0 O4'-C4'-C3' 107.651 2.051 . . . . 1.02 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.483 ' O ' HG13 ' A' ' 3' ' ' VAL . 7.4 p . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 121.328 0.585 . . . . 6.3 109.439 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.47 -20.46 20.73 Favored 'Trans proline' 0 N--CA 1.493 1.443 0 C-N-CA 122.601 2.201 . . . . 5.82 111.542 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.549 ' O ' ' N ' ' A' ' 7' ' ' LYS . 20.1 p -107.14 102.65 44.42 Favored Pre-proline 0 N--CA 1.495 1.814 0 N-CA-C 109.196 -0.668 . . . . 4.39 109.196 179.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -49.94 81.01 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 121.619 1.546 . . . . 2.61 111.803 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.549 ' N ' ' O ' ' A' ' 5' ' ' THR . 15.5 mttt -83.59 112.34 19.92 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.147 -0.971 . . . . 2.6 109.349 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -85.72 144.55 39.92 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.178 -0.951 . . . . 2.94 108.556 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -73.0 144.24 37.73 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.0 1.8 . . . . 0.79 111.995 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -59.67 127.04 30.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.258 -0.901 . . . . 0.57 108.749 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 174.34 173.37 40.29 Favored Glycine 0 N--CA 1.49 2.238 0 C-N-CA 119.271 -1.443 . . . . 0.46 110.264 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.2 ttp180 -101.93 117.84 60.65 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.589 -0.948 . . . . 1.99 109.318 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_exo -42.71 153.61 0.15 Allowed 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 121.945 1.764 . . . . 0.6 112.385 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -75.77 142.16 42.4 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.271 -0.893 . . . . 2.09 109.575 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.97 9.69 84.98 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.636 -1.386 . . . . 0.66 109.636 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 t -84.07 108.06 16.78 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.255 -1.144 . . . . 1.58 109.398 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -91.56 175.86 6.76 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.237 -0.914 . . . . 1.61 108.902 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.1 m-20 -75.35 133.74 41.15 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.09 -1.006 . . . . 1.69 108.616 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -82.22 -3.24 54.67 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.276 -0.89 . . . . 2.86 111.243 -178.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 170.76 -157.69 28.89 Favored Glycine 0 N--CA 1.491 2.33 0 C-N-CA 118.733 -1.698 . . . . 2.39 110.837 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.39 102.45 10.49 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.585 -0.95 . . . . 3.09 110.169 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.99 103.33 7.86 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.182 -0.949 . . . . 3.01 108.724 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.244 -0.91 . . . . 7.23 109.395 -179.395 . . . . . . . . 0 0 . 1 stop_ save_