data_1nil_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 1nil _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 ' 127' ' ' ACE . . . . . 1.328 ' H1 ' ' C ' ' A' ' 127' ' ' ACE . . . . . . . . 1 C--O 0.882 -18.252 . . . . . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 1.621 ' HG3' ' CD ' ' A' ' 128' ' ' LYS 0.281 25.3 pttt -100.83 129.95 46.77 Favored 'General case' 4 N--CA 1.112 -17.328 0 C-N-CA 126.628 1.971 . . . . 0.0 110.512 . . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . 1.241 ' SG ' ' SG ' ' A' ' 142' ' ' CYS 0.278 88.1 m -76.26 -60.94 2.12 Favored 'General case' 3 N--CA 1.22 -11.935 0 C-N-CA 123.996 0.918 . . . . 0.0 109.312 179.732 -67.985 -64.901 57.491 137.032 1.242 140.399 110.873 -179.896 4 3 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' THR . . . . . 1.567 HG22 ' CB ' ' A' ' 130' ' ' THR . 4.0 p -95.96 115.17 27.03 Favored 'General case' 3 C--O 1.045 -9.669 0 O-C-N 117.653 -3.154 . . . . 0.0 112.519 175.872 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 1.376 ' HG ' ' CA ' ' A' ' 131' ' ' SER 0.383 0.4 OUTLIER -83.31 -76.22 0.29 Allowed 'General case' 4 C--O 0.97 -13.638 0 N-CA-C 121.28 3.808 . . . . 0.0 121.28 178.521 . . . . . . . . 5 4 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 1.285 ' HB2' ' OD1' ' A' ' 132' ' ' ASP 0.263 0.6 OUTLIER -103.61 -72.12 0.71 Allowed 'General case' 4 C--O 0.943 -15.074 3 O-C-N 112.609 -6.307 . . . . 0.0 97.235 171.715 . . . . . . . . 6 4 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 1.565 ' HG2' ' CB ' ' A' ' 133' ' ' GLN 0.466 48.5 tt0 -153.08 85.78 1.23 Allowed 'General case' 4 N--CA 1.274 -9.239 3 N-CA-C 123.372 4.582 . . . . 0.0 123.372 169.967 . . . . . . . . 5 3 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 1.208 ' OD2' ' CB ' ' A' ' 134' ' ' ASP . 1.3 m-20 -123.12 84.47 2.27 Favored 'General case' 1 N--CA 1.358 -5.065 0 O-C-N 124.708 1.255 . . . . 0.0 108.922 -178.004 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 1.102 ' OE2' ' CG ' ' A' ' 135' ' ' GLU . 44.8 mt-10 -74.94 -50.39 16.9 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 114.396 -1.274 . . . . 0.0 112.505 -179.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . 1.521 ' HG2' ' CB ' ' A' ' 136' ' ' GLN . 54.5 mt-30 -71.89 -19.68 61.9 Favored 'General case' 0 C--O 1.203 -1.361 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 173.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 1.433 ' CG ' ' CE1' ' A' ' 137' ' ' PHE . 6.4 t80 -113.11 127.56 56.24 Favored 'General case' 0 C--O 1.161 -3.572 0 CA-C-N 120.008 1.276 . . . . 0.0 110.882 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ILE . . . . . 0.991 HD11 ' CD1' ' A' ' 138' ' ' ILE . 2.6 pp -117.27 133.08 23.23 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 125.376 1.47 . . . . 0.0 107.95 169.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -76.6 173.24 14.8 Favored 'Trans proline' 0 C--O 1.203 -1.235 0 C-N-CA 123.434 2.756 . . . . 0.0 115.36 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 1.61 ' HG2' ' CB ' ' A' ' 140' ' ' LYS . 42.5 tttt -74.19 108.21 6.85 Favored 'General case' 0 C--O 1.194 -1.817 0 C-N-CA 123.898 0.879 . . . . 0.0 109.5 178.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.931 ' HA2' ' CE ' ' A' ' 144' ' ' LYS . . . 116.99 0.93 19.4 Favored Glycine 1 C--O 1.164 -4.234 0 N-CA-C 117.789 1.876 . . . . 0.0 117.789 -172.881 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 1.241 ' SG ' ' SG ' ' A' ' 129' ' ' CYS . 52.6 t -74.32 -68.42 0.53 Allowed 'General case' 1 C--O 1.119 -5.763 0 CA-C-N 121.053 2.426 . . . . 0.0 113.456 175.374 -179.896 110.873 57.491 140.399 1.242 137.032 -64.901 -67.985 3 3 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' SER . . . . . 1.294 ' HB2' ' CA ' ' A' ' 143' ' ' SER . 2.0 p -106.74 92.9 4.29 Favored 'General case' 4 C--O 1.0 -12.028 0 N-CA-C 103.39 -2.819 . . . . 0.0 103.39 174.857 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . 