data_4g1a_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 4g1a _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 ' 2' ' ' ILE . . . . . . . . . . . . . 1.2 mp . . . . . 0 N--CA 1.499 1.999 0 N-CA-C 110.22 -0.289 . . . . 23.05 110.22 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.13 -36.15 67.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.854 0.359 . . . . 21.74 110.412 178.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.87 -41.22 68.29 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 120.595 -0.442 . . . . 21.72 111.463 175.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.74 -39.62 94.69 Favored 'General case' 0 C--O 1.213 -0.821 0 O-C-N 123.579 0.549 . . . . 27.73 110.987 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -55.86 -44.3 77.92 Favored 'General case' 0 C--O 1.248 1.005 0 O-C-N 123.706 0.629 . . . . 33.21 111.796 171.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -71.2 -43.98 66.32 Favored 'General case' 0 C--O 1.258 1.545 0 CA-C-N 116.186 -0.461 . . . . 34.81 110.026 -175.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -60.12 -36.97 78.65 Favored 'General case' 0 C--O 1.252 1.221 0 C-N-CA 119.584 -0.846 . . . . 24.0 112.644 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 13.1 mt -67.84 -41.72 85.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 N-CA-C 112.58 0.585 . . . . 23.45 112.58 178.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.9 -37.29 76.27 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-O 121.794 0.807 . . . . 15.18 110.765 174.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . 0.505 ' O ' ' CG ' ' A' ' 15' ' ' LYS . . . -64.63 -38.06 89.72 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 123.963 0.905 . . . . 14.75 110.55 -178.065 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 42.9 mt -80.51 -28.68 37.38 Favored 'General case' 0 C--O 1.254 1.297 0 C-N-CA 120.049 -0.66 . . . . 17.21 111.285 -177.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 76.1 mt-10 -68.45 -40.35 81.1 Favored 'General case' 0 CA--C 1.487 -1.454 0 N-CA-C 108.5 -0.926 . . . . 24.95 108.5 178.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -68.02 -50.1 57.45 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 120.127 -0.629 . . . . 25.63 112.056 173.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . 0.505 ' CG ' ' O ' ' A' ' 11' ' ' ALA . 7.6 mmtp -46.04 -48.73 16.82 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 113.737 1.014 . . . . 28.21 113.737 179.37 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 77.0 m -110.59 28.84 8.28 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.245 0.832 . . . . 14.33 113.245 -170.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.63 -44.02 65.82 Favored 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 114.99 1.478 . . . . 14.85 114.99 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -117.79 4.33 12.24 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.081 0.953 . . . . 16.21 110.797 -172.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.5 t -47.22 -59.92 2.84 Favored 'General case' 0 C--O 1.254 1.292 0 C-N-CA 126.787 2.035 . . . . 25.19 113.363 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -61.63 -31.44 71.53 Favored 'General case' 0 N--CA 1.479 1.013 0 O-C-N 120.991 -1.068 . . . . 15.69 113.146 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -76.47 -35.02 58.67 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 122.881 0.472 . . . . 30.91 110.576 -175.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.3 mttt -73.98 -39.58 63.56 Favored 'General case' 0 CA--C 1.501 -0.909 0 C-N-CA 122.466 0.306 . . . . 24.37 110.614 178.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 22.7 mt -60.61 -49.19 85.44 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.458 0 CA-C-N 116.837 -0.165 . . . . 13.54 111.185 173.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.03 -42.76 81.03 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 120.965 0.412 . . . . 12.57 110.133 177.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.32 -41.91 84.53 Favored 'General case' 0 C--O 1.274 2.345 0 C-N-CA 119.807 -0.757 . . . . 13.94 111.342 -177.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.4 mt -62.06 -36.97 83.24 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 115.588 -0.733 . . . . 19.52 111.531 177.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 . . . . . 0 C--O 1.201 -1.477 0 CA-C-O 117.923 -1.037 . . . . 32.32 108.363 175.456 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.306 0 CA-C-O 123.667 1.698 . . . . 23.95 108.351 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 11.1 mt -67.77 -38.54 83.55 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 111.766 -2.47 . . . . 28.66 111.579 170.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -54.14 -37.54 64.5 Favored 'General case' 0 C--O 1.204 -1.325 0 N-CA-C 108.907 -0.775 . . . . 33.34 108.907 177.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.59 -30.66 52.56 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 113.873 1.064 . . . . 36.51 113.873 -175.758 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 6.5 mttt -69.82 -42.23 73.93 Favored 'General case' 0 N--CA 1.418 -2.033 0 O-C-N 123.639 0.587 . . . . 29.39 111.046 175.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 15.4 mt -63.71 -48.17 87.