data_1fmy_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 1fmy _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' ' ' GLN . . . . . 0.473 ' N ' ' OE2' ' A' ' 3' ' ' GLU . 1.6 tt0 . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -96.55 65.28 2.24 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 103.55 -2.759 . . . . 0.0 103.55 170.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.473 ' OE2' ' N ' ' A' ' 1' ' ' GLN . 9.7 mt-10 -52.6 -18.34 1.71 Allowed 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 126.473 1.909 . . . . 0.0 115.053 -166.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.99 -93.47 1.1 Allowed Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 108.65 -1.78 . . . . 0.0 108.65 168.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 177.56 -171.32 0.1 Allowed 'General case' 0 C--O 1.233 0.203 0 C-N-CA 127.369 2.268 . . . . 0.0 105.691 179.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -74.27 100.54 3.76 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 170.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.41 ' C ' ' H ' ' A' ' 9' ' ' CYS . 43.3 t -55.37 -66.72 0.36 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.622 1.169 . . . . 0.0 112.141 -179.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 29.9 mm-40 53.91 -0.75 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 128.549 2.74 . . . . 0.0 115.896 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.41 ' H ' ' C ' ' A' ' 7' ' ' CYS . 62.4 m -37.49 119.89 0.75 Allowed 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 128.907 2.883 . . . . 0.0 111.492 174.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.78 12.94 0.32 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.36 128.37 35.23 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -48.21 -42.46 24.66 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-N 119.598 1.09 . . . . 0.0 111.382 171.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.18 -23.43 62.22 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 125.838 1.655 . . . . 0.0 111.45 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 9.0 m -94.59 -56.06 2.92 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 124.442 1.097 . . . . 0.0 109.894 173.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.3 mmmt -69.67 68.07 0.25 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 127.819 2.448 . . . . 0.0 111.614 -178.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -171.38 -35.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 126.136 1.775 . . . . 0.0 110.136 -177.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.01 102.64 10.14 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.225 1.01 . . . . 0.0 109.003 -168.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -60.38 -20.49 59.74 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 121.193 -0.942 . . . . 0.0 112.1 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -49.26 -64.14 0.9 Allowed 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 119.334 -0.365 . . . . 0.0 110.802 165.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.39 -35.67 81.65 Favored 'General case' 0 CA--C 1.511 -0.548 0 C-N-CA 119.272 -0.971 . . . . 0.0 109.22 -176.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 71.8 mm-40 -44.07 -38.2 3.47 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -176.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -110.49 -21.87 11.94 Favored 'General case' 0 CA--C 1.547 0.849 0 O-C-N 124.632 1.208 . . . . 0.0 111.432 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 t -121.4 55.45 1.08 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.78 1.632 . . . . 0.0 111.077 -178.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 9.1 t -111.59 150.01 30.65 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 125.318 1.447 . . . . 0.0 109.023 177.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.3 m -124.11 47.49 2.06 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.568 1.147 . . . . 0.0 110.628 -176.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 55.7 m -120.46 155.54 56.38 Favored Pre-proline 0 C--O 1.226 -0.139 0 C-N-CA 124.257 1.023 . . . . 0.0 110.14 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -74.56 167.94 25.97 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 C-N-CA 121.988 1.792 . . . . 0.0 110.627 171.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.1 t -59.0 -31.39 68.75 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 122.686 1.231 . . . . 0.0 111.681 -176.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -63.73 -16.9 59.7 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.943 1.258 . . . . 0.0 113.547 178.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.8 t -70.43 85.51 0.6 Allowed 'General case' 0 C--N 1.34 0.174 0 CA-C-N 119.706 1.753 . . . . 0.0 111.646 -172.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -131.29 41.51 3.32 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 39.2 m -167.55 132.73 1.95 Allowed 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 125.413 1.485 . . . . 0.0 107.4 -172.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.4 p-10 -63.93 -46.18 85.9 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.763 1.225 . . . . 0.0 108.522 -177.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -36.2 -49.49 0.68 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.428 1.891 . . . . 0.0 111.657 170.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.6 mttt -113.46 52.85 0.79 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.833 0.853 . . . . 0.0 111.114 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.6 t -108.51 92.38 9.94 Favored Pre-proline 0 CA--C 1.53 0.188 0 C-N-CA 122.929 0.491 . . . . 0.0 111.79 172.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -77.98 9.52 3.0 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.482 2.121 . . . . 0.0 114.087 176.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.8 t -57.86 129.24 41.02 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 124.535 1.134 . . . . 0.0 112.235 -175.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -87.09 41.71 3.11 Favored Glycine 0 CA--C 1.53 1.0 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 175.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 54.2 m-80 . . . . . 0 C--O 1.248 1.016 0 N-CA-C 104.109 -2.552 . . . . 