data_5e0m_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 5e0m _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 ' 3' ' ' ASP . . . . . 0.802 ' N ' ' O ' ' A' ' 203' ' ' HOH . 1.0 OUTLIER . . . . . 0 CA--C 1.532 0.258 0 CA-C-O 120.968 0.413 . . . . 96.790000000000006 109.999 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ARG . . . . . 0.538 ' NE ' ' O ' ' A' ' 201' ' ' HOH . 83.3 mtt85 -82.89 138.41 33.89 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 114.008 1.114 . . . . 118.67 114.008 -167.156 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -83.77 124.91 31.39 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 114.609 -1.178 . . . . 79.329999999999998 111.235 -176.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -89.27 126.22 35.42 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 123.405 0.441 . . . . 48.909999999999997 110.425 177.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 94.1 t -129.65 109.05 17.37 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 N-CA-C 106.926 -1.509 . . . . 55.299999999999997 106.926 175.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.2 mt -85.78 121.9 37.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 107.689 -1.226 . . . . 70.400000000000006 107.689 -179.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 66.9 mmtt -95.83 -38.45 10.29 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.234 -0.439 . . . . 85.079999999999998 111.734 -171.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASN . . . . . 0.865 ' OD1' ' O ' ' C' ' 501' ' ' HOH . 52.5 t-20 -153.63 130.43 10.87 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.535 -1.283 . . . . 63.170000000000002 107.535 -179.65 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -144.19 134.58 24.55 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.308 -0.557 . . . . 57.25 110.698 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -126.58 85.13 2.34 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 104.906 -2.257 . . . . 52.710000000000001 104.906 164.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.7 ttm -172.86 143.97 1.27 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.542 -0.754 . . . . 56.759999999999998 110.149 -163.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.7 p -59.93 149.83 30.59 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.023 -0.362 . . . . 64.129999999999995 110.023 179.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -61.43 -33.67 74.1 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.991 -0.283 . . . . 104.68000000000001 110.977 -178.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 52.3 tt0 -65.57 -40.06 92.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.795 0.807 . . . . 122.75 110.051 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 77.8 mtp -75.4 -36.55 60.85 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.805 -0.634 . . . . 62.68 110.787 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -59.75 -42.22 92.72 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 107.523 -1.288 . . . . 62.270000000000003 107.523 177.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLN . . . . . 0.664 ' OE1' ' O ' ' A' ' 202' ' ' HOH . 67.1 tp60 -65.95 -36.33 83.05 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.286 -0.565 . . . . 83.239999999999995 111.704 -178.898 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.45 -39.49 85.37 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.744 -0.465 . . . . 86.519999999999996 109.744 178.787 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.43 -42.51 98.87 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.94 -0.763 . . . . 44.329999999999998 108.94 -178.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 89.7 t -65.87 -39.3 84.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.076 -0.511 . . . . 62.329999999999998 110.584 179.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -66.3 -46.38 77.16 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.082 0.468 . . . . 84.469999999999999 109.744 178.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 49.9 t -59.64 -43.52 93.83 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.126 -0.943 . . . . 51.520000000000003 111.025 -179.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.98 -36.76 82.9 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.231 -0.587 . . . . 42.189999999999998 109.979 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 55.0 m -59.48 -46.9 87.46 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 122.273 -0.267 . . . . 60.07 110.882 174.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -58.8 -44.47 90.78 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.423 -0.584 . . . . 107.31999999999999 109.423 176.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.61 -40.56 95.27 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 116.401 -0.363 . . . . 40.450000000000003 111.917 -176.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 65.5 mt -74.1 -21.45 59.9 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.496 -0.482 . . . . 76.569999999999993 111.146 -177.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -72.99 -42.21 63.51 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.257 -0.646 . . . . 87.980000000000004 109.257 177.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.5 tttp -82.56 -39.17 22.67 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 113.803 1.038 . . . . 90.799999999999997 113.803 -174.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -122.4 153.05 39.56 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.791 1.034 . . . . 90.25 113.791 -169.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -111.79 -18.99 12.59 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 112.944 0.72 . . . . 63.810000000000002 112.944 176.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 35.5 mm -92.86 132.83 36.03 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.364 0 N-CA-C 109.027 -0.731 . . . . 44.270000000000003 109.027 -173.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -56.92 -41.34 78.01 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 114.034 1.124 . . . . 35.170000000000002 114.034 -171.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -67.92 -28.55 67.58 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.047 -0.661 . . . . 87.469999999999999 111.726 -178.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -75.97 -37.89 58.07 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 120.003 -0.679 . . . . 42.770000000000003 109.606 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.0 mt -61.32 -50.77 79.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.963 0.887 . . . . 39.280000000000001 108.924 174.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.34 -39.33 82.8 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 121.328 -0.858 . . . . 