data_5hkr_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 5hkr _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' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.511 -0.549 0 N-CA-C 109.277 -0.638 . . . . 36.06 109.277 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 22.4 mp0 -56.45 -37.44 70.29 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.312 -0.858 . . . . 44.36 110.943 -177.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.9 -48.24 82.49 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.136 0.494 . . . . 30.37 110.873 178.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -71.3 -18.61 62.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.564 -0.289 . . . . 41.79 111.124 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.1 m -84.19 -30.33 25.88 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 121.108 -0.237 . . . . 35.47 111.557 177.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.3 -43.87 69.5 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 119.94 -0.704 . . . . 30.24 110.748 175.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.5 mt -63.68 -34.13 77.17 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 120.568 -0.453 . . . . 28.28 111.317 -179.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -64.76 -50.1 68.15 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.133 -0.627 . . . . 51.16 110.58 173.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -60.62 -45.37 94.29 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 120.83 -0.348 . . . . 28.54 111.248 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.94 -31.68 72.83 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 119.502 -0.879 . . . . 28.14 111.154 -179.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLN . . . . . 0.575 ' NE2' ' OE1' ' B' ' 22' ' ' GLN . 22.5 tt0 -66.77 -46.73 74.41 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 119.605 -0.838 . . . . 45.89 110.586 174.607 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLN . . . . . 0.481 ' OE1' ' NZ ' ' A' ' 16' ' ' LYS . 4.5 tt0 -45.29 -59.07 2.85 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.997 0.427 . . . . 36.29 111.108 170.246 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.95 -44.34 67.01 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.483 -0.326 . . . . 28.61 111.671 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.2 mt -61.79 -41.31 97.58 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.648 -0.421 . . . . 29.15 111.804 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -69.74 -39.32 76.85 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 119.482 -0.887 . . . . 38.02 111.278 178.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . 0.481 ' NZ ' ' OE1' ' A' ' 12' ' ' GLN . 9.7 mtmt -55.49 -43.45 75.59 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.749 -0.78 . . . . 33.12 110.129 171.516 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.51 -41.7 99.02 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.667 -0.413 . . . . 26.81 111.316 -177.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLN . . . . . 0.45 ' OE1' ' NE2' ' B' ' 18' ' ' GLN . 36.3 mt-30 -69.4 -29.29 67.01 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 118.768 -1.173 . . . . 35.43 111.831 -174.673 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 13.5 mt -54.03 -53.53 51.79 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 119.886 -0.726 . . . . 30.43 110.322 166.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.26 -41.14 75.32 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.848 -0.615 . . . . 29.32 111.308 -175.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 51.9 mt -61.36 -55.17 34.55 Favored 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 120.65 -0.42 . . . . 29.83 111.347 179.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -59.71 -39.7 85.5 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 119.431 -0.908 . . . . 44.48 110.747 -173.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.37 -47.85 82.51 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.985 -0.686 . . . . 28.4 110.13 172.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.33 -39.45 93.09 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 119.797 -0.761 . . . . 32.09 111.015 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ARG . . . . . 0.624 ' NH2' ' OE1' ' B' ' 11' ' ' GLN . 4.4 mmm180 -61.12 -43.69 98.49 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.161 -0.615 . . . . 39.87 111.126 178.941 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -63.45 -43.96 95.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.993 -0.683 . . . . 37.09 111.146 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.95 -32.4 65.96 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 119.686 -0.806 . . . . 45.11 111.448 179.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.67 -24.84 65.91 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 112.08 0.4 . . . . 42.47 112.08 -178.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.3 mmpt? -66.82 -61.66 1.84 Allowed 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.034 0.445 . . . . 50.4 110.202 172.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.293 0 C-N-CA 123.149 0.58 . . . . 53.16 111.587 172.617 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.487 0 N-CA-C 109.175 -0.676 . . . . 35.71 109.175 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' GLU . . . . . 0.447 ' N ' ' OE2' ' B' ' 2' ' ' GLU . 27.2 mp0 -70.61 -40.72 73.