data_3ovj_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 3ovj _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' ' ' LYS . . . . . . . . . . . . . 54.8 tttt . . . . . 0 N--CA 1.494 1.769 0 N-CA-C 108.982 -0.747 . . . . 26.35 108.982 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 21.7 tp -112.61 129.8 56.25 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.218 0.607 . . . . 15.58 111.036 175.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.8 t -127.9 126.54 66.8 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 N-CA-C 107.515 -1.291 . . . . 9.9 107.515 169.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -137.71 112.97 9.26 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.883 0.873 . . . . 21.64 111.011 -174.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -108.67 127.05 53.64 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 107.857 -1.164 . . . . 31.0 107.857 173.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 111.879 0.325 . . . . 22.76 111.879 179.903 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' LYS . . . . . 0.496 ' NZ ' ' O6 ' ' B' ' 49' ' ' ORA . 26.9 tttt . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 110.234 -0.284 . . . . 25.76 110.234 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 7.0 tt -129.56 130.31 45.57 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.227 0.611 . . . . 17.59 110.237 177.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 47.1 t -126.21 126.1 68.85 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 N-CA-C 109.419 -0.586 . . . . 9.46 109.419 171.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -122.83 137.2 55.0 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.625 0.77 . . . . 9.69 109.68 172.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -149.14 127.48 12.19 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.519 0.563 . . . . 19.57 112.519 172.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.451 0 CA-C-O 118.605 -0.712 . . . . 20.69 111.304 177.906 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' LYS . . . . . 0.528 ' NZ ' ' O6 ' ' B' ' 49' ' ' ORA . 19.1 tttt . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 108.728 -0.841 . . . . 24.06 108.728 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 42.8 tp -112.54 130.13 56.12 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.372 0.669 . . . . 11.6 112.319 177.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' VAL . . . . . . . . . . . . . 35.6 t -126.29 127.4 70.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 108.873 -0.788 . . . . 11.28 108.873 166.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -134.49 119.24 18.25 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.825 1.25 . . . . 18.98 107.969 -175.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -115.59 123.85 49.49 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.38 -0.97 . . . . 28.16 108.38 173.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.845 0 CA-C-O 121.772 0.796 . . . . 21.29 112.786 -179.112 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' LYS . . . . . . . . . . . . . 6.4 ttmt . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 108.694 -0.854 . . . . 29.12 108.694 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' LEU . . . . . . . . . . . . . 8.7 tt -129.43 130.0 45.38 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 123.756 0.66 . . . . 18.28 110.929 175.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' VAL . . . . . . . . . . . . . 60.8 t -129.39 125.48 61.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 N-CA-C 109.409 -0.589 . . . . 9.98 109.409 174.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -127.58 133.35 49.74 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.047 0.939 . . . . 11.01 109.798 176.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -144.99 128.65 17.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.959 -0.564 . . . . 21.89 112.387 173.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.523 0 CA-C-N 115.82 -0.627 . . . . 21.13 111.365 178.101 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ORA . . . . . 0.528 ' O6 ' ' NZ ' ' C' ' 1' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 50' ' ' ORA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 54.8 tttt . . . . . 0 N--CA 1.494 1.769 0 N-CA-C 108.982 -0.747 . . . . 26.350000000000001 108.982 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 21.7 tp -112.61 129.8 56.25 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.218 0.607 . . . . 15.58 111.036 175.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.8 t -127.9 126.54 66.8 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 N-CA-C 107.515 -1.291 . . . . 9.9000000000000004 107.515 169.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PHE . . . . . 0.542 ' CZ ' ' HB2' ' A' ' 6' ' ' ALA . 14.4 t80 -137.71 112.97 9.26 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.883 0.873 . . . . 21.640000000000001 111.011 -174.614 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -108.67 127.05 53.64 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 107.857 -1.164 . . . . 31.0 107.857 173.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ALA . . . . . 0.542 ' HB2' ' CZ ' ' A' ' 4' ' ' PHE . . . . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 111.879 0.325 . . . . 22.760000000000002 111.879 179.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 1' ' ' LYS . . . . . 0.49 ' NZ ' ' O6 ' ' B' ' 49' ' ' ORA . 26.9 tttt . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 110.234 -0.284 . . . . 25.760000000000002 110.234 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 7.0 tt -129.56 130.31 45.57 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.227 0.611 . . . . 17.59 110.237 177.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 47.1 t -126.21 126.1 68.85 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 N-CA-C 109.419 -0.586 . . . . 9.4600000000000009 109.419 171.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -122.83 137.2 55.0 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.625 0.77 . . . . 9.6899999999999995 109.68 172.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -149.14 127.48 12.19 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.519 0.563 . . . . 19.57 112.519 172.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.451 0 CA-C-O 118.605 -0.712 . . . . 20.690000000000001 111.304 177.906 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 1' ' ' LYS . . . . . . . . . . . . . 19.1 tttt . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 108.728 -0.841 . . . . 24.059999999999999 108.728 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 42.8 tp -112.54 130.13 56.12 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.372 0.669 . . . . 11.6 112.319 177.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' VAL . . . . . . . . . . . . . 