31.920000000000002 112.844 178.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.54 -38.4 87.08 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 120.014 -0.674 . . . . 40.090000000000003 110.87 -177.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -63.95 -45.21 90.16 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.999 0.428 . . . . 77.810000000000002 111.016 179.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 84.0 mt -64.69 -49.19 81.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.028 0.442 . . . . 41.299999999999997 110.411 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.21 -44.82 79.86 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.503 0.668 . . . . 51.159999999999997 110.188 -178.56 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -68.36 -41.64 80.37 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.226 -0.443 . . . . 79.989999999999995 111.504 -175.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -59.31 -42.15 90.7 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.531 -0.468 . . . . 83.939999999999998 110.497 176.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -74.74 -32.72 62.18 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 119.228 -0.989 . . . . 53.310000000000002 111.815 -176.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -57.55 -38.23 74.42 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.94 -0.763 . . . . 65.379999999999995 108.94 173.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 mtmm -78.96 -59.59 2.72 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.495 -0.775 . . . . 137.56999999999999 111.243 -176.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.3 mttm -60.11 -35.47 75.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.721 -0.672 . . . . 103.68000000000001 112.804 -178.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -131.83 17.83 4.68 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 114.68 1.363 . . . . 80.599999999999994 114.68 -168.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 75.88 145.28 0.11 Allowed Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 123.412 0.685 . . . . 101.15000000000001 111.509 175.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -64.13 163.6 25.35 Favored 'Trans proline' 0 CA--C 1.532 0.419 0 CA-C-O 117.836 -0.985 . . . . 74.200000000000003 112.488 173.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.5 m -118.44 122.11 41.97 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 125.155 1.382 . . . . 68.109999999999999 110.527 2.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 76.1 m95 -103.83 159.84 15.3 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 113.238 0.829 . . . . 52.380000000000003 113.238 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 -136.2 141.05 43.97 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 106.672 -1.603 . . . . 44.990000000000002 106.672 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 22.1 t -138.26 130.96 29.45 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 120.513 -0.475 . . . . 31.949999999999999 110.753 -176.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.2 mp -119.88 134.81 62.22 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 N-CA-C 107.802 -1.184 . . . . 32.57 107.802 172.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 69.3 t -131.34 129.26 62.27 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 N-CA-C 107.168 -1.419 . . . . 31.73 107.168 -178.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 177.96 175.48 45.16 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 115.41 0.924 . . . . 28.43 115.41 -179.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 84.0 mtt-85 -104.99 -16.81 14.71 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.322 -0.439 . . . . 95.489999999999995 111.675 179.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -147.09 102.29 3.49 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 113.361 0.874 . . . . 39.899999999999999 113.361 178.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -166.07 153.27 9.91 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 121.992 0.901 . . . . 33.140000000000001 110.576 175.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -120.27 161.2 14.64 Favored Glycine 0 N--CA 1.438 -1.199 0 N-CA-C 107.127 -2.389 . . . . 26.77 107.127 167.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.7 p -145.55 156.6 43.8 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 120.449 -0.501 . . . . 31.75 110.946 -177.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -137.5 108.99 6.93 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.149 -1.426 . . . . 53.380000000000003 107.149 162.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 7.1 m -127.24 155.88 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 108.494 -0.928 . . . . 42.289999999999999 108.494 -176.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 29.8 m -109.85 113.15 25.65 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.04 -1.096 . . . . 54.859999999999999 108.04 175.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -111.56 155.8 22.74 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 113.362 0.875 . . . . 57.659999999999997 113.362 -175.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -65.95 138.13 57.62 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.054 -1.43 . . . . 88.319999999999993 108.127 172.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 72.5 p -60.12 138.93 57.79 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.638 -0.875 . . . . 83.060000000000002 108.638 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 24.1 mmm180 72.51 19.52 4.15 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.189 0.995 . . . . 76.519999999999996 113.098 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -141.07 59.59 1.52 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.929 0.395 . . . . 78.090000000000003 111.163 176.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -150.35 129.26 12.53 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.622 -0.717 . . . . 46.240000000000002 109.518 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.7 tt -143.16 140.8 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-O 122.365 1.079 . . . . 51.899999999999999 109.484 168.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -131.42 116.6 17.73 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 105.151 -2.166 . . . . 40.439999999999998 105.151 176.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 27.6 p90 -150.8 161.16 43.18 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 112.857 0.688 . . . . 39.829999999999998 112.857 -177.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -100.2 139.34 36.01 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.052 -1.431 . . . . 