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.69 -0.686 . . . . 41.03 110.541 165.47 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . -55.32 -34.0 63.79 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.683 0.278 . . . . 33.1 110.602 173.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -56.66 -62.26 1.86 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.027 0.441 . . . . 46.05 110.126 172.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 36.6 m -59.57 -34.83 73.2 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-N 116.506 -0.315 . . . . 32.18 111.63 -177.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.89 -43.05 89.38 Favored 'General case' 0 CA--C 1.52 -0.202 0 C-N-CA 119.831 -0.748 . . . . 30.18 110.902 177.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 1.2 mt -68.32 -42.83 78.79 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 120.395 -0.522 . . . . 30.3 111.547 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -61.61 -47.08 87.09 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.378 -0.929 . . . . 46.47 110.375 177.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -53.06 -47.32 68.56 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 120.428 -0.509 . . . . 28.39 111.069 176.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.92 -44.43 96.79 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 120.228 -0.589 . . . . 28.02 111.124 -175.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' GLN . . . . . 0.624 ' OE1' ' NH2' ' A' ' 25' ' ' ARG . 21.5 tt0 -60.08 -41.94 93.5 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.073 -0.651 . . . . 42.36 111.09 -178.802 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -58.96 -49.6 77.24 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.761 -0.376 . . . . 42.73 111.259 175.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.83 -37.43 71.23 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.644 -0.422 . . . . 28.96 111.108 -176.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' LEU . . . . . 0.401 ' O ' ' N ' ' B' ' 18' ' ' GLN . 4.7 mt -66.79 -37.18 84.07 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 119.867 -0.733 . . . . 34.6 111.556 179.496 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -62.82 -45.25 93.5 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 120.277 -0.569 . . . . 42.07 110.756 177.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 18.9 mttm -61.25 -37.96 84.96 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 120.205 -0.598 . . . . 32.06 110.588 173.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.87 -35.56 80.99 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.421 -0.912 . . . . 25.58 110.886 173.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' GLN . . . . . 0.45 ' NE2' ' OE1' ' A' ' 18' ' ' GLN . 51.1 mt-30 -70.75 -52.01 23.55 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.314 -0.554 . . . . 35.34 111.875 -177.754 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 4.3 pp -66.21 -36.47 83.13 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.552 -0.859 . . . . 28.1 111.473 -173.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.52 -48.23 81.97 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 120.469 -0.493 . . . . 26.1 110.477 174.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 7.3 tp -56.92 -32.47 65.97 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.687 -0.405 . . . . 28.19 111.387 179.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLN . . . . . 0.575 ' OE1' ' NE2' ' A' ' 11' ' ' GLN . 8.7 mm100 -69.66 -39.43 77.04 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 119.509 -0.876 . . . . 33.23 111.125 -179.972 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.82 -41.82 87.76 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 119.581 -0.847 . . . . 28.47 110.297 172.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.98 -51.36 67.15 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.372 -0.531 . . . . 29.45 111.164 -176.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 20.5 mtm180 -56.02 -35.14 66.51 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 119.205 -0.998 . . . . 44.23 110.822 179.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 71.2 tp60 -62.75 -45.03 94.61 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.471 -0.492 . . . . 42.39 111.352 178.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.03 -32.23 69.55 Favored 'General case' 0 CA--C 1.514 -0.441 0 O-C-N 122.133 -0.354 . . . . 37.36 111.78 -179.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 63.6 mt -62.94 -44.29 96.46 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.02 0.438 . . . . 35.29 111.273 -176.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.7 mmtm -65.56 -27.45 68.45 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.018 -0.673 . . . . 42.02 111.286 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.503 0 CA-C-O 121.094 0.474 . . . . 44.34 111.179 169.299 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' 60C . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' 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 build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.511 -0.549 0 N-CA-C 109.277 -0.638 . . . . 36.060000000000002 109.277 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 22.4 mp0 -56.45 -37.44 70.29 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.312 -0.858 . . . . 44.359999999999999 110.943 -177.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.9 -48.24 82.49 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.136 0.494 . . . . 