35.6 t -126.29 127.4 70.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 108.873 -0.788 . . . . 11.279999999999999 108.873 166.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' PHE . . . . . 0.577 ' CZ ' ' HB2' ' C' ' 6' ' ' ALA . 7.5 t80 -134.49 119.24 18.25 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.825 1.25 . . . . 18.98 107.969 -175.796 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 5' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -115.59 123.85 49.49 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.38 -0.97 . . . . 28.16 108.38 173.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' ALA . . . . . 0.577 ' HB2' ' CZ ' ' C' ' 4' ' ' PHE . . . . . . . . 0 N--CA 1.476 0.845 0 CA-C-O 121.772 0.796 . . . . 21.289999999999999 112.786 -179.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 1' ' ' LYS . . . . . . . . . . . . . 6.4 ttmt . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 108.694 -0.854 . . . . 29.120000000000001 108.694 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 2' ' ' LEU . . . . . 0.418 HD23 ' C ' ' D' ' 2' ' ' LEU . 8.7 tt -129.43 130.0 45.38 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 123.756 0.66 . . . . 18.280000000000001 110.929 175.652 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 3' ' ' VAL . . . . . . . . . . . . . 60.8 t -129.39 125.48 61.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 N-CA-C 109.409 -0.589 . . . . 9.9800000000000004 109.409 174.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 4' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -127.58 133.35 49.74 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.047 0.939 . . . . 11.01 109.798 176.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 5' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -144.99 128.65 17.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.959 -0.564 . . . . 21.890000000000001 112.387 173.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.523 0 CA-C-N 115.82 -0.627 . . . . 21.129999999999999 111.365 178.101 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ORA . . . . . 0.49 ' O6 ' ' NZ ' ' B' ' 1' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 50' ' ' ORA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 54.8 tttt . . . . . 0 N--CA 1.494 1.769 0 N-CA-C 108.982 -0.747 . . . . 26.350000000000001 108.982 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 21.7 tp -112.61 129.8 56.25 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.218 0.607 . . . . 15.58 111.036 175.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.8 t -127.9 126.54 66.8 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 N-CA-C 107.515 -1.291 . . . . 9.9000000000000004 107.515 169.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.542 ' CZ ' ' HB2' ' A' ' 6' ' ' ALA . 14.4 t80 -137.71 112.97 9.26 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.883 0.873 . . . . 21.640000000000001 111.011 -174.614 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -108.67 127.05 53.64 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 107.857 -1.164 . . . . 31.0 107.857 173.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.542 ' HB2' ' CZ ' ' A' ' 4' ' ' PHE . . . . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 111.879 0.325 . . . . 22.760000000000002 111.879 179.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' LYS . . . . . 0.49 ' NZ ' ' O6 ' ' B' ' 49' ' ' ORA . 26.9 tttt . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 110.234 -0.284 . . . . 25.760000000000002 110.234 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 7.0 tt -129.56 130.31 45.57 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.227 0.611 . . . . 17.59 110.237 177.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 47.1 t -126.21 126.1 68.85 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 N-CA-C 109.419 -0.586 . . . . 9.4600000000000009 109.419 171.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -122.83 137.2 55.0 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.625 0.77 . . . . 9.6899999999999995 109.68 172.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -149.14 127.48 12.19 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.519 0.563 . . . . 19.57 112.519 172.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.451 0 CA-C-O 118.605 -0.712 . . . . 20.690000000000001 111.304 177.906 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' LYS . . . . . . . . . . . . . 19.1 tttt . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 108.728 -0.841 . . . . 24.059999999999999 108.728 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 42.8 tp -112.54 130.13 56.12 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.372 0.669 . . . . 11.6 112.319 177.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' VAL . . . . . . . . . . . . . 35.6 t -126.29 127.4 70.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 108.873 -0.788 . . . . 11.279999999999999 108.873 166.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' PHE . . . . . 0.577 ' CZ ' ' HB2' ' C' ' 6' ' ' ALA . 7.5 t80 -134.49 119.24 18.25 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.825 1.25 . . . . 18.98 107.969 -175.796 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -115.59 123.85 49.49 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.38 -0.97 . . . . 28.16 108.38 173.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' ALA . . . . . 0.577 ' HB2' ' CZ ' ' C' ' 4' ' ' PHE . . . . . . . . 0 N--CA 1.476 0.845 0 CA-C-O 121.772 0.796 . . . . 21.289999999999999 112.786 -179.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' LYS . . . . . . . . . . . . . 6.4 ttmt . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 108.694 -0.854 . . . . 29.120000000000001 108.694 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' LEU . . . . . 0.418 HD23 ' C ' ' D' ' 2' ' ' LEU . 8.7 tt -129.43 130.0 45.38 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 123.756 0.66 . . . . 18.280000000000001 110.929 175.652 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' VAL . . . . . . . . . . . . . 60.8 t -129.39 125.48 61.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 N-CA-C 109.409 -0.589 . . . . 9.9800000000000004 109.409 174.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -127.58 133.35 49.74 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.047 0.939 . . . . 11.01 109.798 176.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -144.99 128.65 17.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.959 -0.564 . . . . 21.890000000000001 112.387 173.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.523 0 CA-C-N 115.82 -0.627 . . . . 21.129999999999999 111.365 178.101 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ORA . . . . . 0.49 ' O6 ' ' NZ ' ' B' ' 1' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 50' ' ' ORA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_