1.651 ' HB3' ' CG ' ' A' ' 144' ' ' LYS 0.42 15.0 tttt . . . . . 4 C--O 0.539 -36.322 1 CA-C-O 150.225 14.345 . . . . 0.0 111.372 -176.381 . . . . . . . . 4 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ACE . . . . . . . . . . . . . . . . . . . . 1 C--O 0.882 -18.252 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.281 25.3 pttt -100.83 129.95 46.77 Favored 'General case' 4 N--CA 1.112 -17.328 0 C-N-CA 126.628 1.971 . . . . 0.0 110.512 . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' CYS . . . . . 1.241 ' SG ' ' SG ' ' A' ' 142' ' ' CYS 0.278 88.1 m -76.26 -60.94 2.12 Favored 'General case' 3 N--CA 1.22 -11.935 0 C-N-CA 123.996 0.918 . . . . 0.0 109.312 179.732 -67.985 -64.901 57.491 137.032 1.242 140.399 110.873 -179.896 4 3 . 1 . 001 nuclear build full ' A' A ' 130' ' ' THR . . . . . 1.377 ' CG2' ' CA ' ' A' ' 130' ' ' THR . 4.0 p -95.96 115.17 27.03 Favored 'General case' 3 C--O 1.045 -9.669 0 O-C-N 117.653 -3.154 . . . . 0.0 112.519 175.872 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . 0.383 0.4 OUTLIER -83.31 -76.22 0.29 Allowed 'General case' 4 C--O 0.97 -13.638 0 N-CA-C 121.28 3.808 . . . . 0.0 121.28 178.521 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 1.208 ' CG ' ' CA ' ' A' ' 132' ' ' ASP 0.263 0.6 OUTLIER -103.61 -72.12 0.71 Allowed 'General case' 4 C--O 0.943 -15.074 3 O-C-N 112.609 -6.307 . . . . 0.0 97.235 171.715 . . . . . . . . 6 4 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 1.072 ' O ' ' HG2' ' A' ' 133' ' ' GLN 0.466 48.5 tt0 -153.08 85.78 1.23 Allowed 'General case' 4 N--CA 1.274 -9.239 3 N-CA-C 123.372 4.582 . . . . 0.0 123.372 169.967 . . . . . . . . 5 3 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 1.253 ' OD1' ' CB ' ' A' ' 134' ' ' ASP . 1.3 m-20 -123.12 84.47 2.27 Favored 'General case' 1 N--CA 1.358 -5.065 0 O-C-N 124.708 1.255 . . . . 0.0 108.922 -178.004 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 1.102 ' OE2' ' CG ' ' A' ' 135' ' ' GLU . 44.8 mt-10 -74.94 -50.39 16.9 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 114.396 -1.274 . . . . 0.0 112.505 -179.494 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLN . . . . . 1.444 ' NE2' ' CG ' ' A' ' 136' ' ' GLN . 54.5 mt-30 -71.89 -19.68 61.9 Favored 'General case' 0 C--O 1.203 -1.361 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 173.275 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 1.433 ' CG ' ' CE1' ' A' ' 137' ' ' PHE . 6.4 t80 -113.11 127.56 56.24 Favored 'General case' 0 C--O 1.161 -3.572 0 CA-C-N 120.008 1.276 . . . . 0.0 110.882 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 2.6 pp -117.27 133.08 23.23 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 125.376 1.47 . . . . 0.0 107.95 169.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -76.6 173.24 14.8 Favored 'Trans proline' 0 C--O 1.203 -1.235 0 C-N-CA 123.434 2.756 . . . . 0.0 115.36 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 1.43 ' NZ ' ' CD ' ' A' ' 140' ' ' LYS . 42.5 tttt -74.19 108.21 6.85 Favored 'General case' 0 C--O 1.194 -1.817 0 C-N-CA 123.898 0.879 . . . . 0.0 109.5 178.13 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 1.067 ' HA2' ' HD2' ' A' ' 144' ' ' LYS . . . 116.99 0.93 19.4 Favored Glycine 1 C--O 1.164 -4.234 0 N-CA-C 117.789 1.876 . . . . 0.0 117.789 -172.881 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 1.241 ' SG ' ' SG ' ' A' ' 129' ' ' CYS . 52.6 t -74.32 -68.42 0.53 Allowed 'General case' 1 C--O 1.119 -5.763 0 CA-C-N 121.053 2.426 . . . . 0.0 113.456 175.374 -179.896 110.873 57.491 140.399 1.242 137.032 -64.901 -67.985 3 3 . 1 . 001 nuclear build full ' A' A ' 143' ' ' SER . . . . . 1.265 ' OG ' ' CA ' ' A' ' 143' ' ' SER . 2.0 p -106.74 92.9 4.29 Favored 'General case' 4 C--O 1.0 -12.028 0 N-CA-C 103.39 -2.819 . . . . 0.0 103.39 174.857 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 144' ' ' LYS . . . . . 1.562 ' CG ' ' CE ' ' A' ' 144' ' ' LYS 0.42 15.0 tttt . . . . . 