data_3t4g_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 3t4g _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' ' ' ORN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . -141.09 158.37 44.01 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 115.0 -1.0 . . . . 40.350000000000001 112.935 -177.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ILE . . . . . 0.607 ' CG2' ' CM ' ' B' ' 14' ' ' MPD . 13.1 mt -76.92 124.37 35.18 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.133 0 O-C-N 124.609 1.193 . . . . 38.990000000000002 110.277 166.924 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 89.9 mt -123.37 134.54 65.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 106.41 -1.7 . . . . 29.539999999999999 106.41 -178.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -123.36 148.62 16.79 Favored Glycine 0 N--CA 1.428 -1.843 0 C-N-CA 126.829 2.157 . . . . 15.27 112.149 173.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 33.4 tp -131.6 133.44 44.99 Favored 'General case' 0 N--CA 1.424 -1.759 0 C-N-CA 124.584 1.153 . . . . 27.649999999999999 108.328 175.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 11.0 tmm? -120.56 124.87 46.38 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 105.275 -2.12 . . . . 30.66 105.275 -176.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' VAL . . . . . 0.444 ' O ' ' CG ' ' A' ' 8' ' ' ORN . 66.9 t . . . . . 0 C--N 1.312 -1.028 0 C-N-CA 118.364 -1.334 . . . . 25.530000000000001 108.219 176.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ORN . . . . . 0.444 ' CG ' ' O ' ' A' ' 7' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . . . -96.16 155.84 16.59 Favored 'General case' 0 C--O 1.202 -1.431 0 CA-C-O 122.983 1.373 . . . . 33.359999999999999 114.208 -178.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.0 t80 . . . . . 0 CA--C 1.485 -1.533 0 N-CA-C 107.726 -1.212 . . . . 26.579999999999998 107.726 -173.387 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' HAO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' 4BF . . . . . 1.038 ' CD1' ' C ' ' A' ' 12' ' ' 4BF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.541 0.629 0 CA-C-N 111.392 -2.64 . . . . 46.369999999999997 109.948 -171.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 0' ' ' ORN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . -161.09 173.15 15.6 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-O 122.789 1.281 . . . . 44.740000000000002 111.374 -177.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 35.1 mt -90.77 140.47 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 N-CA-C 104.56 -2.385 . . . . 42.32 104.56 -172.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 59.5 mt -127.97 131.96 69.1 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.47 0 N-CA-C 107.809 -1.182 . . . . 29.23 107.809 -175.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . -127.76 155.55 20.19 Favored Glycine 0 N--CA 1.415 -2.764 0 N-CA-C 116.729 1.452 . . . . 16.739999999999998 116.729 169.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 24.6 tp -133.45 133.96 42.95 Favored 'General case' 0 C--O 1.29 3.19 0 CA-C-O 122.767 1.27 . . . . 20.690000000000001 109.624 178.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -118.28 121.18 39.78 Favored 'General case' 0 N--CA 1.434 -1.275 0 N-CA-C 106.78 -1.563 . . . . 28.530000000000001 106.78 -175.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 42.3 t . . . . . 0 CA--C 1.557 1.242 0 C-N-CA 118.975 -1.09 . . . . 27.129999999999999 111.122 172.916 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ORN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.55 141.65 35.01 Favored 'General case' 0 CA--C 1.573 1.844 0 O-C-N 121.522 -0.737 . . . . 40.719999999999999 109.088 -178.7 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 66.3 t80 . . . . . 0 CA--C 1.485 -1.543 0 CA-C-O 118.657 -0.687 . . . . 26.48 111.234 -179.538 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' HAO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' 4BF . . . . . 0.583 ' C ' ' CD1' ' B' ' 12' ' ' 4BF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' LYS . . . . . . . . . . . . . 23.1 mmtt . . . . . 0 N--CA 1.493 1.677 0 CA-C-N 113.977 -1.465 . . . . 43.460000000000001 110.914 -167.194 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' MPD . . . . . 0.607 ' CM ' ' CG2' ' A' ' 2' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' MPD . . . . . 0.794 ' C1 ' ' C5 ' ' A' ' 15' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' MPD . . . . . 