data_1etl_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 1etl _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 ' 5' ' ' MPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 96.6 m . . . . . 0 N--CA 1.437 -1.078 0 N-CA-C 116.553 2.057 . . . . 0.08 116.553 . -69.748 -60.335 -77.231 103.4 2.03 102.688 -81.507 -69.984 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.4 pm0 -61.98 -18.22 59.7 Favored 'General case' 0 C--N 1.402 2.883 0 C-N-CA 118.681 -1.207 . . . . 0.11 113.959 172.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 63.2 mt -108.05 15.87 23.9 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.671 0.788 . . . . 0.21 111.3 176.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 91.8 m 45.88 48.22 12.12 Favored 'General case' 0 C--N 1.366 1.322 0 O-C-N 120.797 -1.19 . . . . 0.07 111.631 -174.245 -70.127 -52.662 -78.613 103.211 2.035 106.559 -93.265 -60.389 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 20.7 p -74.78 -13.46 60.59 Favored 'General case' 0 C--O 1.245 0.821 0 O-C-N 120.322 -1.486 . . . . 0.07 113.828 -171.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASN . . . . . 0.41 ' HA ' ' HD3' ' A' ' 12' ' ' PRO . 22.0 t-20 -140.57 140.49 22.6 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 106.477 -1.675 . . . . 0.1 106.477 -178.637 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 11' ' ' ASN . 14.0 Cg_exo -68.99 -13.98 37.64 Favored 'Trans proline' 0 CA--C 1.505 -0.973 0 N-CA-C 114.36 0.869 . . . . 0.27 114.36 -176.75 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -83.63 -5.05 88.68 Favored Glycine 0 N--CA 1.432 -1.572 0 CA-C-O 115.886 -2.619 . . . . 0.1 114.0 175.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.6 m -61.92 133.24 55.16 Favored 'General case' 0 C--N 1.264 -3.126 0 CA-C-N 119.752 1.776 . . . . 0.08 110.066 177.531 -69.984 -81.507 -77.231 102.688 2.03 103.4 -60.335 -69.748 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.58 131.16 48.13 Favored 'General case' 0 CA--C 1.598 2.815 0 CA-C-O 115.898 -2.001 . . . . 0.19 110.153 -179.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.28 -13.37 67.77 Favored Glycine 0 C--N 1.291 -1.918 1 C-N-CA 109.594 -6.051 . . . . 0.15 116.219 -175.231 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 80.3 m . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 115.949 -1.977 . . . . 0.16 108.063 174.908 -60.389 -93.265 -78.613 106.559 2.035 103.211 -52.662 -70.127 0 0 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' MPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 96.6 m . . . . . 0 N--CA 1.437 -1.078 0 N-CA-C 116.553 2.057 . . . . 0.08 116.553 . -69.748 -60.335 -77.231 103.4 2.03 102.688 -81.507 -69.984 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.4 pm0 -61.98 -18.22 59.7 Favored 'General case' 0 C--N 1.402 2.883 0 C-N-CA 118.681 -1.207 . . . . 0.1 113.959 172.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 63.2 mt -108.05 15.87 23.9 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.671 0.788 . . . . 0.21 111.3 176.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 91.8 m 45.88 48.22 12.12 Favored 'General case' 0 C--N 1.366 1.322 0 O-C-N 120.797 -1.19 . . . . 0.07 111.631 -174.245 -70.127 -52.662 -78.613 103.211 2.035 106.559 -93.265 -60.389 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 20.7 p -74.78 -13.46 60.59 Favored 'General case' 0 C--O 1.245 0.821 0 O-C-N 120.322 -1.486 . . . . 0.07 113.828 -171.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -140.57 140.49 22.6 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 106.477 -1.675 . . . . 0.09 106.477 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -68.99 -13.98 37.64 Favored 'Trans proline' 0 CA--C 1.505 -0.973 0 N-CA-C 114.36 0.869 . . . . 0.27 114.36 -176.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -83.63 -5.05 88.68 Favored Glycine 0 N--CA 1.432 -1.572 0 CA-C-O 115.886 -2.619 . . . . 0.1 114.0 175.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.6 m -61.92 133.24 55.16 Favored 'General case' 0 C--N 1.264 -3.126 0 CA-C-N 119.752 1.776 . . . . 0.08 110.066 177.531 -69.984 -81.507 -77.231 102.688 2.03 103.4 -60.335 -69.748 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.58 131.16 48.13 Favored 'General case' 0 CA--C 1.598 2.815 0 CA-C-O 115.898 -2.001 . . . . 0.19 110.153 -179.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.28 -13.37 67.77 Favored Glycine 0 C--N 1.291 -1.918 1 C-N-CA 109.594 -6.051 . . . . 0.15 116.219 -175.231 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 80.3 m . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 115.949 -1.977 . . . . 0.16 108.063 174.908 -60.389 -93.265 -78.613 106.559 2.035 103.211 -52.662 -70.127 0 0 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' MPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 96.6 m . . . . . 0 N--CA 1.437 -1.078 0 N-CA-C 116.553 2.057 . . . . 0.08 116.553 . -69.748 -60.335 -77.231 103.4 2.03 102.688 -81.507 -69.984 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.4 pm0 -61.98 -18.22 59.7 Favored 'General case' 0 C--N 1.402 2.883 0 C-N-CA 118.681 -1.207 . . . . 0.1 113.959 172.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 63.2 mt -108.05 15.87 23.9 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.671 0.788 . . . . 0.21 111.3 176.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 91.8 m 45.88 48.22 12.12 Favored 'General case' 0 C--N 1.366 1.322 0 O-C-N 120.797 -1.19 . . . . 0.07 111.631 -174.245 -70.127 -52.662 -78.613 103.211 2.035 106.559 -93.265 -60.389 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 20.7 p -74.78 -13.46 60.59 Favored 'General case' 0 C--O 1.245 0.821 0 O-C-N 120.322 -1.486 . . . . 0.07 113.828 -171.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -140.57 140.49 22.6 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 106.477 -1.675 . . . . 0.09 106.477 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -68.99 -13.98 37.64 Favored 'Trans proline' 0 CA--C 1.505 -0.973 0 N-CA-C 114.36 0.869 . . . . 0.27 114.36 -176.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -83.63 -5.05 88.68 Favored Glycine 0 N--CA 1.432 -1.572 0 CA-C-O 115.886 -2.619 . . . . 0.1 114.0 175.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.6 m -61.92 133.24 55.16 Favored 'General case' 0 C--N 1.264 -3.126 0 CA-C-N 119.752 1.776 . . . . 0.08 110.066 177.531 -69.984 -81.507 -77.231 102.688 2.03 103.4 -60.335 -69.748 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.58 131.16 48.13 Favored 'General case' 0 CA--C 1.598 2.815 0 CA-C-O 115.898 -2.001 . . . . 0.19 110.153 -179.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.28 -13.37 67.77 Favored Glycine 0 C--N 1.291 -1.918 1 C-N-CA 109.594 -6.051 . . . . 0.15 116.219 -175.231 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 80.3 m . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 115.949 -1.977 . . . . 0.16 108.063 174.908 -60.389 -93.265 -78.613 106.559 2.035 103.211 -52.662 -70.127 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_