data_3hex_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 3hex _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' ' ' XPC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -84.94 -37.99 19.87 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 113.401 -1.727 . . . . 43.109999999999999 114.18 179.979 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . . . -76.04 -47.6 24.14 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 107.348 -1.353 . . . . 38.259999999999998 107.348 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' XCP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 21.9 mt -54.63 -56.65 9.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 114.12 1.156 . . . . 34.229999999999997 114.12 179.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . . . -68.54 -28.78 67.28 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 119.214 0.916 . . . . 34.020000000000003 113.282 -172.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' B3D . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -72.32 -63.12 1.21 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.427 0.691 . . . . 29.66 109.824 179.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.7 mt -46.47 -40.97 13.27 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.474 0.916 . . . . 27.82 113.474 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' B3E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -61.12 -40.62 94.46 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 114.766 1.395 . . . . 33.329999999999998 114.766 -179.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ILE . . . . . 0.409 ' O ' ' HGA' ' A' ' 16' ' ' B3L . 3.7 mt -79.1 -41.61 23.22 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.262 0 C-N-CA 120.41 -0.516 . . . . 22.800000000000001 111.769 -176.399 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' B3L . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.0 t -69.02 -64.79 0.8 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 116.528 2.048 . . . . 25.629999999999999 116.528 -179.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.0 mmtt -64.75 -36.39 84.15 Favored 'General case' 0 C--O 1.207 -1.166 0 CA-C-O 119.276 -0.392 . . . . 28.93 111.807 -178.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' B3L . . . . . 0.409 ' HGA' ' O ' ' A' ' 12' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -41.52 -63.19 0.74 Allowed 'General case' 0 C--N 1.344 0.362 0 N-CA-C 115.184 1.55 . . . . 36.789999999999999 115.184 179.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -67.91 -48.68 65.32 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 119.398 -0.921 . . . . 38.740000000000002 112.873 -167.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' XCP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -43.58 -38.58 3.05 Favored 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 118.664 2.838 . . . . 43.780000000000001 118.664 -179.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -98.14 -39.62 8.8 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 117.523 2.416 . . . . 36.259999999999998 117.523 -169.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' B3E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.8 mt -51.44 -48.75 62.63 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 116.229 1.937 . . . . 33.289999999999999 116.229 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.02 -35.02 66.7 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.84 1.052 . . . . 32.799999999999997 113.84 -174.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' HMR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.7 mt -59.91 -63.11 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 CA-C-N 120.699 1.591 . . . . 31.379999999999999 109.999 141.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . . . -42.27 -40.14 2.33 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.18 1.178 . . . . 32.93 114.18 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' XPC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 27.9 mt -65.16 -18.07 65.0 Favored 'General case' 0 C--O 1.247 0.965 0 N-CA-C 114.738 1.385 . . . . 33.509999999999998 114.738 179.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 79.8 mt -115.0 -27.77 7.24 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 116.21 1.93 . . . . 32.549999999999997 116.21 -174.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' BAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' XPC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -84.94 -37.99 19.87 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 113.401 -1.727 . . . . 43.11 114.18 179.979 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . . . -76.04 -47.6 24.14 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 107.348 -1.353 . . . . 38.26 107.348 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' XCP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 21.9 mt -54.63 -56.65 9.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 114.12 1.156 . . . . 34.18 114.12 179.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . . . -68.54 -28.78 67.28 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 119.214 0.916 . . . . 34.02 113.282 -172.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' B3D . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -72.32 -63.12 1.21 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.427 0.691 . . . . 29.66 109.824 179.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.7 mt -46.47 -40.97 13.27 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.474 0.916 . . . . 27.82 113.474 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' B3E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -61.12 -40.62 94.46 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 114.766 1.395 . . . . 33.33 114.766 -179.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 3.7 mt -79.1 -41.61 23.22 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.262 0 C-N-CA 120.41 -0.516 . . . . 22.74 111.769 -176.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' B3L . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.0 t -69.02 -64.79 0.8 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 116.528 2.048 . . . . 25.53 116.528 -179.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.0 mmtt -64.75 -36.39 84.15 Favored 'General case' 0 C--O 1.207 -1.166 0 CA-C-O 119.276 -0.392 . . . . 