43.07 111.067 171.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.6 tp -119.76 101.54 7.96 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 104.787 -2.301 . . . . 51.469999999999999 104.787 166.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.58 -127.49 34.24 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 107.995 -2.042 . . . . 57.890000000000001 107.995 -169.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLN . . . . . 0.795 ' OE1' ' O ' ' A' ' 201' ' ' HOH . 0.2 OUTLIER -88.52 -6.21 57.73 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.375 0.607 . . . . 113.11 111.962 -171.503 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.3 t -101.7 134.36 42.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.064 -0.516 . . . . 77.890000000000001 111.068 -171.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.03 143.05 28.24 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.346 0.593 . . . . 32.990000000000002 110.507 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 81.4 mt -133.07 125.0 50.95 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.805 0 CA-C-N 115.354 -0.839 . . . . 62.380000000000003 108.935 -175.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 36.3 tp -114.0 121.91 45.32 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 107.899 -1.149 . . . . 37.200000000000003 107.899 175.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 45.6 tp -135.77 126.75 27.76 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 109.191 -0.67 . . . . 39.07 109.191 -176.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -162.93 159.68 23.93 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 112.701 0.63 . . . . 45.490000000000002 112.701 -173.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -100.52 149.4 23.74 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.177 -1.046 . . . . 89.469999999999999 108.177 166.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 35.3 t -76.77 139.64 40.48 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 119.701 -0.8 . . . . 64.209999999999994 111.753 -177.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.422 0 N-CA-C 110.743 -0.943 . . . . 85.200000000000003 110.743 171.831 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 468' ' ' ARG . . . . . 1.024 ' NH2' ' O ' ' C' ' 501' ' ' HOH . 20.7 ptt85 . . . . . 0 N--CA 1.454 -0.258 0 CA-C-O 121.414 0.626 . . . . 123.59999999999999 110.731 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 469' ' ' SER . . . . . . . . . . . . . 49.8 m -102.21 133.62 46.8 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.601 -0.727 . . . . 63.840000000000003 109.228 177.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 470' ' ' THR . . . . . . . . . . . . . 6.3 p -140.38 157.56 45.35 Favored 'General case' 0 CA--C 1.509 -0.631 0 C-N-CA 120.696 -0.401 . . . . 86.510000000000005 110.665 177.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 471' ' ' THR . . . . . . . . . . . . . 71.5 p -99.56 152.27 20.21 Favored 'General case' 0 C--O 1.245 0.851 0 CA-C-N 115.456 -0.793 . . . . 47.969999999999999 109.177 175.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 472' ' ' THR . . . . . . . . . . . . . 21.2 p -129.8 149.45 51.54 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 106.019 -1.845 . . . . 40.670000000000002 106.019 165.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 473' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -145.48 125.59 13.72 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 109.764 -0.458 . . . . 39.219999999999999 109.764 174.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 474' ' ' THR . . . . . . . . . . . . . 25.8 p -65.45 145.68 55.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.968 0.413 . . . . 41.060000000000002 110.617 177.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 475' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -64.38 -38.62 91.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.266 -0.879 . . . . 82.620000000000005 110.486 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 476' ' ' MET . . . . . . . . . . . . . 2.0 mpp? . . . . . 0 CA--C 1.539 0.557 0 CA-C-O 121.848 0.832 . . . . 119.37 110.262 176.391 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . 0.795 ' O ' ' OE1' ' A' ' 80' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . 0.664 ' O ' ' OE1' ' A' ' 19' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . 0.802 ' O ' ' N ' ' A' ' 3' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 501' ' ' HOH . . . . . 1.024 ' O ' ' NH2' ' C' ' 468' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASP . . . . . 0.802 ' N ' ' O ' ' A' ' 203' ' ' HOH . 1.0 OUTLIER . . . . . 0 CA--C 1.532 0.258 0 CA-C-O 120.968 0.413 . . . . 89.260000000000005 109.999 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ARG . . . . . 0.538 ' NE ' ' O ' ' A' ' 201' ' ' HOH . 83.3 mtt85 -82.89 138.41 33.89 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 114.008 1.114 . . . . 98.890000000000001 114.008 -167.156 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -83.77 124.91 31.39 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 114.609 -1.178 . . . . 66.109999999999999 111.235 -176.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -89.27 126.22 35.42 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 123.405 0.441 . . . . 43.450000000000003 110.425 177.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 94.1 t -129.65 109.05 17.37 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 N-CA-C 106.926 -1.509 . . . . 46.090000000000003 106.926 175.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.2 mt -85.78 121.9 37.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 107.689 -1.226 . . . . 58.659999999999997 107.689 -179.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 66.9 mmtt -95.83 -38.45 10.29 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.234 -0.439 . . . . 70.900000000000006 111.734 -171.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASN . . . . . 0.865 ' OD1' ' O ' ' C' ' 501' ' ' HOH . 52.5 t-20 -153.63 130.43 10.87 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.535 -1.283 . . . . 52.640000000000001 107.535 -179.65 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -144.19 134.58 24.55 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.308 -0.557 . . . . 49.25 110.698 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -126.58 85.13 2.34 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 104.906 -2.257 . . . . 52.710000000000001 104.906 164.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.7 ttm -172.86 143.97 1.27 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.542 -0.754 . . . . 47.299999999999997 110.149 -163.