data_4g13_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 4g13 _Structure_validation_residue.Date_analyzed 2016-10-12 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 ecloud orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.199 -1.57 . . . . . . . . 7.99 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 29.3 p90 -125.94 -5.69 6.8 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 114.471 1.286 . . . . 9.26 114.471 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.481 0 CA-C-N 120.863 1.665 . . . . 7.04 109.084 179.839 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 C--N 1.351 0.669 0 CA-C-N 115.929 -0.578 . . . . 7.69 109.858 -173.095 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.817 0 CA-C-O 122.637 1.208 . . . . 9.74 108.474 -175.465 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.267 65.2 t -77.62 -41.11 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.548 0 CA-C-O 121.657 0.741 . . . . 12.0 111.741 -178.04 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -62.32 -39.31 97.57 Favored Glycine 0 C--N 1.355 1.605 0 C-N-CA 119.062 -1.542 . . . . 6.14 115.458 -175.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 58.4 mt -72.58 -36.19 68.1 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 119.487 -0.885 . . . . 11.61 111.945 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.617 0 C-N-CA 125.03 1.332 . . . . 6.09 110.179 176.747 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 N-CA-C 112.379 0.511 . . . . 5.68 112.379 -157.443 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.5 mm-40 -87.23 -10.92 51.27 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 112.939 0.718 . . . . 5.14 112.939 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' DIV . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.312 0 CA-C-N 119.042 0.837 . . . . 6.45 109.32 171.14 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' PHL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.199 -1.57 . . . . . . . . 6.3600000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 29.3 p90 -125.94 -5.69 6.8 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 114.471 1.286 . . . . 7.71 114.471 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.481 0 CA-C-N 120.863 1.665 . . . . 4.7000000000000002 109.084 179.839 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 C--N 1.351 0.669 0 CA-C-N 115.929 -0.578 . . . . 5.1299999999999999 109.858 -173.095 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.817 0 CA-C-O 122.637 1.208 . . . . 6.4900000000000002 108.474 -175.465 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.267 65.2 t -77.62 -41.11 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.548 0 CA-C-O 121.657 0.741 . . . . 8.0 111.741 -178.04 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -62.32 -39.31 97.57 Favored Glycine 0 C--N 1.355 1.605 0 C-N-CA 119.062 -1.542 . . . . 5.1200000000000001 115.458 -175.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 58.4 mt -72.58 -36.19 68.1 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 119.487 -0.885 . . . . 7.7400000000000002 111.945 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.617 0 C-N-CA 125.03 1.332 . . . . 4.0599999999999996 110.179 176.747 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 N-CA-C 112.379 0.511 . . . . 3.79 112.379 -157.443 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.5 mm-40 -87.23 -10.92 51.27 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 112.939 0.718 . . . . 4.8700000000000001 112.939 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' DIV . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.312 0 CA-C-N 119.042 0.837 . . . . 4.2999999999999998 109.32 171.14 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 15' ' ' PHL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.199 -1.57 . . . . . . . . 6.3600000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 29.3 p90 -125.94 -5.69 6.8 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 114.471 1.286 . . . . 7.71 114.471 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.481 0 CA-C-N 120.863 1.665 . . . . 4.7000000000000002 109.084 179.839 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 C--N 1.351 0.669 0 CA-C-N 115.929 -0.578 . . . . 5.1299999999999999 109.858 -173.095 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.817 0 CA-C-O 122.637 1.208 . . . . 6.4900000000000002 108.474 -175.465 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.267 65.2 t -77.62 -41.11 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.548 0 CA-C-O 121.657 0.741 . . . . 8.0 111.741 -178.04 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -62.32 -39.31 97.57 Favored Glycine 0 C--N 1.355 1.605 0 C-N-CA 119.062 -1.542 . . . . 5.1200000000000001 115.458 -175.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 58.4 mt -72.58 -36.19 68.1 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 119.487 -0.885 . . . . 7.7400000000000002 111.945 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.617 0 C-N-CA 125.03 1.332 . . . . 4.0599999999999996 110.179 176.747 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 N-CA-C 112.379 0.511 . . . . 3.79 112.379 -157.443 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.5 mm-40 -87.23 -10.92 51.27 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 112.939 0.718 . . . . 4.8700000000000001 112.939 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' DIV . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.312 0 CA-C-N 119.042 0.837 . . . . 4.2999999999999998 109.32 171.14 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' PHL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_