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 C-N-CA 119.852 -0.739 . . . . 19.77 111.357 177.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.08 -42.23 60.47 Favored 'General case' 0 CA--C 1.573 1.828 0 N-CA-C 112.978 0.733 . . . . 18.26 112.978 174.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.67 -40.73 97.55 Favored 'General case' 0 C--O 1.215 -0.72 0 O-C-N 121.749 -0.594 . . . . 17.1 111.118 179.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mt -70.2 -36.14 74.41 Favored 'General case' 0 C--O 1.256 1.446 0 C-N-CA 120.38 -0.528 . . . . 21.79 110.004 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -62.93 -39.24 94.01 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 107.932 -1.136 . . . . 30.02 107.932 -178.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -73.76 -47.77 36.65 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 107.882 -1.155 . . . . 25.6 107.882 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.1 tttt -52.92 -45.88 67.82 Favored 'General case' 0 N--CA 1.434 -1.235 0 N-CA-C 112.361 0.504 . . . . 21.54 112.361 -176.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 99.7 m -104.71 28.58 6.93 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-O 121.115 0.483 . . . . 14.24 110.983 -175.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -50.93 -44.8 60.28 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 116.864 2.172 . . . . 17.84 116.864 176.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -126.11 17.48 7.81 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 114.13 1.159 . . . . 17.02 114.13 -177.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . 0.294 12.2 p -69.98 -37.31 75.7 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 117.214 2.302 . . . . 23.57 117.214 -177.961 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -55.19 -49.66 71.35 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 119.451 1.023 . . . . 16.53 113.686 169.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -54.65 -46.0 73.91 Favored 'General case' 0 C--O 1.251 1.162 0 N-CA-C 117.393 2.368 . . . . 31.72 117.393 171.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -67.0 -42.76 84.44 Favored 'General case' 0 C--O 1.208 -1.116 0 N-CA-C 115.414 1.635 . . . . 25.94 115.414 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 76.4 mt -58.88 -46.0 91.43 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.172 0 C-N-CA 123.744 0.817 . . . . 12.92 112.131 169.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.32 -42.43 91.4 Favored 'General case' 0 C--O 1.254 1.33 0 O-C-N 121.518 -0.739 . . . . 13.97 112.167 175.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.64 -50.3 73.1 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 123.948 0.78 . . . . 15.72 112.242 173.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 17.4 mt -53.84 -43.29 69.36 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-N 119.006 0.821 . . . . 21.94 112.746 171.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 . . . . . 0 C--O 1.252 1.205 0 CA-C-O 117.271 -1.347 . . . . 27.58 113.471 173.816 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.507 2.378 0 N-CA-C 107.699 -1.223 . . . . 22.8 107.699 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.54 -41.35 85.34 Favored 'General case' 0 C--O 1.26 1.621 0 N-CA-C 104.229 -2.508 . . . . 21.15 104.229 156.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' LEU . . . . . . . . . . . . . 19.0 mt -60.12 -48.57 81.16 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 115.565 1.691 . . . . 24.14 115.565 -176.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -55.35 -37.95 68.14 Favored 'General case' 0 C--O 1.217 -0.624 0 C-N-CA 124.336 1.054 . . . . 40.22 113.29 176.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' GLN . . . . . . . . . . . . . 9.9 tp-100 -71.73 -43.15 66.35 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 123.896 0.878 . . . . 38.3 111.193 179.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' LYS . . . . . . . . . . . . . 48.4 mttt -65.57 -34.0 77.23 Favored 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 124.178 0.924 . . . . 23.21 108.578 179.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' ILE . . . . . . . . . . . . . 68.8 mt -67.27 -43.67 87.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 N-CA-C 113.402 0.89 . . . . 22.59 113.402 172.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.47 -38.71 90.88 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 120.094 -0.642 . . . . 17.55 112.476 178.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.28 -33.71 76.35 Favored 'General case' 0 C--O 1.212 -0.893 0 C-N-CA 124.784 1.234 . . . . 16.08 108.809 -176.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' LEU . . . . . . . . . . . . . 11.3 mt -75.71 -40.08 56.27 Favored 'General case' 0 C--O 1.268 2.038 0 CA-C-O 118.934 -0.555 . . . . 18.79 109.882 -179.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -58.65 -44.53 90.15 Favored 'General case' 0 CA--C 1.503 -0.855 0 O-C-N 125.576 1.798 . . . . 25.51 110.071 177.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -68.35 -52.82 29.03 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.407 -0.815 . . . . 30.09 111.851 178.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' LYS . . . . . . . . . . . . . 27.3 tttt -49.95 -47.06 52.76 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 124.201 1.0 . . . . 