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.7 p -59.93 149.83 30.59 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.023 -0.362 . . . . 54.18 110.023 179.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -61.43 -33.67 74.1 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.991 -0.283 . . . . 101.79000000000001 110.977 -178.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 52.3 tt0 -65.57 -40.06 92.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.795 0.807 . . . . 119.16 110.051 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 77.8 mtp -75.4 -36.55 60.85 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.805 -0.634 . . . . 55.0 110.787 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -59.75 -42.22 92.72 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 107.523 -1.288 . . . . 51.890000000000001 107.523 177.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLN . . . . . 0.664 ' OE1' ' O ' ' A' ' 202' ' ' HOH . 67.1 tp60 -65.95 -36.33 83.05 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.286 -0.565 . . . . 83.239999999999995 111.704 -178.898 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.45 -39.49 85.37 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.744 -0.465 . . . . 86.519999999999996 109.744 178.787 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.43 -42.51 98.87 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.94 -0.763 . . . . 37.770000000000003 108.94 -178.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 89.7 t -65.87 -39.3 84.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.076 -0.511 . . . . 51.939999999999998 110.584 179.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -66.3 -46.38 77.16 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.082 0.468 . . . . 84.469999999999999 109.744 178.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 49.9 t -59.64 -43.52 93.83 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.126 -0.943 . . . . 56.0 111.025 -179.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.98 -36.76 82.9 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.231 -0.587 . . . . 38.649999999999999 109.979 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 55.0 m -59.48 -46.9 87.46 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 122.273 -0.267 . . . . 50.049999999999997 110.882 174.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -58.8 -44.47 90.78 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.423 -0.584 . . . . 89.430000000000007 109.423 176.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.61 -40.56 95.27 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 116.401 -0.363 . . . . 37.560000000000002 111.917 -176.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 65.5 mt -74.1 -21.45 59.9 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.496 -0.482 . . . . 63.799999999999997 111.146 -177.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -72.99 -42.21 63.51 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.257 -0.646 . . . . 87.980000000000004 109.257 177.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.5 tttp -82.56 -39.17 22.67 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 113.803 1.038 . . . . 75.659999999999997 113.803 -174.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -122.4 153.05 39.56 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.791 1.034 . . . . 75.209999999999994 113.791 -169.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -111.79 -18.99 12.59 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 112.944 0.72 . . . . 53.170000000000002 112.944 176.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 35.5 mm -92.86 132.83 36.03 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.364 0 N-CA-C 109.027 -0.731 . . . . 37.439999999999998 109.027 -173.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -56.92 -41.34 78.01 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 114.034 1.124 . . . . 29.309999999999999 114.034 -171.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -67.92 -28.55 67.58 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.047 -0.661 . . . . 72.890000000000001 111.726 -178.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -75.97 -37.89 58.07 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 120.003 -0.679 . . . . 42.770000000000003 109.606 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.0 mt -61.32 -50.77 79.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.963 0.887 . . . . 32.729999999999997 108.924 174.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.34 -39.33 82.8 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 121.328 -0.858 . . . . 27.640000000000001 112.844 178.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.54 -38.4 87.08 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 120.014 -0.674 . . . . 33.409999999999997 110.87 -177.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -63.95 -45.21 90.16 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.999 0.428 . . . . 64.840000000000003 111.016 179.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 84.0 mt -64.69 -49.19 81.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.028 0.442 . . . . 37.439999999999998 110.411 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.21 -44.82 79.86 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.503 0.668 . . . . 42.630000000000003 110.188 -178.56 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -68.36 -41.64 80.37 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.226 -0.443 . . . . 66.659999999999997 111.504 -175.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -59.31 -42.15 90.7 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.531 -0.468 . . . . 79.989999999999995 110.497 176.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -74.74 -32.72 62.18 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 119.228 -0.989 . . . . 44.43 111.815 -176.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -57.55 -38.23 74.42 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.94 -0.763 . . . . 54.479999999999997 108.94 173.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 mtmm -78.96 -59.59 2.72 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.495 -0.775 . . . . 114.64 111.243 -176.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.3 mttm -60.11 -35.47 75.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.721 -0.672 . . . . 86.400000000000006 112.804 -178.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -131.83 17.83 4.68 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 114.68 1.363 . . . . 67.170000000000002 114.68 -168.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 75.88 145.28 0.11 Allowed Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 123.412 0.685 . . . . 84.299999999999997 111.509 175.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -64.13 163.6 25.35 Favored 'Trans proline' 0 CA--C 1.532 0.419 0 CA-C-O 117.836 -0.985 . . . . 