0.0 104.109 174.781 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.473 ' N ' ' OE2' ' A' ' 3' ' ' GLU . 1.6 tt0 . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.425 ' H ' ' HG2' ' A' ' 1' ' ' GLN . 21.5 m120 -96.55 65.28 2.24 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 103.55 -2.759 . . . . 0.0 103.55 170.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.473 ' OE2' ' N ' ' A' ' 1' ' ' GLN . 9.7 mt-10 -52.6 -18.34 1.71 Allowed 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 126.473 1.909 . . . . 0.0 115.053 -166.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.99 -93.47 1.1 Allowed Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 108.65 -1.78 . . . . 0.0 108.65 168.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 177.56 -171.32 0.1 Allowed 'General case' 0 C--O 1.233 0.203 0 C-N-CA 127.369 2.268 . . . . 0.0 105.691 179.214 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -74.27 100.54 3.76 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 170.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.44 ' HB3' ' HA ' ' A' ' 21' ' ' GLN . 43.3 t -55.37 -66.72 0.36 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.622 1.169 . . . . 0.0 112.141 -179.711 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 29.9 mm-40 53.91 -0.75 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 128.549 2.74 . . . . 0.0 115.896 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 62.4 m -37.49 119.89 0.75 Allowed 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 128.907 2.883 . . . . 0.0 111.492 174.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -71.78 12.94 0.32 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.36 128.37 35.23 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -48.21 -42.46 24.66 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-N 119.598 1.09 . . . . 0.0 111.382 171.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.18 -23.43 62.22 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 125.838 1.655 . . . . 0.0 111.45 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 9.0 m -94.59 -56.06 2.92 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 124.442 1.097 . . . . 0.0 109.894 173.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.3 mmmt -69.67 68.07 0.25 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 127.819 2.448 . . . . 0.0 111.614 -178.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -171.38 -35.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 126.136 1.775 . . . . 0.0 110.136 -177.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.01 102.64 10.14 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.225 1.01 . . . . 0.0 109.003 -168.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -60.38 -20.49 59.74 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 121.193 -0.942 . . . . 0.0 112.1 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -49.26 -64.14 0.9 Allowed 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 119.334 -0.365 . . . . 0.0 110.802 165.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.39 -35.67 81.65 Favored 'General case' 0 CA--C 1.511 -0.548 0 C-N-CA 119.272 -0.971 . . . . 0.0 109.22 -176.201 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.44 ' HA ' ' HB3' ' A' ' 7' ' ' CYS . 71.8 mm-40 -44.07 -38.2 3.47 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -176.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -110.49 -21.87 11.94 Favored 'General case' 0 CA--C 1.547 0.849 0 O-C-N 124.632 1.208 . . . . 0.0 111.432 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 t -121.4 55.45 1.08 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.78 1.632 . . . . 0.0 111.077 -178.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 9.1 t -111.59 150.01 30.65 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 125.318 1.447 . . . . 0.0 109.023 177.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.3 m -124.11 47.49 2.06 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.568 1.147 . . . . 0.0 110.628 -176.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 55.7 m -120.46 155.54 56.38 Favored Pre-proline 0 C--O 1.226 -0.139 0 C-N-CA 124.257 1.023 . . . . 0.0 110.14 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -74.56 167.94 25.97 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 C-N-CA 121.988 1.792 . . . . 0.0 110.627 171.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.1 t -59.0 -31.39 68.75 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 122.686 1.231 . . . . 0.0 111.681 -176.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -63.73 -16.9 59.7 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.943 1.258 . . . . 0.0 113.547 178.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.8 t -70.43 85.51 0.6 Allowed 'General case' 0 C--N 1.34 0.174 0 CA-C-N 119.706 1.753 . . . . 0.0 111.646 -172.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -131.29 41.51 3.32 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 39.2 m -167.55 132.73 1.95 Allowed 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 125.413 1.485 . . . . 0.0 107.4 -172.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.4 p-10 -63.93 -46.18 85.9 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.763 1.225 . . . . 0.0 108.522 -177.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -36.2 -49.49 0.68 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.428 1.891 . . . . 0.0 111.657 170.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.6 mttt -113.46 52.85 0.79 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.833 0.853 . . . . 0.0 111.114 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.6 t -108.51 92.38 9.94 Favored Pre-proline 0 CA--C 1.53 0.188 0 C-N-CA 122.929 0.491 . . . . 0.0 111.79 172.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -77.98 9.52 3.0 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.482 2.121 . . . . 0.0 114.087 176.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.8 t -57.86 129.24 41.02 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 124.535 1.134 . . . . 0.0 112.235 -175.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -87.09 41.71 3.11 Favored Glycine 0 CA--C 1.53 1.0 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 175.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 54.2 m-80 . . . . . 0 C--O 1.248 1.016 0 N-CA-C 104.109 -2.552 . . . . 