33.25 113.353 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' CYS . . . . . . . . . . . . . 76.9 m -101.67 22.5 12.7 Favored 'General case' 0 C--O 1.212 -0.92 0 O-C-N 123.664 0.602 . . . . 16.73 112.427 -178.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' ALA . . . . . . . . . . . . . . . -47.17 -46.95 23.99 Favored 'General case' 0 C--O 1.263 1.806 0 N-CA-C 114.6 1.333 . . . . 18.0 114.6 175.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.68 7.31 14.69 Favored 'General case' 0 C--O 1.203 -1.394 0 N-CA-C 113.958 1.095 . . . . 17.61 113.958 -171.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' CYS . . . . . . . . . . . . . 6.7 t -47.27 -62.6 1.35 Allowed 'General case' 0 N--CA 1.424 -1.757 0 C-N-CA 127.8 2.44 . . . . 25.92 114.217 -179.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -62.87 -35.36 79.73 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 114.988 1.477 . . . . 16.94 114.988 179.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.42 -33.1 62.88 Favored 'General case' 0 CA--C 1.511 -0.545 0 C-N-CA 119.499 -0.88 . . . . 29.69 112.03 -177.79 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -73.6 -39.92 64.25 Favored 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 113.876 1.065 . . . . 36.39 113.876 176.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' ILE . . . . . . . . . . . . . 63.0 mt -57.61 -48.87 82.29 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.779 0 N-CA-C 108.647 -0.872 . . . . 14.11 108.647 171.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.64 -42.08 91.97 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 113.373 0.879 . . . . 14.05 113.373 178.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.24 -42.24 94.84 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 109.181 -0.674 . . . . 15.53 109.181 176.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.99 -39.79 93.41 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.997 -0.547 . . . . 19.46 112.292 176.382 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -65.02 -47.38 77.65 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 120.687 0.28 . . . . 31.43 110.903 178.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -62.8 -35.43 79.85 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 113.336 0.865 . . . . 30.24 113.336 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' LYS . . . . . . . . . . . . . 55.5 mttt . . . . . 0 N--CA 1.482 1.151 0 C-N-CA 123.443 0.697 . . . . 33.16 111.992 -179.609 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 1.2 mp . . . . . 0 N--CA 1.499 1.999 0 N-CA-C 110.22 -0.289 . . . . 23.050000000000001 110.22 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.13 -36.15 67.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.854 0.359 . . . . 21.739999999999998 110.412 178.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.87 -41.22 68.29 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 120.595 -0.442 . . . . 21.719999999999999 111.463 175.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . 0.572 HD11 ' HG2' ' C' ' 6' ' ' GLU . 78.0 mt -62.74 -39.62 94.69 Favored 'General case' 0 C--O 1.213 -0.821 0 O-C-N 123.579 0.549 . . . . 27.73 110.987 -179.799 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . 0.574 ' HG2' HD21 ' B' ' 5' ' ' LEU . 10.4 mt-10 -55.86 -44.3 77.92 Favored 'General case' 0 C--O 1.248 1.005 0 O-C-N 123.706 0.629 . . . . 33.210000000000001 111.796 171.233 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -71.2 -43.98 66.32 Favored 'General case' 0 C--O 1.258 1.545 0 CA-C-N 116.186 -0.461 . . . . 34.810000000000002 110.026 -175.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -60.12 -36.97 78.65 Favored 'General case' 0 C--O 1.252 1.221 0 C-N-CA 119.584 -0.846 . . . . 24.0 112.644 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ILE . . . . . 0.44 ' CD1' HD22 ' B' ' 5' ' ' LEU . 13.1 mt -67.84 -41.72 85.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 N-CA-C 112.58 0.585 . . . . 23.449999999999999 112.58 178.184 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.9 -37.29 76.27 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-O 121.794 0.807 . . . . 15.18 110.765 174.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . 0.905 ' O ' ' HG2' ' A' ' 15' ' ' LYS . . . -64.63 -38.06 89.72 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 123.963 0.905 . . . . 14.75 110.55 -178.065 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 42.9 mt -80.51 -28.68 37.38 Favored 'General case' 0 C--O 1.254 1.297 0 C-N-CA 120.049 -0.66 . . . . 17.210000000000001 111.285 -177.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . 0.566 ' HG2' HD21 ' B' ' 12' ' ' LEU . 76.1 mt-10 -68.45 -40.35 81.1 Favored 'General case' 0 CA--C 1.487 -1.454 0 N-CA-C 108.5 -0.926 . . . . 24.949999999999999 108.5 178.188 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -68.02 -50.1 57.45 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 120.127 -0.629 . . . . 25.629999999999999 112.056 173.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . 0.905 ' HG2' ' O ' ' A' ' 11' ' ' ALA . 7.6 mmtp -46.04 -48.73 16.82 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 113.737 1.014 . . . . 28.210000000000001 113.737 179.37 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 77.0 m -110.59 28.84 8.28 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.245 0.832 . . . . 