61.829999999999998 112.488 173.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.5 m -118.44 122.11 41.97 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 125.155 1.382 . . . . 56.759999999999998 110.527 2.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 76.1 m95 -103.83 159.84 15.3 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 113.238 0.829 . . . . 43.649999999999999 113.238 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 -136.2 141.05 43.97 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 106.672 -1.603 . . . . 37.490000000000002 106.672 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 22.1 t -138.26 130.96 29.45 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 120.513 -0.475 . . . . 26.629999999999999 110.753 -176.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.2 mp -119.88 134.81 62.22 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 N-CA-C 107.802 -1.184 . . . . 27.140000000000001 107.802 172.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 69.3 t -131.34 129.26 62.27 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 N-CA-C 107.168 -1.419 . . . . 26.440000000000001 107.168 -178.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 177.96 175.48 45.16 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 115.41 0.924 . . . . 25.829999999999998 115.41 -179.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 84.0 mtt-85 -104.99 -16.81 14.71 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.322 -0.439 . . . . 81.560000000000002 111.675 179.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -147.09 102.29 3.49 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 113.361 0.874 . . . . 33.25 113.361 178.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -166.07 153.27 9.91 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 121.992 0.901 . . . . 27.620000000000001 110.576 175.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -120.27 161.2 14.64 Favored Glycine 0 N--CA 1.438 -1.199 0 N-CA-C 107.127 -2.389 . . . . 22.539999999999999 107.127 167.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.7 p -145.55 156.6 43.8 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 120.449 -0.501 . . . . 26.850000000000001 110.946 -177.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -137.5 108.99 6.93 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.149 -1.426 . . . . 44.490000000000002 107.149 162.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 7.1 m -127.24 155.88 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 108.494 -0.928 . . . . 35.240000000000002 108.494 -176.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 29.8 m -109.85 113.15 25.65 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.04 -1.096 . . . . 45.719999999999999 108.04 175.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -111.56 155.8 22.74 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 113.362 0.875 . . . . 57.659999999999997 113.362 -175.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -65.95 138.13 57.62 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.054 -1.43 . . . . 88.319999999999993 108.127 172.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 72.5 p -60.12 138.93 57.79 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.638 -0.875 . . . . 69.219999999999999 108.638 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 24.1 mmm180 72.51 19.52 4.15 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.189 0.995 . . . . 63.759999999999998 113.098 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -141.07 59.59 1.52 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.929 0.395 . . . . 65.069999999999993 111.163 176.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -150.35 129.26 12.53 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.622 -0.717 . . . . 42.270000000000003 109.518 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.7 tt -143.16 140.8 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-O 122.365 1.079 . . . . 43.25 109.484 168.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -131.42 116.6 17.73 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 105.151 -2.166 . . . . 33.700000000000003 105.151 176.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 27.6 p90 -150.8 161.16 43.18 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 112.857 0.688 . . . . 33.189999999999998 112.857 -177.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -100.2 139.34 36.01 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.052 -1.431 . . . . 35.890000000000001 111.067 171.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.6 tp -119.76 101.54 7.96 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 104.787 -2.301 . . . . 42.890000000000001 104.787 166.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.58 -127.49 34.24 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 107.995 -2.042 . . . . 48.509999999999998 107.995 -169.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLN . . . . . 0.795 ' OE1' ' O ' ' A' ' 201' ' ' HOH . 0.2 OUTLIER -88.52 -6.21 57.73 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.375 0.607 . . . . 94.260000000000005 111.962 -171.503 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.3 t -101.7 134.36 42.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.064 -0.516 . . . . 64.909999999999997 111.068 -171.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.03 143.05 28.24 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.346 0.593 . . . . 28.07 110.507 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 81.4 mt -133.07 125.0 50.95 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.805 0 CA-C-N 115.354 -0.839 . . . . 51.979999999999997 108.935 -175.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 36.3 tp -114.0 121.91 45.32 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 107.899 -1.149 . . . . 31.0 107.899 175.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 45.6 tp -135.77 126.75 27.76 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 109.191 -0.67 . . . . 32.560000000000002 109.191 -176.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -162.93 159.68 23.93 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 112.701 0.63 . . . . 37.909999999999997 112.701 -173.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -100.52 149.4 23.74 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.177 -1.046 . . . . 74.560000000000002 108.177 166.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 35.3 t -76.77 139.64 40.48 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 119.701 -0.8 . . . . 64.209999999999994 111.753 -177.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.422 0 N-CA-C 110.743 -0.943 . . . . 85.200000000000003 110.743 171.831 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 468' ' ' ARG . . . . . 