30.370000000000001 110.873 178.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLU . . . . . 0.477 ' HG2' HD13 ' B' ' 28' ' ' LEU . 3.2 mt-10 -71.3 -18.61 62.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.564 -0.289 . . . . 41.789999999999999 111.124 -179.889 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.1 m -84.19 -30.33 25.88 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 121.108 -0.237 . . . . 35.469999999999999 111.557 177.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.3 -43.87 69.5 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 119.94 -0.704 . . . . 30.239999999999998 110.748 175.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . 0.422 HD12 HD11 ' B' ' 28' ' ' LEU . 13.5 mt -63.68 -34.13 77.17 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 120.568 -0.453 . . . . 28.280000000000001 111.317 -179.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -64.76 -50.1 68.15 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.133 -0.627 . . . . 51.159999999999997 110.58 173.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -60.62 -45.37 94.29 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 120.83 -0.348 . . . . 28.539999999999999 111.248 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.94 -31.68 72.83 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 119.502 -0.879 . . . . 28.140000000000001 111.154 -179.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLN . . . . . 0.458 ' HB2' HD21 ' B' ' 21' ' ' LEU . 22.5 tt0 -66.77 -46.73 74.41 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 119.605 -0.838 . . . . 45.890000000000001 110.586 174.607 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -45.29 -59.07 2.85 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.997 0.427 . . . . 36.289999999999999 111.108 170.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.95 -44.34 67.01 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.483 -0.326 . . . . 28.609999999999999 111.671 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.2 mt -61.79 -41.31 97.58 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.648 -0.421 . . . . 29.149999999999999 111.804 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 11' ' ' GLN . 55.5 mt-10 -69.74 -39.32 76.85 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 119.482 -0.887 . . . . 38.020000000000003 111.278 178.387 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -55.49 -43.45 75.59 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.749 -0.78 . . . . 33.119999999999997 110.129 171.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.51 -41.7 99.02 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.667 -0.413 . . . . 26.809999999999999 111.316 -177.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -69.4 -29.29 67.01 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 118.768 -1.173 . . . . 35.43 111.831 -174.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 13.5 mt -54.03 -53.53 51.79 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 119.886 -0.726 . . . . 30.43 110.322 166.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.26 -41.14 75.32 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.848 -0.615 . . . . 29.32 111.308 -175.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 51.9 mt -61.36 -55.17 34.55 Favored 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 120.65 -0.42 . . . . 29.829999999999998 111.347 179.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -59.71 -39.7 85.5 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 119.431 -0.908 . . . . 44.479999999999997 110.747 -173.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.37 -47.85 82.51 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.985 -0.686 . . . . 28.399999999999999 110.13 172.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.33 -39.45 93.09 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 119.797 -0.761 . . . . 32.090000000000003 111.015 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ARG . . . . . 0.572 ' NH2' ' OE1' ' B' ' 11' ' ' GLN . 4.4 mmm180 -61.12 -43.69 98.49 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.161 -0.615 . . . . 39.869999999999997 111.126 178.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -63.45 -43.96 95.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.993 -0.683 . . . . 37.090000000000003 111.146 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.95 -32.4 65.96 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 119.686 -0.806 . . . . 45.109999999999999 111.448 179.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.67 -24.84 65.91 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 112.08 0.4 . . . . 42.469999999999999 112.08 -178.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.3 mmpt? -66.82 -61.66 1.84 Allowed 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.034 0.445 . . . . 50.399999999999999 110.202 172.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.293 0 C-N-CA 123.149 0.58 . . . . 53.159999999999997 111.587 172.617 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.487 0 N-CA-C 109.175 -0.676 . . . . 35.710000000000001 109.175 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' GLU . . . . . 0.447 ' OE2' ' N ' ' B' ' 2' ' ' GLU . 27.2 mp0 -70.61 -40.72 73.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.69 -0.686 . . . . 41.030000000000001 110.541 165.47 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . -55.32 -34.0 63.79 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.683 0.278 . . . . 33.100000000000001 110.602 173.