14.33 113.245 -170.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.63 -44.02 65.82 Favored 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 114.99 1.478 . . . . 14.85 114.99 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -117.79 4.33 12.24 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.081 0.953 . . . . 16.210000000000001 110.797 -172.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.5 t -47.22 -59.92 2.84 Favored 'General case' 0 C--O 1.254 1.292 0 C-N-CA 126.787 2.035 . . . . 25.190000000000001 113.363 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -61.63 -31.44 71.53 Favored 'General case' 0 N--CA 1.479 1.013 0 O-C-N 120.991 -1.068 . . . . 15.69 113.146 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -76.47 -35.02 58.67 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 122.881 0.472 . . . . 30.91 110.576 -175.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.3 mttt -73.98 -39.58 63.56 Favored 'General case' 0 CA--C 1.501 -0.909 0 C-N-CA 122.466 0.306 . . . . 24.370000000000001 110.614 178.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ILE . . . . . 0.494 HD13 ' HB2' ' B' ' 19' ' ' CYS . 22.7 mt -60.61 -49.19 85.44 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.458 0 CA-C-N 116.837 -0.165 . . . . 13.539999999999999 111.185 173.89 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.03 -42.76 81.03 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 120.965 0.412 . . . . 12.57 110.133 177.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.32 -41.91 84.53 Favored 'General case' 0 C--O 1.274 2.345 0 C-N-CA 119.807 -0.757 . . . . 13.94 111.342 -177.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.4 mt -62.06 -36.97 83.24 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 115.588 -0.733 . . . . 19.52 111.531 177.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 . . . . . 0 C--O 1.201 -1.477 0 CA-C-O 117.923 -1.037 . . . . 32.32 108.363 175.456 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.306 0 CA-C-O 123.667 1.698 . . . . 23.949999999999999 108.351 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LEU . . . . . 0.574 HD21 ' HG2' ' A' ' 6' ' ' GLU . 11.1 mt -67.77 -38.54 83.55 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 111.766 -2.47 . . . . 28.66 111.579 170.145 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLU . . . . . 0.512 ' HG2' HD11 ' C' ' 5' ' ' LEU . 46.1 mt-10 -54.14 -37.54 64.5 Favored 'General case' 0 C--O 1.204 -1.325 0 N-CA-C 108.907 -0.775 . . . . 33.340000000000003 108.907 177.955 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.59 -30.66 52.56 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 113.873 1.064 . . . . 36.509999999999998 113.873 -175.758 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 6.5 mttt -69.82 -42.23 73.93 Favored 'General case' 0 N--CA 1.418 -2.033 0 O-C-N 123.639 0.587 . . . . 29.390000000000001 111.046 175.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 15.4 mt -63.71 -48.17 87.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 C-N-CA 119.852 -0.739 . . . . 19.77 111.357 177.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.08 -42.23 60.47 Favored 'General case' 0 CA--C 1.573 1.828 0 N-CA-C 112.978 0.733 . . . . 18.260000000000002 112.978 174.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.67 -40.73 97.55 Favored 'General case' 0 C--O 1.215 -0.72 0 O-C-N 121.749 -0.594 . . . . 17.100000000000001 111.118 179.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' LEU . . . . . 0.566 HD21 ' HG2' ' A' ' 13' ' ' GLU . 9.9 mt -70.2 -36.14 74.41 Favored 'General case' 0 C--O 1.256 1.446 0 C-N-CA 120.38 -0.528 . . . . 21.789999999999999 110.004 179.165 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -62.93 -39.24 94.01 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 107.932 -1.136 . . . . 30.02 107.932 -178.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -73.76 -47.77 36.65 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 107.882 -1.155 . . . . 25.600000000000001 107.882 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.1 tttt -52.92 -45.88 67.82 Favored 'General case' 0 N--CA 1.434 -1.235 0 N-CA-C 112.361 0.504 . . . . 21.539999999999999 112.361 -176.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 99.7 m -104.71 28.58 6.93 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-O 121.115 0.483 . . . . 14.24 110.983 -175.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -50.93 -44.8 60.28 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 116.864 2.172 . . . . 17.84 116.864 176.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -126.11 17.48 7.81 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 114.13 1.159 . . . . 17.02 114.13 -177.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' CYS . . . . . 0.494 ' HB2' HD13 ' A' ' 23' ' ' ILE 0.294 12.2 p -69.98 -37.31 75.7 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 117.214 2.302 . . . . 23.57 117.214 -177.961 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -55.19 -49.66 71.35 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 119.451 1.023 . . . . 16.530000000000001 113.686 169.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -54.65 -46.0 73.91 Favored 'General case' 0 C--O 1.251 1.162 0 N-CA-C 117.393 2.368 . . . . 31.719999999999999 117.393 171.