1.024 ' NH2' ' O ' ' C' ' 501' ' ' HOH . 20.7 ptt85 . . . . . 0 N--CA 1.454 -0.258 0 CA-C-O 121.414 0.626 . . . . 103.0 110.731 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 469' ' ' SER . . . . . . . . . . . . . 49.8 m -102.21 133.62 46.8 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.601 -0.727 . . . . 54.759999999999998 109.228 177.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 470' ' ' THR . . . . . . . . . . . . . 6.3 p -140.38 157.56 45.35 Favored 'General case' 0 CA--C 1.509 -0.631 0 C-N-CA 120.696 -0.401 . . . . 72.090000000000003 110.665 177.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 471' ' ' THR . . . . . . . . . . . . . 71.5 p -99.56 152.27 20.21 Favored 'General case' 0 C--O 1.245 0.851 0 CA-C-N 115.456 -0.793 . . . . 39.979999999999997 109.177 175.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 472' ' ' THR . . . . . . . . . . . . . 21.2 p -129.8 149.45 51.54 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 106.019 -1.845 . . . . 33.890000000000001 106.019 165.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 473' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -145.48 125.59 13.72 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 109.764 -0.458 . . . . 32.689999999999998 109.764 174.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 474' ' ' THR . . . . . . . . . . . . . 25.8 p -65.45 145.68 55.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.968 0.413 . . . . 41.060000000000002 110.617 177.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 475' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -64.38 -38.62 91.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.266 -0.879 . . . . 82.620000000000005 110.486 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 476' ' ' MET . . . . . . . . . . . . . 2.0 mpp? . . . . . 0 CA--C 1.539 0.557 0 CA-C-O 121.848 0.832 . . . . 100.03 110.262 176.391 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . 0.795 ' O ' ' OE1' ' A' ' 80' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . 0.664 ' O ' ' OE1' ' A' ' 19' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . 0.802 ' O ' ' N ' ' A' ' 3' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 501' ' ' HOH . . . . . 1.024 ' O ' ' NH2' ' C' ' 468' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.802 ' N ' ' O ' ' A' ' 203' ' ' HOH . 1.0 OUTLIER . . . . . 0 CA--C 1.532 0.258 0 CA-C-O 120.968 0.413 . . . . 89.260000000000005 109.999 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.538 ' NE ' ' O ' ' A' ' 201' ' ' HOH . 83.3 mtt85 -82.89 138.41 33.89 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 114.008 1.114 . . . . 98.890000000000001 114.008 -167.156 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -83.77 124.91 31.39 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 114.609 -1.178 . . . . 66.109999999999999 111.235 -176.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -89.27 126.22 35.42 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 123.405 0.441 . . . . 43.450000000000003 110.425 177.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 94.1 t -129.65 109.05 17.37 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 N-CA-C 106.926 -1.509 . . . . 46.090000000000003 106.926 175.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.2 mt -85.78 121.9 37.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 107.689 -1.226 . . . . 58.659999999999997 107.689 -179.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 66.9 mmtt -95.83 -38.45 10.29 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.234 -0.439 . . . . 70.900000000000006 111.734 -171.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.865 ' OD1' ' O ' ' C' ' 501' ' ' HOH . 52.5 t-20 -153.63 130.43 10.87 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.535 -1.283 . . . . 52.640000000000001 107.535 -179.65 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -144.19 134.58 24.55 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.308 -0.557 . . . . 49.25 110.698 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -126.58 85.13 2.34 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 104.906 -2.257 . . . . 52.710000000000001 104.906 164.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.7 ttm -172.86 143.97 1.27 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.542 -0.754 . . . . 47.299999999999997 110.149 -163.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.7 p -59.93 149.83 30.59 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.023 -0.362 . . . . 54.18 110.023 179.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -61.43 -33.67 74.1 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.991 -0.283 . . . . 101.79000000000001 110.977 -178.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 52.3 tt0 -65.57 -40.06 92.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.795 0.807 . . . . 119.16 110.051 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 77.8 mtp -75.4 -36.55 60.85 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.805 -0.634 . . . . 55.0 110.787 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -59.75 -42.22 92.72 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 107.523 -1.288 . . . . 51.890000000000001 107.523 177.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.664 ' OE1' ' O ' ' A' ' 202' ' ' HOH . 67.1 tp60 -65.95 -36.33 83.05 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.286 -0.565 . . . . 83.239999999999995 111.704 -178.898 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.45 -39.49 85.37 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.744 -0.465 . . . . 86.519999999999996 109.744 178.787 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.43 -42.51 98.87 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.94 -0.763 . . . . 37.770000000000003 108.94 -178.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 89.7 t -65.87 -39.3 84.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.076 -0.511 . . . . 51.939999999999998 110.584 179.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -66.3 -46.38 77.16 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.082 0.468 . . . . 84.469999999999999 109.744 178.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 49.9 t -59.64 -43.52 93.83 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.126 -0.943 . . . . 56.0 111.025 -179.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.98 -36.76 82.9 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.231 -0.587 . . . . 38.649999999999999 109.979 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 55.0 m -59.48 -46.9 87.46 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 122.273 -0.267 . . . . 50.049999999999997 110.882 174.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -58.8 -44.47 90.78 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.423 -0.584 . . . . 