0.804 ' O4 ' ' CM ' ' B' ' 16' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 0' ' ' ORN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . -141.09 158.37 44.01 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 115.0 -1.0 . . . . 40.350000000000001 112.935 -177.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ILE . . . . . 0.934 HG21 ' CM ' ' B' ' 14' ' ' MPD . 13.1 mt -76.92 124.37 35.18 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.133 0 O-C-N 124.609 1.193 . . . . 38.990000000000002 110.277 166.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 89.9 mt -123.37 134.54 65.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 106.41 -1.7 . . . . 29.539999999999999 106.41 -178.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -123.36 148.62 16.79 Favored Glycine 0 N--CA 1.428 -1.843 0 C-N-CA 126.829 2.157 . . . . 15.27 112.149 173.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 33.4 tp -131.6 133.44 44.99 Favored 'General case' 0 N--CA 1.424 -1.759 0 C-N-CA 124.584 1.153 . . . . 27.649999999999999 108.328 175.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 11.0 tmm? -120.56 124.87 46.38 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 105.275 -2.12 . . . . 30.66 105.275 -176.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' VAL . . . . . 0.601 ' O ' ' HG3' ' A' ' 8' ' ' ORN . 66.9 t . . . . . 0 C--N 1.312 -1.028 0 C-N-CA 118.364 -1.334 . . . . 25.530000000000001 108.219 176.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ORN . . . . . 0.601 ' HG3' ' O ' ' A' ' 7' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . . . -96.16 155.84 16.59 Favored 'General case' 0 C--O 1.202 -1.431 0 CA-C-O 122.983 1.373 . . . . 33.359999999999999 114.208 -178.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.0 t80 . . . . . 0 CA--C 1.485 -1.533 0 N-CA-C 107.726 -1.212 . . . . 26.579999999999998 107.726 -173.387 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' HAO . . . . . 0.418 ' C12' ' H31' ' A' ' 14' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' 4BF . . . . . 1.273 ' C ' ' HD1' ' A' ' 12' ' ' 4BF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.541 0.629 0 CA-C-N 111.392 -2.64 . . . . 46.369999999999997 109.948 -171.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 0' ' ' ORN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . -161.09 173.15 15.6 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-O 122.789 1.281 . . . . 44.740000000000002 111.374 -177.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 35.1 mt -90.77 140.47 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 N-CA-C 104.56 -2.385 . . . . 42.32 104.56 -172.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ILE . . . . . 0.487 HD12 ' HB2' ' B' ' 13' ' ' LYS . 59.5 mt -127.97 131.96 69.1 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.47 0 N-CA-C 107.809 -1.182 . . . . 29.23 107.809 -175.106 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . -127.76 155.55 20.19 Favored Glycine 0 N--CA 1.415 -2.764 0 N-CA-C 116.729 1.452 . . . . 16.739999999999998 116.729 169.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 24.6 tp -133.45 133.96 42.95 Favored 'General case' 0 C--O 1.29 3.19 0 CA-C-O 122.767 1.27 . . . . 20.690000000000001 109.624 178.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -118.28 121.18 39.78 Favored 'General case' 0 N--CA 1.434 -1.275 0 N-CA-C 106.78 -1.563 . . . . 28.530000000000001 106.78 -175.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 42.3 t . . . . . 0 CA--C 1.557 1.242 0 C-N-CA 118.975 -1.09 . . . . 27.129999999999999 111.122 172.916 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ORN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.55 141.65 35.01 Favored 'General case' 0 CA--C 1.573 1.844 0 O-C-N 121.522 -0.737 . . . . 40.719999999999999 109.088 -178.7 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 66.3 t80 . . . . . 0 CA--C 1.485 -1.543 0 CA-C-O 118.657 -0.687 . . . . 26.48 111.234 -179.538 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 11' ' ' HAO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 12' ' ' 4BF . . . . . 0.583 ' C ' ' CD1' ' B' ' 12' ' ' 4BF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' LYS . . . . . 0.487 ' HB2' HD12 ' B' ' 3' ' ' ILE . 23.1 mmtt . . . . . 0 N--CA 1.493 1.677 0 CA-C-N 113.977 -1.465 . . . . 43.460000000000001 110.914 -167.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' MPD . . . . . 0.418 ' H31' ' C12' ' A' ' 11' ' ' HAO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' MPD . . . . . 0.934 ' CM ' HG21 ' A' ' 2' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' MPD . . . . . 1.025 ' H52' ' C1 ' ' A' ' 15' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 16' ' ' MPD . . . . . 