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -67.0 -42.76 84.44 Favored 'General case' 0 C--O 1.208 -1.116 0 N-CA-C 115.414 1.635 . . . . 25.940000000000001 115.414 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 76.4 mt -58.88 -46.0 91.43 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.172 0 C-N-CA 123.744 0.817 . . . . 12.92 112.131 169.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.32 -42.43 91.4 Favored 'General case' 0 C--O 1.254 1.33 0 O-C-N 121.518 -0.739 . . . . 13.970000000000001 112.167 175.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.64 -50.3 73.1 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 123.948 0.78 . . . . 15.720000000000001 112.242 173.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 17.4 mt -53.84 -43.29 69.36 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-N 119.006 0.821 . . . . 21.940000000000001 112.746 171.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 . . . . . 0 C--O 1.252 1.205 0 CA-C-O 117.271 -1.347 . . . . 27.579999999999998 113.471 173.816 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.507 2.378 0 N-CA-C 107.699 -1.223 . . . . 22.800000000000001 107.699 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.54 -41.35 85.34 Favored 'General case' 0 C--O 1.26 1.621 0 N-CA-C 104.229 -2.508 . . . . 21.149999999999999 104.229 156.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' LEU . . . . . 0.512 HD11 ' HG2' ' B' ' 6' ' ' GLU . 19.0 mt -60.12 -48.57 81.16 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 115.565 1.691 . . . . 24.140000000000001 115.565 -176.302 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 6' ' ' GLU . . . . . 0.572 ' HG2' HD11 ' A' ' 5' ' ' LEU . 3.1 mt-10 -55.35 -37.95 68.14 Favored 'General case' 0 C--O 1.217 -0.624 0 C-N-CA 124.336 1.054 . . . . 40.219999999999999 113.29 176.206 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 7' ' ' GLN . . . . . . . . . . . . . 53.3 tp60 -71.73 -43.15 66.35 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 123.896 0.878 . . . . 38.299999999999997 111.193 179.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 8' ' ' LYS . . . . . . . . . . . . . 48.4 mttt -65.57 -34.0 77.23 Favored 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 124.178 0.924 . . . . 23.210000000000001 108.578 179.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' ILE . . . . . 0.517 HD12 HD22 ' A' ' 5' ' ' LEU . 68.8 mt -67.27 -43.67 87.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 N-CA-C 113.402 0.89 . . . . 22.59 113.402 172.163 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.47 -38.71 90.88 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 120.094 -0.642 . . . . 17.550000000000001 112.476 178.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.28 -33.71 76.35 Favored 'General case' 0 C--O 1.212 -0.893 0 C-N-CA 124.784 1.234 . . . . 16.079999999999998 108.809 -176.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' LEU . . . . . . . . . . . . . 11.3 mt -75.71 -40.08 56.27 Favored 'General case' 0 C--O 1.268 2.038 0 CA-C-O 118.934 -0.555 . . . . 18.789999999999999 109.882 -179.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' C' ' 9' ' ' ILE . 84.0 mt-10 -58.65 -44.53 90.15 Favored 'General case' 0 CA--C 1.503 -0.855 0 O-C-N 125.576 1.798 . . . . 25.510000000000002 110.071 177.404 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -68.35 -52.82 29.03 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.407 -0.815 . . . . 30.09 111.851 178.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' LYS . . . . . . . . . . . . . 27.3 tttt -49.95 -47.06 52.76 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 124.201 1.0 . . . . 33.25 113.353 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' CYS . . . . . . . . . . . . . 76.9 m -101.67 22.5 12.7 Favored 'General case' 0 C--O 1.212 -0.92 0 O-C-N 123.664 0.602 . . . . 16.73 112.427 -178.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' ALA . . . . . . . . . . . . . . . -47.17 -46.95 23.99 Favored 'General case' 0 C--O 1.263 1.806 0 N-CA-C 114.6 1.333 . . . . 18.0 114.6 175.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.68 7.31 14.69 Favored 'General case' 0 C--O 1.203 -1.394 0 N-CA-C 113.958 1.095 . . . . 17.609999999999999 113.958 -171.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' CYS . . . . . . . . . . . . . 6.7 t -47.27 -62.6 1.35 Allowed 'General case' 0 N--CA 1.424 -1.757 0 C-N-CA 127.8 2.44 . . . . 25.920000000000002 114.217 -179.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -62.87 -35.36 79.73 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 114.988 1.477 . . . . 16.940000000000001 114.988 179.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' GLN . . . . . 0.672 ' HG2' ' O ' ' C' ' 201' ' ' HOH . 0.2 OUTLIER -74.42 -33.1 62.88 Favored 'General case' 0 CA--C 1.511 -0.545 0 C-N-CA 119.499 -0.88 . . . . 29.690000000000001 112.03 -177.79 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 22' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -73.6 -39.92 64.25 Favored 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 113.876 1.065 . . . . 36.390000000000001 113.876 176.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' ILE . . . . . 0.447 ' O ' ' HG3' ' C' ' 27' ' ' GLU . 63.0 mt -57.61 -48.87 82.29 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.779 0 N-CA-C 108.647 -0.872 . . . . 