89.430000000000007 109.423 176.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.61 -40.56 95.27 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 116.401 -0.363 . . . . 37.560000000000002 111.917 -176.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 65.5 mt -74.1 -21.45 59.9 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.496 -0.482 . . . . 63.799999999999997 111.146 -177.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -72.99 -42.21 63.51 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.257 -0.646 . . . . 87.980000000000004 109.257 177.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.5 tttp -82.56 -39.17 22.67 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 113.803 1.038 . . . . 75.659999999999997 113.803 -174.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -122.4 153.05 39.56 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.791 1.034 . . . . 75.209999999999994 113.791 -169.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -111.79 -18.99 12.59 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 112.944 0.72 . . . . 53.170000000000002 112.944 176.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 35.5 mm -92.86 132.83 36.03 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.364 0 N-CA-C 109.027 -0.731 . . . . 37.439999999999998 109.027 -173.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -56.92 -41.34 78.01 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 114.034 1.124 . . . . 29.309999999999999 114.034 -171.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -67.92 -28.55 67.58 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.047 -0.661 . . . . 72.890000000000001 111.726 -178.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -75.97 -37.89 58.07 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 120.003 -0.679 . . . . 42.770000000000003 109.606 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 67.0 mt -61.32 -50.77 79.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.963 0.887 . . . . 32.729999999999997 108.924 174.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.34 -39.33 82.8 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 121.328 -0.858 . . . . 27.640000000000001 112.844 178.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.54 -38.4 87.08 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 120.014 -0.674 . . . . 33.409999999999997 110.87 -177.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -63.95 -45.21 90.16 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.999 0.428 . . . . 64.840000000000003 111.016 179.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 84.0 mt -64.69 -49.19 81.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.028 0.442 . . . . 37.439999999999998 110.411 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.21 -44.82 79.86 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.503 0.668 . . . . 42.630000000000003 110.188 -178.56 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -68.36 -41.64 80.37 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.226 -0.443 . . . . 66.659999999999997 111.504 -175.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -59.31 -42.15 90.7 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.531 -0.468 . . . . 79.989999999999995 110.497 176.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -74.74 -32.72 62.18 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 119.228 -0.989 . . . . 44.43 111.815 -176.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -57.55 -38.23 74.42 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.94 -0.763 . . . . 54.479999999999997 108.94 173.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 mtmm -78.96 -59.59 2.72 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.495 -0.775 . . . . 114.64 111.243 -176.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.3 mttm -60.11 -35.47 75.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.721 -0.672 . . . . 86.400000000000006 112.804 -178.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -131.83 17.83 4.68 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 114.68 1.363 . . . . 67.170000000000002 114.68 -168.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 75.88 145.28 0.11 Allowed Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 123.412 0.685 . . . . 84.299999999999997 111.509 175.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -64.13 163.6 25.35 Favored 'Trans proline' 0 CA--C 1.532 0.419 0 CA-C-O 117.836 -0.985 . . . . 61.829999999999998 112.488 173.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.5 m -118.44 122.11 41.97 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 125.155 1.382 . . . . 56.759999999999998 110.527 2.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 76.1 m95 -103.83 159.84 15.3 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 113.238 0.829 . . . . 43.649999999999999 113.238 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 -136.2 141.05 43.97 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 106.672 -1.603 . . . . 37.490000000000002 106.672 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 22.1 t -138.26 130.96 29.45 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 120.513 -0.475 . . . . 26.629999999999999 110.753 -176.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.2 mp -119.88 134.81 62.22 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 N-CA-C 107.802 -1.184 . . . . 27.140000000000001 107.802 172.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 69.3 t -131.34 129.26 62.27 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 N-CA-C 107.168 -1.419 . . . . 26.440000000000001 107.168 -178.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 177.96 175.48 45.16 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 115.41 0.924 . . . . 25.829999999999998 115.41 -179.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 84.0 mtt-85 -104.99 -16.81 14.71 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.322 -0.439 . . . . 81.560000000000002 111.675 179.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -147.09 102.29 3.49 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 113.361 0.874 . . . . 33.25 113.361 178.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -166.07 153.27 9.91 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 121.992 0.901 . . . . 27.620000000000001 110.576 175.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -120.27 161.2 14.64 Favored Glycine 0 N--CA 1.438 -1.199 0 N-CA-C 107.127 -2.389 . . . . 22.539999999999999 107.127 167.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.7 p -145.55 156.6 43.8 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 120.449 -0.501 . . . . 26.850000000000001 110.946 -177.