4 C--O 0.539 -36.322 1 CA-C-O 150.225 14.345 . . . . 0.0 111.372 -176.381 . . . . . . . . 4 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ACE . . . . . . . . . . . . . . . . . . . . 1 C--O 0.882 -18.252 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . 0.281 25.3 pttt -100.83 129.95 46.77 Favored 'General case' 4 N--CA 1.112 -17.328 0 C-N-CA 126.628 1.971 . . . . 0.0 110.512 . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . 1.241 ' SG ' ' SG ' ' A' ' 142' ' ' CYS 0.278 88.1 m -76.26 -60.94 2.12 Favored 'General case' 3 N--CA 1.22 -11.935 0 C-N-CA 123.996 0.918 . . . . 0.0 109.312 179.732 -67.985 -64.901 57.491 137.032 1.242 140.399 110.873 -179.896 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . 1.377 ' CG2' ' CA ' ' A' ' 130' ' ' THR . 4.0 p -95.96 115.17 27.03 Favored 'General case' 3 C--O 1.045 -9.669 0 O-C-N 117.653 -3.154 . . . . 0.0 112.519 175.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . 0.383 0.4 OUTLIER -83.31 -76.22 0.29 Allowed 'General case' 4 C--O 0.97 -13.638 0 N-CA-C 121.28 3.808 . . . . 0.0 121.28 178.521 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 1.208 ' CG ' ' CA ' ' A' ' 132' ' ' ASP 0.263 0.6 OUTLIER -103.61 -72.12 0.71 Allowed 'General case' 4 C--O 0.943 -15.074 3 O-C-N 112.609 -6.307 . . . . 0.0 97.235 171.715 . . . . . . . . 6 4 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 1.072 ' O ' ' HG2' ' A' ' 133' ' ' GLN 0.466 48.5 tt0 -153.08 85.78 1.23 Allowed 'General case' 4 N--CA 1.274 -9.239 3 N-CA-C 123.372 4.582 . . . . 0.0 123.372 169.967 . . . . . . . . 5 3 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 1.253 ' OD1' ' CB ' ' A' ' 134' ' ' ASP . 1.3 m-20 -123.12 84.47 2.27 Favored 'General case' 1 N--CA 1.358 -5.065 0 O-C-N 124.708 1.255 . . . . 0.0 108.922 -178.004 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 1.102 ' OE2' ' CG ' ' A' ' 135' ' ' GLU . 44.8 mt-10 -74.94 -50.39 16.9 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 114.396 -1.274 . . . . 0.0 112.505 -179.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . 1.444 ' NE2' ' CG ' ' A' ' 136' ' ' GLN . 54.5 mt-30 -71.89 -19.68 61.9 Favored 'General case' 0 C--O 1.203 -1.361 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 173.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 1.433 ' CG ' ' CE1' ' A' ' 137' ' ' PHE . 6.4 t80 -113.11 127.56 56.24 Favored 'General case' 0 C--O 1.161 -3.572 0 CA-C-N 120.008 1.276 . . . . 0.0 110.882 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 2.6 pp -117.27 133.08 23.23 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 125.376 1.47 . . . . 0.0 107.95 169.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -76.6 173.24 14.8 Favored 'Trans proline' 0 C--O 1.203 -1.235 0 C-N-CA 123.434 2.756 . . . . 0.0 115.36 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 1.43 ' NZ ' ' CD ' ' A' ' 140' ' ' LYS . 42.5 tttt -74.19 108.21 6.85 Favored 'General case' 0 C--O 1.194 -1.817 0 C-N-CA 123.898 0.879 . . . . 0.0 109.5 178.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 1.067 ' HA2' ' HD2' ' A' ' 144' ' ' LYS . . . 116.99 0.93 19.4 Favored Glycine 1 C--O 1.164 -4.234 0 N-CA-C 117.789 1.876 . . . . 0.0 117.789 -172.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 1.241 ' SG ' ' SG ' ' A' ' 129' ' ' CYS . 52.6 t -74.32 -68.42 0.53 Allowed 'General case' 1 C--O 1.119 -5.763 0 CA-C-N 121.053 2.426 . . . . 0.0 113.456 175.374 -179.896 110.873 57.491 140.399 1.242 137.032 -64.901 -67.985 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . 1.265 ' OG ' ' CA ' ' A' ' 143' ' ' SER . 2.0 p -106.74 92.9 4.29 Favored 'General case' 4 C--O 1.0 -12.028 0 N-CA-C 103.39 -2.819 . . . . 0.0 103.39 174.857 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . 1.562 ' CG ' ' CE ' ' A' ' 144' ' ' LYS 0.42 15.0 tttt . . . . . 4 C--O 0.539 -36.322 1 CA-C-O 150.225 14.345 . . . . 0.0 111.372 -176.381 . . . . . . . . 4 2 . 1 stop_ save_