28.93 111.807 -178.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' B3L . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -41.52 -63.19 0.74 Allowed 'General case' 0 C--N 1.344 0.362 0 N-CA-C 115.184 1.55 . . . . 36.79 115.184 179.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -67.91 -48.68 65.32 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 119.398 -0.921 . . . . 38.74 112.873 -167.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' XCP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -43.58 -38.58 3.05 Favored 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 118.664 2.838 . . . . 43.78 118.664 -179.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -98.14 -39.62 8.8 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 117.523 2.416 . . . . 36.26 117.523 -169.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' B3E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.8 mt -51.44 -48.75 62.63 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 116.229 1.937 . . . . 33.19 116.229 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.02 -35.02 66.7 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.84 1.052 . . . . 32.8 113.84 -174.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' HMR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.7 mt -59.91 -63.11 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 CA-C-N 120.699 1.591 . . . . 31.38 109.999 141.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . . . -42.27 -40.14 2.33 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.18 1.178 . . . . 32.93 114.18 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' XPC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 27.9 mt -65.16 -18.07 65.0 Favored 'General case' 0 C--O 1.247 0.965 0 N-CA-C 114.738 1.385 . . . . 33.51 114.738 179.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 79.8 mt -115.0 -27.77 7.24 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 116.21 1.93 . . . . 32.55 116.21 -174.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' BAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' XPC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -84.94 -37.99 19.87 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 113.401 -1.727 . . . . 43.109999999999999 114.18 179.979 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . . . -76.04 -47.6 24.14 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 107.348 -1.353 . . . . 38.259999999999998 107.348 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' XCP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 21.9 mt -54.63 -56.65 9.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 114.12 1.156 . . . . 34.18 114.12 179.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . . . -68.54 -28.78 67.28 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 119.214 0.916 . . . . 34.020000000000003 113.282 -172.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' B3D . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -72.32 -63.12 1.21 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.427 0.691 . . . . 29.66 109.824 179.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.7 mt -46.47 -40.97 13.27 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.474 0.916 . . . . 27.82 113.474 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' B3E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -61.12 -40.62 94.46 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 114.766 1.395 . . . . 33.329999999999998 114.766 -179.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 3.7 mt -79.1 -41.61 23.22 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.262 0 C-N-CA 120.41 -0.516 . . . . 22.739999999999998 111.769 -176.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' B3L . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.0 t -69.02 -64.79 0.8 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 116.528 2.048 . . . . 25.530000000000001 116.528 -179.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.0 mmtt -64.75 -36.39 84.15 Favored 'General case' 0 C--O 1.207 -1.166 0 CA-C-O 119.276 -0.392 . . . . 28.93 111.807 -178.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' B3L . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -41.52 -63.19 0.74 Allowed 'General case' 0 C--N 1.344 0.362 0 N-CA-C 115.184 1.55 . . . . 36.789999999999999 115.184 179.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -67.91 -48.68 65.32 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 119.398 -0.921 . . . . 38.740000000000002 112.873 -167.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' XCP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -43.58 -38.58 3.05 Favored 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 118.664 2.838 . . . . 43.780000000000001 118.664 -179.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -98.14 -39.62 8.8 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 117.523 2.416 . . . . 36.259999999999998 117.523 -169.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' B3E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.8 mt -51.44 -48.75 62.63 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 116.229 1.937 . . . . 33.189999999999998 116.229 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.02 -35.02 66.7 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.84 1.052 . . . . 32.799999999999997 113.84 -174.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' HMR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.7 mt -59.91 -63.11 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 CA-C-N 120.699 1.591 . . . . 31.379999999999999 109.999 141.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . . . -42.27 -40.14 2.33 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.18 1.178 . . . . 32.93 114.18 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' XPC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 27.9 mt -65.16 -18.07 65.0 Favored 'General case' 0 C--O 1.247 0.965 0 N-CA-C 114.738 1.385 . . . . 33.509999999999998 114.738 179.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 79.8 mt -115.0 -27.77 7.24 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 116.21 1.93 . . . . 32.549999999999997 116.21 -174.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' BAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_