14.109999999999999 108.647 171.869 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.64 -42.08 91.97 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 113.373 0.879 . . . . 14.050000000000001 113.373 178.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.24 -42.24 94.84 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 109.181 -0.674 . . . . 15.529999999999999 109.181 176.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.99 -39.79 93.41 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.997 -0.547 . . . . 19.460000000000001 112.292 176.382 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 27' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' C' ' 23' ' ' ILE . 56.6 mt-10 -65.02 -47.38 77.65 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 120.687 0.28 . . . . 31.43 110.903 178.101 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 28' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -62.8 -35.43 79.85 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 113.336 0.865 . . . . 30.239999999999998 113.336 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' LYS . . . . . . . . . . . . . 55.5 mttt . . . . . 0 N--CA 1.482 1.151 0 C-N-CA 123.443 0.697 . . . . 33.159999999999997 111.992 -179.609 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 201' ' ' HOH . . . . . 0.672 ' O ' ' HG2' ' C' ' 21' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 1.2 mp . . . . . 0 N--CA 1.499 1.999 0 N-CA-C 110.22 -0.289 . . . . 23.050000000000001 110.22 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.13 -36.15 67.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.854 0.359 . . . . 21.739999999999998 110.412 178.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.87 -41.22 68.29 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 120.595 -0.442 . . . . 21.719999999999999 111.463 175.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.572 HD11 ' HG2' ' C' ' 6' ' ' GLU . 78.0 mt -62.74 -39.62 94.69 Favored 'General case' 0 C--O 1.213 -0.821 0 O-C-N 123.579 0.549 . . . . 27.73 110.987 -179.799 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.574 ' HG2' HD21 ' B' ' 5' ' ' LEU . 10.4 mt-10 -55.86 -44.3 77.92 Favored 'General case' 0 C--O 1.248 1.005 0 O-C-N 123.706 0.629 . . . . 33.210000000000001 111.796 171.233 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -71.2 -43.98 66.32 Favored 'General case' 0 C--O 1.258 1.545 0 CA-C-N 116.186 -0.461 . . . . 34.810000000000002 110.026 -175.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -60.12 -36.97 78.65 Favored 'General case' 0 C--O 1.252 1.221 0 C-N-CA 119.584 -0.846 . . . . 24.0 112.644 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.44 ' CD1' HD22 ' B' ' 5' ' ' LEU . 13.1 mt -67.84 -41.72 85.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 N-CA-C 112.58 0.585 . . . . 23.449999999999999 112.58 178.184 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.9 -37.29 76.27 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-O 121.794 0.807 . . . . 15.18 110.765 174.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.905 ' O ' ' HG2' ' A' ' 15' ' ' LYS . . . -64.63 -38.06 89.72 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 123.963 0.905 . . . . 14.75 110.55 -178.065 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 42.9 mt -80.51 -28.68 37.38 Favored 'General case' 0 C--O 1.254 1.297 0 C-N-CA 120.049 -0.66 . . . . 17.210000000000001 111.285 -177.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.566 ' HG2' HD21 ' B' ' 12' ' ' LEU . 76.1 mt-10 -68.45 -40.35 81.1 Favored 'General case' 0 CA--C 1.487 -1.454 0 N-CA-C 108.5 -0.926 . . . . 24.949999999999999 108.5 178.188 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -68.02 -50.1 57.45 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 120.127 -0.629 . . . . 25.629999999999999 112.056 173.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.905 ' HG2' ' O ' ' A' ' 11' ' ' ALA . 7.6 mmtp -46.04 -48.73 16.82 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 113.737 1.014 . . . . 28.210000000000001 113.737 179.37 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 77.0 m -110.59 28.84 8.28 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.245 0.832 . . . . 14.33 113.245 -170.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.63 -44.02 65.82 Favored 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 114.99 1.478 . . . . 14.85 114.99 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -117.79 4.33 12.24 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.081 0.953 . . . . 16.210000000000001 110.797 -172.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.5 t -47.22 -59.92 2.84 Favored 'General case' 0 C--O 1.254 1.292 0 C-N-CA 126.787 2.035 . . . . 25.190000000000001 113.363 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -61.63 -31.44 71.53 Favored 'General case' 0 N--CA 1.479 1.013 0 O-C-N 120.991 -1.068 . . . . 15.69 113.146 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -76.47 -35.02 58.67 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 122.881 0.472 . . . . 30.91 110.576 -175.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.3 mttt -73.98 -39.58 63.56 Favored 'General case' 0 CA--C 1.501 -0.909 0 C-N-CA 122.466 0.306 . . . . 24.370000000000001 110.614 178.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.494 HD13 ' HB2' ' B' ' 19' ' ' CYS . 