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -56.66 -62.26 1.86 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.027 0.441 . . . . 46.049999999999997 110.126 172.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 36.6 m -59.57 -34.83 73.2 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-N 116.506 -0.315 . . . . 32.18 111.63 -177.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.89 -43.05 89.38 Favored 'General case' 0 CA--C 1.52 -0.202 0 C-N-CA 119.831 -0.748 . . . . 30.18 110.902 177.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' LEU . . . . . 0.511 ' HB3' ' HD3' ' A' ' 25' ' ' ARG . 1.2 mt -68.32 -42.83 78.79 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 120.395 -0.522 . . . . 30.300000000000001 111.547 179.94 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -61.61 -47.08 87.09 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.378 -0.929 . . . . 46.469999999999999 110.375 177.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -53.06 -47.32 68.56 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 120.428 -0.509 . . . . 28.390000000000001 111.069 176.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.92 -44.43 96.79 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 120.228 -0.589 . . . . 28.02 111.124 -175.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' GLN . . . . . 0.572 ' OE1' ' NH2' ' A' ' 25' ' ' ARG . 21.5 tt0 -60.08 -41.94 93.5 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.073 -0.651 . . . . 42.359999999999999 111.09 -178.802 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 12' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -58.96 -49.6 77.24 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.761 -0.376 . . . . 42.729999999999997 111.259 175.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.83 -37.43 71.23 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.644 -0.422 . . . . 28.960000000000001 111.108 -176.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.7 mt -66.79 -37.18 84.07 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 119.867 -0.733 . . . . 34.600000000000001 111.556 179.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -62.82 -45.25 93.5 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 120.277 -0.569 . . . . 42.07 110.756 177.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 18.9 mttm -61.25 -37.96 84.96 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 120.205 -0.598 . . . . 32.060000000000002 110.588 173.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.87 -35.56 80.99 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.421 -0.912 . . . . 25.579999999999998 110.886 173.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -70.75 -52.01 23.55 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.314 -0.554 . . . . 35.340000000000003 111.875 -177.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' LEU . . . . . 0.412 HD12 ' N ' ' B' ' 20' ' ' ALA . 4.3 pp -66.21 -36.47 83.13 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.552 -0.859 . . . . 28.100000000000001 111.473 -173.931 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ALA . . . . . 0.412 ' N ' HD12 ' B' ' 19' ' ' LEU . . . -61.52 -48.23 81.97 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 120.469 -0.493 . . . . 26.100000000000001 110.477 174.025 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 21' ' ' LEU . . . . . 0.458 HD21 ' HB2' ' A' ' 11' ' ' GLN . 7.3 tp -56.92 -32.47 65.97 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.687 -0.405 . . . . 28.190000000000001 111.387 179.139 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLN . . . . . 0.453 ' OE1' ' NE2' ' A' ' 11' ' ' GLN . 8.7 mm100 -69.66 -39.43 77.04 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 119.509 -0.876 . . . . 33.229999999999997 111.125 -179.972 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.82 -41.82 87.76 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 119.581 -0.847 . . . . 28.469999999999999 110.297 172.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.98 -51.36 67.15 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.372 -0.531 . . . . 29.449999999999999 111.164 -176.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 20.5 mtm180 -56.02 -35.14 66.51 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 119.205 -0.998 . . . . 44.229999999999997 110.822 179.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 71.2 tp60 -62.75 -45.03 94.61 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.471 -0.492 . . . . 42.390000000000001 111.352 178.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.03 -32.23 69.55 Favored 'General case' 0 CA--C 1.514 -0.441 0 O-C-N 122.133 -0.354 . . . . 37.359999999999999 111.78 -179.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LEU . . . . . 0.477 HD13 ' HG2' ' A' ' 4' ' ' GLU . 63.6 mt -62.94 -44.29 96.46 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.02 0.438 . . . . 35.289999999999999 111.273 -176.865 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.7 mmtm -65.56 -27.45 68.45 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.018 -0.673 . . . . 42.020000000000003 111.286 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.503 0 CA-C-O 121.094 0.474 . . . . 44.340000000000003 111.179 169.299 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' 60C . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . 0.429 ' O ' ' HD2' ' A' ' 25' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.511 -0.549 0 N-CA-C 109.277 -0.638 . . . . 