1.037 ' HM2' ' O4 ' ' B' ' 16' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' ORN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . -141.09 158.37 44.01 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 115.0 -1.0 . . . . 40.35 112.935 -177.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.934 HG21 ' CM ' ' B' ' 14' ' ' MPD . 13.1 mt -76.92 124.37 35.18 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.133 0 O-C-N 124.609 1.193 . . . . 38.99 110.277 166.924 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 89.9 mt -123.37 134.54 65.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 106.41 -1.7 . . . . 29.54 106.41 -178.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -123.36 148.62 16.79 Favored Glycine 0 N--CA 1.428 -1.843 0 C-N-CA 126.829 2.157 . . . . 15.27 112.149 173.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 33.4 tp -131.6 133.44 44.99 Favored 'General case' 0 N--CA 1.424 -1.759 0 C-N-CA 124.584 1.153 . . . . 27.65 108.328 175.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 11.0 tmm? -120.56 124.87 46.38 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 105.275 -2.12 . . . . 30.66 105.275 -176.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.601 ' O ' ' HG3' ' A' ' 8' ' ' ORN . 66.9 t . . . . . 0 C--N 1.312 -1.028 0 C-N-CA 118.364 -1.334 . . . . 25.53 108.219 176.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ORN . . . . . 0.601 ' HG3' ' O ' ' A' ' 7' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . . . -96.16 155.84 16.59 Favored 'General case' 0 C--O 1.202 -1.431 0 CA-C-O 122.983 1.373 . . . . 33.36 114.208 -178.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.0 t80 . . . . . 0 CA--C 1.485 -1.533 0 N-CA-C 107.726 -1.212 . . . . 26.58 107.726 -173.387 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' HAO . . . . . 0.418 ' C12' ' H31' ' A' ' 14' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' 4BF . . . . . 1.273 ' HD1' ' C ' ' A' ' 12' ' ' 4BF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.541 0.629 0 CA-C-N 111.392 -2.64 . . . . 46.37 109.948 -171.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 0' ' ' ORN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . -161.09 173.15 15.6 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-O 122.789 1.281 . . . . 44.74 111.374 -177.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' ILE . . . . . . . . . . . . . 35.1 mt -90.77 140.47 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 N-CA-C 104.56 -2.385 . . . . 42.32 104.56 -172.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.487 HD12 ' HB2' ' B' ' 13' ' ' LYS . 59.5 mt -127.97 131.96 69.1 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.47 0 N-CA-C 107.809 -1.182 . . . . 29.23 107.809 -175.106 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . -127.76 155.55 20.19 Favored Glycine 0 N--CA 1.415 -2.764 0 N-CA-C 116.729 1.452 . . . . 16.74 116.729 169.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 24.6 tp -133.45 133.96 42.95 Favored 'General case' 0 C--O 1.29 3.19 0 CA-C-O 122.767 1.27 . . . . 20.69 109.624 178.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -118.28 121.18 39.78 Favored 'General case' 0 N--CA 1.434 -1.275 0 N-CA-C 106.78 -1.563 . . . . 28.53 106.78 -175.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 42.3 t . . . . . 0 CA--C 1.557 1.242 0 C-N-CA 118.975 -1.09 . . . . 27.13 111.122 172.916 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ORN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.55 141.65 35.01 Favored 'General case' 0 CA--C 1.573 1.844 0 O-C-N 121.522 -0.737 . . . . 40.72 109.088 -178.7 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 66.3 t80 . . . . . 0 CA--C 1.485 -1.543 0 CA-C-O 118.657 -0.687 . . . . 26.48 111.234 -179.538 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' HAO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' 4BF . . . . . 0.583 ' C ' ' CD1' ' B' ' 12' ' ' 4BF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' LYS . . . . . 0.487 ' HB2' HD12 ' B' ' 3' ' ' ILE . 23.1 mmtt . . . . . 0 N--CA 1.493 1.677 0 CA-C-N 113.977 -1.465 . . . . 43.46 110.914 -167.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' MPD . . . . . 0.418 ' H31' ' C12' ' A' ' 11' ' ' HAO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' MPD . . . . . 0.934 ' CM ' HG21 ' A' ' 2' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' MPD . . . . . 1.025 ' H52' ' C1 ' ' A' ' 15' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' MPD . . . . . 1.037 ' O4 ' ' HM2' ' B' ' 16' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_