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -137.5 108.99 6.93 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.149 -1.426 . . . . 44.490000000000002 107.149 162.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 7.1 m -127.24 155.88 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 108.494 -0.928 . . . . 35.240000000000002 108.494 -176.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 29.8 m -109.85 113.15 25.65 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.04 -1.096 . . . . 45.719999999999999 108.04 175.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -111.56 155.8 22.74 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 113.362 0.875 . . . . 57.659999999999997 113.362 -175.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -65.95 138.13 57.62 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.054 -1.43 . . . . 88.319999999999993 108.127 172.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 72.5 p -60.12 138.93 57.79 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.638 -0.875 . . . . 69.219999999999999 108.638 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 24.1 mmm180 72.51 19.52 4.15 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.189 0.995 . . . . 63.759999999999998 113.098 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -141.07 59.59 1.52 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.929 0.395 . . . . 65.069999999999993 111.163 176.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -150.35 129.26 12.53 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.622 -0.717 . . . . 42.270000000000003 109.518 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.7 tt -143.16 140.8 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-O 122.365 1.079 . . . . 43.25 109.484 168.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -131.42 116.6 17.73 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 105.151 -2.166 . . . . 33.700000000000003 105.151 176.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 27.6 p90 -150.8 161.16 43.18 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 112.857 0.688 . . . . 33.189999999999998 112.857 -177.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -100.2 139.34 36.01 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.052 -1.431 . . . . 35.890000000000001 111.067 171.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.6 tp -119.76 101.54 7.96 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 104.787 -2.301 . . . . 42.890000000000001 104.787 166.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.58 -127.49 34.24 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 107.995 -2.042 . . . . 48.509999999999998 107.995 -169.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.795 ' OE1' ' O ' ' A' ' 201' ' ' HOH . 0.2 OUTLIER -88.52 -6.21 57.73 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.375 0.607 . . . . 94.260000000000005 111.962 -171.503 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.3 t -101.7 134.36 42.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.064 -0.516 . . . . 64.909999999999997 111.068 -171.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.03 143.05 28.24 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.346 0.593 . . . . 28.07 110.507 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 81.4 mt -133.07 125.0 50.95 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.805 0 CA-C-N 115.354 -0.839 . . . . 51.979999999999997 108.935 -175.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 36.3 tp -114.0 121.91 45.32 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 107.899 -1.149 . . . . 31.0 107.899 175.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 45.6 tp -135.77 126.75 27.76 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 109.191 -0.67 . . . . 32.560000000000002 109.191 -176.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -162.93 159.68 23.93 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 112.701 0.63 . . . . 37.909999999999997 112.701 -173.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -100.52 149.4 23.74 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.177 -1.046 . . . . 74.560000000000002 108.177 166.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 35.3 t -76.77 139.64 40.48 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 119.701 -0.8 . . . . 64.209999999999994 111.753 -177.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.422 0 N-CA-C 110.743 -0.943 . . . . 85.200000000000003 110.743 171.831 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 468' ' ' ARG . . . . . 1.024 ' NH2' ' O ' ' C' ' 501' ' ' HOH . 20.7 ptt85 . . . . . 0 N--CA 1.454 -0.258 0 CA-C-O 121.414 0.626 . . . . 103.0 110.731 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 469' ' ' SER . . . . . . . . . . . . . 49.8 m -102.21 133.62 46.8 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.601 -0.727 . . . . 54.759999999999998 109.228 177.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 470' ' ' THR . . . . . . . . . . . . . 6.3 p -140.38 157.56 45.35 Favored 'General case' 0 CA--C 1.509 -0.631 0 C-N-CA 120.696 -0.401 . . . . 72.090000000000003 110.665 177.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 471' ' ' THR . . . . . . . . . . . . . 71.5 p -99.56 152.27 20.21 Favored 'General case' 0 C--O 1.245 0.851 0 CA-C-N 115.456 -0.793 . . . . 39.979999999999997 109.177 175.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 472' ' ' THR . . . . . . . . . . . . . 21.2 p -129.8 149.45 51.54 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 106.019 -1.845 . . . . 33.890000000000001 106.019 165.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 473' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -145.48 125.59 13.72 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 109.764 -0.458 . . . . 32.689999999999998 109.764 174.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 474' ' ' THR . . . . . . . . . . . . . 25.8 p -65.45 145.68 55.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.968 0.413 . . . . 41.060000000000002 110.617 177.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 475' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -64.38 -38.62 91.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.266 -0.879 . . . . 82.620000000000005 110.486 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 476' ' ' MET . . . . . . . . . . . . . 2.0 mpp? . . . . . 0 CA--C 1.539 0.557 0 CA-C-O 121.848 0.832 . . . . 100.03 110.262 176.391 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . 0.795 ' O ' ' OE1' ' A' ' 80' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . 0.664 ' O ' ' OE1' ' A' ' 19' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . 0.802 ' O ' ' N ' ' A' ' 3' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 501' ' ' HOH . . . . . 1.024 ' O ' ' NH2' ' C' ' 468' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_