data_3nve_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 3nve _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 ' 1' ' ' MET . . . . . . . . . . . . . 8.4 tmm? . . . . . 0 CA--C 1.566 1.583 0 N-CA-C 112.131 0.419 . . . . 39.509999999999998 112.131 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 75.8 mtp -128.91 115.34 17.7 Favored 'General case' 0 C--O 1.19 -2.029 0 C-N-CA 124.347 1.059 . . . . 28.18 112.051 176.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -117.32 128.04 54.66 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 122.676 1.227 . . . . 21.640000000000001 112.372 176.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -117.49 115.69 25.66 Favored 'General case' 0 C--O 1.203 -1.355 0 CA-C-N 112.9 -1.955 . . . . 20.640000000000001 112.812 176.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -141.71 -175.3 15.09 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 117.343 1.697 . . . . 20.199999999999999 117.343 -175.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 . . . . . 0 N--CA 1.482 1.173 0 C-N-CA 125.068 1.347 . . . . 29.48 113.38 175.47 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.6 tmm? . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 107.738 -1.208 . . . . 27.43 107.738 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 61.9 mtm -139.77 134.48 31.88 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 107.572 -1.27 . . . . 24.350000000000001 107.572 172.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' HIS . . . . . . . . . . . . . 31.2 t60 -126.02 114.28 18.24 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.879 -1.055 . . . . 21.039999999999999 109.802 173.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 3.9 m-30 -108.28 116.13 31.4 Favored 'General case' 0 C--O 1.263 1.814 0 CA-C-O 121.686 0.755 . . . . 24.07 110.345 171.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . -150.8 -170.43 17.86 Favored Glycine 0 C--O 1.18 -3.23 0 C-N-CA 119.745 -1.216 . . . . 22.370000000000001 113.537 -173.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 106.607 -1.627 . . . . 29.48 106.607 -178.216 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.4 tmm? . . . . . 0 CA--C 1.566 1.583 0 N-CA-C 112.131 0.419 . . . . 39.51 112.131 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 75.8 mtp -128.91 115.34 17.7 Favored 'General case' 0 C--O 1.19 -2.029 0 C-N-CA 124.347 1.059 . . . . 28.18 112.051 176.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -117.32 128.04 54.66 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 122.676 1.227 . . . . 21.64 112.372 176.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -117.49 115.69 25.66 Favored 'General case' 0 C--O 1.203 -1.355 0 CA-C-N 112.9 -1.955 . . . . 20.64 112.812 176.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -141.71 -175.3 15.09 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 117.343 1.697 . . . . 20.2 117.343 -175.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 . . . . . 0 N--CA 1.482 1.173 0 C-N-CA 125.068 1.347 . . . . 29.48 113.38 175.47 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.6 tmm? . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 107.738 -1.208 . . . . 27.43 107.738 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 61.9 mtm -139.77 134.48 31.88 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 107.572 -1.27 . . . . 24.35 107.572 172.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' HIS . . . . . . . . . . . . . 31.2 t60 -126.02 114.28 18.24 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.879 -1.055 . . . . 21.04 109.802 173.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 3.9 m-30 -108.28 116.13 31.4 Favored 'General case' 0 C--O 1.263 1.814 0 CA-C-O 121.686 0.755 . . . . 24.07 110.345 171.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . -150.8 -170.43 17.86 Favored Glycine 0 C--O 1.18 -3.23 0 C-N-CA 119.745 -1.216 . . . . 22.37 113.537 -173.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 106.607 -1.627 . . . . 29.48 106.607 -178.216 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.4 tmm? . . . . . 0 CA--C 1.566 1.583 0 N-CA-C 112.131 0.419 . . . . 39.51 112.131 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 75.8 mtp -128.91 115.34 17.7 Favored 'General case' 0 C--O 1.19 -2.029 0 C-N-CA 124.347 1.059 . . . . 28.18 112.051 176.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -117.32 128.04 54.66 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 122.676 1.227 . . . . 21.64 112.372 176.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -117.49 115.69 25.66 Favored 'General case' 0 C--O 1.203 -1.355 0 CA-C-N 112.9 -1.955 . . . . 20.64 112.812 176.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -141.71 -175.3 15.09 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 117.343 1.697 . . . . 20.2 117.343 -175.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 . . . . . 0 N--CA 1.482 1.173 0 C-N-CA 125.068 1.347 . . . . 29.48 113.38 175.47 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.6 tmm? . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 107.738 -1.208 . . . . 27.43 107.738 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 61.9 mtm -139.77 134.48 31.88 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 107.572 -1.27 . . . . 24.35 107.572 172.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' HIS . . . . . . . . . . . . . 31.2 t60 -126.02 114.28 18.24 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.879 -1.055 . . . . 21.04 109.802 173.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 3.9 m-30 -108.28 116.13 31.4 Favored 'General case' 0 C--O 1.263 1.814 0 CA-C-O 121.686 0.755 . . . . 24.07 110.345 171.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . -150.8 -170.43 17.86 Favored Glycine 0 C--O 1.18 -3.23 0 C-N-CA 119.745 -1.216 . . . . 22.37 113.537 -173.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 106.607 -1.627 . . . . 29.48 106.607 -178.216 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_