36.060000000000002 109.277 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 22.4 mp0 -56.45 -37.44 70.29 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.312 -0.858 . . . . 44.359999999999999 110.943 -177.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.9 -48.24 82.49 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.136 0.494 . . . . 30.370000000000001 110.873 178.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.477 ' HG2' HD13 ' B' ' 28' ' ' LEU . 3.2 mt-10 -71.3 -18.61 62.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.564 -0.289 . . . . 41.789999999999999 111.124 -179.889 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.1 m -84.19 -30.33 25.88 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 121.108 -0.237 . . . . 35.469999999999999 111.557 177.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.3 -43.87 69.5 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 119.94 -0.704 . . . . 30.239999999999998 110.748 175.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.422 HD12 HD11 ' B' ' 28' ' ' LEU . 13.5 mt -63.68 -34.13 77.17 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 120.568 -0.453 . . . . 28.280000000000001 111.317 -179.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -64.76 -50.1 68.15 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.133 -0.627 . . . . 51.159999999999997 110.58 173.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -60.62 -45.37 94.29 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 120.83 -0.348 . . . . 28.539999999999999 111.248 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.94 -31.68 72.83 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 119.502 -0.879 . . . . 28.140000000000001 111.154 -179.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.458 ' HB2' HD21 ' B' ' 21' ' ' LEU . 22.5 tt0 -66.77 -46.73 74.41 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 119.605 -0.838 . . . . 45.890000000000001 110.586 174.607 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -45.29 -59.07 2.85 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.997 0.427 . . . . 36.289999999999999 111.108 170.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.95 -44.34 67.01 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.483 -0.326 . . . . 28.609999999999999 111.671 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.2 mt -61.79 -41.31 97.58 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.648 -0.421 . . . . 29.149999999999999 111.804 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 11' ' ' GLN . 55.5 mt-10 -69.74 -39.32 76.85 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 119.482 -0.887 . . . . 38.020000000000003 111.278 178.387 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -55.49 -43.45 75.59 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.749 -0.78 . . . . 33.119999999999997 110.129 171.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.51 -41.7 99.02 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.667 -0.413 . . . . 26.809999999999999 111.316 -177.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -69.4 -29.29 67.01 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 118.768 -1.173 . . . . 35.43 111.831 -174.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 13.5 mt -54.03 -53.53 51.79 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 119.886 -0.726 . . . . 30.43 110.322 166.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.26 -41.14 75.32 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.848 -0.615 . . . . 29.32 111.308 -175.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 51.9 mt -61.36 -55.17 34.55 Favored 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 120.65 -0.42 . . . . 29.829999999999998 111.347 179.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -59.71 -39.7 85.5 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 119.431 -0.908 . . . . 44.479999999999997 110.747 -173.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.37 -47.85 82.51 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.985 -0.686 . . . . 28.399999999999999 110.13 172.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.33 -39.45 93.09 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 119.797 -0.761 . . . . 32.090000000000003 111.015 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.572 ' NH2' ' OE1' ' B' ' 11' ' ' GLN . 4.4 mmm180 -61.12 -43.69 98.49 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.161 -0.615 . . . . 39.869999999999997 111.126 178.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -63.45 -43.96 95.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.993 -0.683 . . . . 37.090000000000003 111.146 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.95 -32.4 65.96 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 119.686 -0.806 . . . . 45.109999999999999 111.448 179.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.67 -24.84 65.91 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 112.08 0.4 . . . . 42.469999999999999 112.08 -178.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.3 mmpt? -66.82 -61.66 1.84 Allowed 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.034 0.445 . . . . 50.399999999999999 110.202 172.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.293 0 C-N-CA 123.149 0.58 . . . . 53.159999999999997 111.587 172.617 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.487 0 N-CA-C 109.175 -0.676 . . . . 35.710000000000001 109.175 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.447 ' OE2' ' N ' ' B' ' 2' ' ' GLU . 27.2 mp0 -70.61 -40.72 73.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.69 -0.686 . . . . 