22.7 mt -60.61 -49.19 85.44 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.458 0 CA-C-N 116.837 -0.165 . . . . 13.539999999999999 111.185 173.89 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.03 -42.76 81.03 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 120.965 0.412 . . . . 12.57 110.133 177.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.32 -41.91 84.53 Favored 'General case' 0 C--O 1.274 2.345 0 C-N-CA 119.807 -0.757 . . . . 13.94 111.342 -177.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.4 mt -62.06 -36.97 83.24 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 115.588 -0.733 . . . . 19.52 111.531 177.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 . . . . . 0 C--O 1.201 -1.477 0 CA-C-O 117.923 -1.037 . . . . 32.32 108.363 175.456 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.306 0 CA-C-O 123.667 1.698 . . . . 23.949999999999999 108.351 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.574 HD21 ' HG2' ' A' ' 6' ' ' GLU . 11.1 mt -67.77 -38.54 83.55 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 111.766 -2.47 . . . . 28.66 111.579 170.145 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.512 ' HG2' HD11 ' C' ' 5' ' ' LEU . 46.1 mt-10 -54.14 -37.54 64.5 Favored 'General case' 0 C--O 1.204 -1.325 0 N-CA-C 108.907 -0.775 . . . . 33.340000000000003 108.907 177.955 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.59 -30.66 52.56 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 113.873 1.064 . . . . 36.509999999999998 113.873 -175.758 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 6.5 mttt -69.82 -42.23 73.93 Favored 'General case' 0 N--CA 1.418 -2.033 0 O-C-N 123.639 0.587 . . . . 29.390000000000001 111.046 175.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 15.4 mt -63.71 -48.17 87.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 C-N-CA 119.852 -0.739 . . . . 19.77 111.357 177.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.08 -42.23 60.47 Favored 'General case' 0 CA--C 1.573 1.828 0 N-CA-C 112.978 0.733 . . . . 18.260000000000002 112.978 174.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.67 -40.73 97.55 Favored 'General case' 0 C--O 1.215 -0.72 0 O-C-N 121.749 -0.594 . . . . 17.100000000000001 111.118 179.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.566 HD21 ' HG2' ' A' ' 13' ' ' GLU . 9.9 mt -70.2 -36.14 74.41 Favored 'General case' 0 C--O 1.256 1.446 0 C-N-CA 120.38 -0.528 . . . . 21.789999999999999 110.004 179.165 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -62.93 -39.24 94.01 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 107.932 -1.136 . . . . 30.02 107.932 -178.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -73.76 -47.77 36.65 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 107.882 -1.155 . . . . 25.600000000000001 107.882 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.1 tttt -52.92 -45.88 67.82 Favored 'General case' 0 N--CA 1.434 -1.235 0 N-CA-C 112.361 0.504 . . . . 21.539999999999999 112.361 -176.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 99.7 m -104.71 28.58 6.93 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-O 121.115 0.483 . . . . 14.24 110.983 -175.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -50.93 -44.8 60.28 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 116.864 2.172 . . . . 17.84 116.864 176.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -126.11 17.48 7.81 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 114.13 1.159 . . . . 17.02 114.13 -177.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' CYS . . . . . 0.494 ' HB2' HD13 ' A' ' 23' ' ' ILE 0.294 12.2 p -69.98 -37.31 75.7 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 117.214 2.302 . . . . 23.57 117.214 -177.961 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -55.19 -49.66 71.35 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 119.451 1.023 . . . . 16.530000000000001 113.686 169.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -54.65 -46.0 73.91 Favored 'General case' 0 C--O 1.251 1.162 0 N-CA-C 117.393 2.368 . . . . 31.719999999999999 117.393 171.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 9.0 mtpp -67.0 -42.76 84.44 Favored 'General case' 0 C--O 1.208 -1.116 0 N-CA-C 115.414 1.635 . . . . 25.940000000000001 115.414 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 76.4 mt -58.88 -46.0 91.43 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.172 0 C-N-CA 123.744 0.817 . . . . 12.92 112.131 169.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.32 -42.43 91.4 Favored 'General case' 0 C--O 1.254 1.33 0 O-C-N 121.518 -0.739 . . . . 13.970000000000001 112.167 175.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.64 -50.3 73.1 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 123.948 0.78 . . . . 15.720000000000001 112.242 173.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 17.4 mt -53.84 -43.29 69.36 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-N 119.006 0.821 . . . . 21.940000000000001 112.746 171.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 . . . . . 0 C--O 1.252 1.205 0 CA-C-O 117.271 -1.347 . . . . 27.579999999999998 113.471 173.816 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.507 2.378 0 N-CA-C 107.699 -1.223 . . . . 22.800000000000001 107.699 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.54 -41.35 85.34 Favored 'General case' 0 C--O 1.26 1.621 0 N-CA-C 104.229 -2.508 . . . . 