0.0 104.109 174.781 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.473 ' N ' ' OE2' ' A' ' 3' ' ' GLU . 1.6 tt0 . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.425 ' H ' ' HG2' ' A' ' 1' ' ' GLN . 21.5 m120 -96.55 65.28 2.24 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 103.55 -2.759 . . . . 0.0 103.55 170.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.473 ' OE2' ' N ' ' A' ' 1' ' ' GLN . 9.7 mt-10 -52.6 -18.34 1.71 Allowed 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 126.473 1.909 . . . . 0.0 115.053 -166.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.99 -93.47 1.1 Allowed Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 108.65 -1.78 . . . . 0.0 108.65 168.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 177.56 -171.32 0.1 Allowed 'General case' 0 C--O 1.233 0.203 0 C-N-CA 127.369 2.268 . . . . 0.0 105.691 179.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -74.27 100.54 3.76 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 170.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.44 ' HB3' ' HA ' ' A' ' 21' ' ' GLN . 43.3 t -55.37 -66.72 0.36 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.622 1.169 . . . . 0.0 112.141 -179.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 29.9 mm-40 53.91 -0.75 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 128.549 2.74 . . . . 0.0 115.896 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 62.4 m -37.49 119.89 0.75 Allowed 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 128.907 2.883 . . . . 0.0 111.492 174.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.78 12.94 0.32 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.36 128.37 35.23 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -48.21 -42.46 24.66 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-N 119.598 1.09 . . . . 0.0 111.382 171.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.18 -23.43 62.22 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 125.838 1.655 . . . . 0.0 111.45 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 9.0 m -94.59 -56.06 2.92 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 124.442 1.097 . . . . 0.0 109.894 173.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.3 mmmt -69.67 68.07 0.25 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 127.819 2.448 . . . . 0.0 111.614 -178.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -171.38 -35.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 126.136 1.775 . . . . 0.0 110.136 -177.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.01 102.64 10.14 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.225 1.01 . . . . 0.0 109.003 -168.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -60.38 -20.49 59.74 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 121.193 -0.942 . . . . 0.0 112.1 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -49.26 -64.14 0.9 Allowed 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 119.334 -0.365 . . . . 0.0 110.802 165.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.39 -35.67 81.65 Favored 'General case' 0 CA--C 1.511 -0.548 0 C-N-CA 119.272 -0.971 . . . . 0.0 109.22 -176.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.44 ' HA ' ' HB3' ' A' ' 7' ' ' CYS . 71.8 mm-40 -44.07 -38.2 3.47 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -176.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -110.49 -21.87 11.94 Favored 'General case' 0 CA--C 1.547 0.849 0 O-C-N 124.632 1.208 . . . . 0.0 111.432 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 t -121.4 55.45 1.08 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.78 1.632 . . . . 0.0 111.077 -178.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 9.1 t -111.59 150.01 30.65 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 125.318 1.447 . . . . 0.0 109.023 177.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.3 m -124.11 47.49 2.06 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.568 1.147 . . . . 0.0 110.628 -176.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 55.7 m -120.46 155.54 56.38 Favored Pre-proline 0 C--O 1.226 -0.139 0 C-N-CA 124.257 1.023 . . . . 0.0 110.14 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -74.56 167.94 25.97 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 C-N-CA 121.988 1.792 . . . . 0.0 110.627 171.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.1 t -59.0 -31.39 68.75 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 122.686 1.231 . . . . 0.0 111.681 -176.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -63.73 -16.9 59.7 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.943 1.258 . . . . 0.0 113.547 178.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 10.8 t -70.43 85.51 0.6 Allowed 'General case' 0 C--N 1.34 0.174 0 CA-C-N 119.706 1.753 . . . . 0.0 111.646 -172.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -131.29 41.51 3.32 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 39.2 m -167.55 132.73 1.95 Allowed 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 125.413 1.485 . . . . 0.0 107.4 -172.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.4 p-10 -63.93 -46.18 85.9 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.763 1.225 . . . . 0.0 108.522 -177.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -36.2 -49.49 0.68 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.428 1.891 . . . . 0.0 111.657 170.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.6 mttt -113.46 52.85 0.79 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.833 0.853 . . . . 0.0 111.114 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 41.6 t -108.51 92.38 9.94 Favored Pre-proline 0 CA--C 1.53 0.188 0 C-N-CA 122.929 0.491 . . . . 0.0 111.79 172.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -77.98 9.52 3.0 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.482 2.121 . . . . 0.0 114.087 176.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.8 t -57.86 129.24 41.02 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 124.535 1.134 . . . . 0.0 112.235 -175.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -87.09 41.71 3.11 Favored Glycine 0 CA--C 1.53 1.0 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 175.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 54.2 m-80 . . . . . 0 C--O 1.248 1.016 0 N-CA-C 104.109 -2.552 . . . . 0.0 104.109 174.781 . . . . . . . . 0 0 . 1 stop_ save_