41.030000000000001 110.541 165.47 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . -55.32 -34.0 63.79 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.683 0.278 . . . . 33.100000000000001 110.602 173.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -56.66 -62.26 1.86 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.027 0.441 . . . . 46.049999999999997 110.126 172.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 36.6 m -59.57 -34.83 73.2 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-N 116.506 -0.315 . . . . 32.18 111.63 -177.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.89 -43.05 89.38 Favored 'General case' 0 CA--C 1.52 -0.202 0 C-N-CA 119.831 -0.748 . . . . 30.18 110.902 177.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.511 ' HB3' ' HD3' ' A' ' 25' ' ' ARG . 1.2 mt -68.32 -42.83 78.79 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 120.395 -0.522 . . . . 30.300000000000001 111.547 179.94 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -61.61 -47.08 87.09 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.378 -0.929 . . . . 46.469999999999999 110.375 177.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -53.06 -47.32 68.56 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 120.428 -0.509 . . . . 28.390000000000001 111.069 176.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.92 -44.43 96.79 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 120.228 -0.589 . . . . 28.02 111.124 -175.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' GLN . . . . . 0.572 ' OE1' ' NH2' ' A' ' 25' ' ' ARG . 21.5 tt0 -60.08 -41.94 93.5 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.073 -0.651 . . . . 42.359999999999999 111.09 -178.802 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -58.96 -49.6 77.24 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.761 -0.376 . . . . 42.729999999999997 111.259 175.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.83 -37.43 71.23 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.644 -0.422 . . . . 28.960000000000001 111.108 -176.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.7 mt -66.79 -37.18 84.07 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 119.867 -0.733 . . . . 34.600000000000001 111.556 179.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -62.82 -45.25 93.5 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 120.277 -0.569 . . . . 42.07 110.756 177.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 18.9 mttm -61.25 -37.96 84.96 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 120.205 -0.598 . . . . 32.060000000000002 110.588 173.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.87 -35.56 80.99 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.421 -0.912 . . . . 25.579999999999998 110.886 173.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -70.75 -52.01 23.55 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.314 -0.554 . . . . 35.340000000000003 111.875 -177.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.412 HD12 ' N ' ' B' ' 20' ' ' ALA . 4.3 pp -66.21 -36.47 83.13 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.552 -0.859 . . . . 28.100000000000001 111.473 -173.931 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ALA . . . . . 0.412 ' N ' HD12 ' B' ' 19' ' ' LEU . . . -61.52 -48.23 81.97 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 120.469 -0.493 . . . . 26.100000000000001 110.477 174.025 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.458 HD21 ' HB2' ' A' ' 11' ' ' GLN . 7.3 tp -56.92 -32.47 65.97 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.687 -0.405 . . . . 28.190000000000001 111.387 179.139 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.453 ' OE1' ' NE2' ' A' ' 11' ' ' GLN . 8.7 mm100 -69.66 -39.43 77.04 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 119.509 -0.876 . . . . 33.229999999999997 111.125 -179.972 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.82 -41.82 87.76 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 119.581 -0.847 . . . . 28.469999999999999 110.297 172.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.98 -51.36 67.15 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.372 -0.531 . . . . 29.449999999999999 111.164 -176.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 20.5 mtm180 -56.02 -35.14 66.51 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 119.205 -0.998 . . . . 44.229999999999997 110.822 179.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 71.2 tp60 -62.75 -45.03 94.61 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.471 -0.492 . . . . 42.390000000000001 111.352 178.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.03 -32.23 69.55 Favored 'General case' 0 CA--C 1.514 -0.441 0 O-C-N 122.133 -0.354 . . . . 37.359999999999999 111.78 -179.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LEU . . . . . 0.477 HD13 ' HG2' ' A' ' 4' ' ' GLU . 63.6 mt -62.94 -44.29 96.46 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.02 0.438 . . . . 35.289999999999999 111.273 -176.865 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.7 mmtm -65.56 -27.45 68.45 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.018 -0.673 . . . . 42.020000000000003 111.286 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.503 0 CA-C-O 121.094 0.474 . . . . 44.340000000000003 111.179 169.299 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' 60C . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . 0.429 ' O ' ' HD2' ' A' ' 25' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_