21.149999999999999 104.229 156.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' LEU . . . . . 0.512 HD11 ' HG2' ' B' ' 6' ' ' GLU . 19.0 mt -60.12 -48.57 81.16 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 115.565 1.691 . . . . 24.140000000000001 115.565 -176.302 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' GLU . . . . . 0.572 ' HG2' HD11 ' A' ' 5' ' ' LEU . 3.1 mt-10 -55.35 -37.95 68.14 Favored 'General case' 0 C--O 1.217 -0.624 0 C-N-CA 124.336 1.054 . . . . 40.219999999999999 113.29 176.206 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' GLN . . . . . 0.487 ' NE2' ' HA ' ' C' ' 7' ' ' GLN . 9.9 tp-100 -71.73 -43.15 66.35 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 123.896 0.878 . . . . 38.299999999999997 111.193 179.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' LYS . . . . . . . . . . . . . 48.4 mttt -65.57 -34.0 77.23 Favored 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 124.178 0.924 . . . . 23.210000000000001 108.578 179.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' ILE . . . . . 0.517 HD12 HD22 ' A' ' 5' ' ' LEU . 68.8 mt -67.27 -43.67 87.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 N-CA-C 113.402 0.89 . . . . 22.59 113.402 172.163 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.47 -38.71 90.88 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 120.094 -0.642 . . . . 17.550000000000001 112.476 178.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.28 -33.71 76.35 Favored 'General case' 0 C--O 1.212 -0.893 0 C-N-CA 124.784 1.234 . . . . 16.079999999999998 108.809 -176.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' LEU . . . . . . . . . . . . . 11.3 mt -75.71 -40.08 56.27 Favored 'General case' 0 C--O 1.268 2.038 0 CA-C-O 118.934 -0.555 . . . . 18.789999999999999 109.882 -179.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' C' ' 9' ' ' ILE . 84.0 mt-10 -58.65 -44.53 90.15 Favored 'General case' 0 CA--C 1.503 -0.855 0 O-C-N 125.576 1.798 . . . . 25.510000000000002 110.071 177.404 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -68.35 -52.82 29.03 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.407 -0.815 . . . . 30.09 111.851 178.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' LYS . . . . . . . . . . . . . 27.3 tttt -49.95 -47.06 52.76 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 124.201 1.0 . . . . 33.25 113.353 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' CYS . . . . . . . . . . . . . 76.9 m -101.67 22.5 12.7 Favored 'General case' 0 C--O 1.212 -0.92 0 O-C-N 123.664 0.602 . . . . 16.73 112.427 -178.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' ALA . . . . . . . . . . . . . . . -47.17 -46.95 23.99 Favored 'General case' 0 C--O 1.263 1.806 0 N-CA-C 114.6 1.333 . . . . 18.0 114.6 175.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.68 7.31 14.69 Favored 'General case' 0 C--O 1.203 -1.394 0 N-CA-C 113.958 1.095 . . . . 17.609999999999999 113.958 -171.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' CYS . . . . . . . . . . . . . 6.7 t -47.27 -62.6 1.35 Allowed 'General case' 0 N--CA 1.424 -1.757 0 C-N-CA 127.8 2.44 . . . . 25.920000000000002 114.217 -179.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -62.87 -35.36 79.73 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 114.988 1.477 . . . . 16.940000000000001 114.988 179.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' GLN . . . . . 0.672 ' HG2' ' O ' ' C' ' 201' ' ' HOH . 0.2 OUTLIER -74.42 -33.1 62.88 Favored 'General case' 0 CA--C 1.511 -0.545 0 C-N-CA 119.499 -0.88 . . . . 29.690000000000001 112.03 -177.79 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -73.6 -39.92 64.25 Favored 'General case' 0 N--CA 1.428 -1.561 0 N-CA-C 113.876 1.065 . . . . 36.390000000000001 113.876 176.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' ILE . . . . . 0.447 ' O ' ' HG3' ' C' ' 27' ' ' GLU . 63.0 mt -57.61 -48.87 82.29 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.779 0 N-CA-C 108.647 -0.872 . . . . 14.109999999999999 108.647 171.869 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.64 -42.08 91.97 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 113.373 0.879 . . . . 14.050000000000001 113.373 178.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.24 -42.24 94.84 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 109.181 -0.674 . . . . 15.529999999999999 109.181 176.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.99 -39.79 93.41 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.997 -0.547 . . . . 19.460000000000001 112.292 176.382 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' C' ' 23' ' ' ILE . 56.6 mt-10 -65.02 -47.38 77.65 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 120.687 0.28 . . . . 31.43 110.903 178.101 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -62.8 -35.43 79.85 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 113.336 0.865 . . . . 30.239999999999998 113.336 -179.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' LYS . . . . . . . . . . . . . 55.5 mttt . . . . . 0 N--CA 1.482 1.151 0 C-N-CA 123.443 0.697 . . . . 33.159999999999997 111.992 -179.609 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 201' ' ' HOH . . . . . 0.672 ' O ' ' HG2' ' C' ' 21' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_