data_5ixu_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 5ixu _Structure_validation_residue.Date_analyzed 2016-10-13 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 ' 7' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.958 0 CA-C-O 122.335 1.064 . . . . 51.810000000000002 113.4 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -157.9 130.58 7.32 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 107.928 -1.138 . . . . 49.009999999999998 107.928 -173.801 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 2.3 t -107.0 138.36 33.26 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 N-CA-C 107.913 -1.143 . . . . 42.159999999999997 107.913 174.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 86.9 tt0 -105.24 119.43 39.04 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.197 -1.038 . . . . 47.18 108.197 163.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 46.9 ttp -100.86 118.58 37.19 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.566 -0.902 . . . . 56.539999999999999 108.566 175.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 67.9 mtp85 -117.55 129.0 55.51 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 109.091 -0.707 . . . . 45.880000000000003 109.091 -176.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.6 m -119.49 127.03 52.66 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.155 -0.475 . . . . 41.07 109.941 -177.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 16.9 m-30 -113.68 116.26 29.17 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 108.812 -0.81 . . . . 49.310000000000002 108.812 -177.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.3 ttm180 -84.37 121.43 27.53 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 108.36 -0.978 . . . . 83.290000000000006 108.36 169.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 49.9 mm -98.68 148.62 5.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 C-N-CA 125.825 1.65 . . . . 60.810000000000002 109.056 -174.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 27.6 m -41.57 125.98 2.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.957 -0.565 . . . . 52.829999999999998 111.065 164.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -46.91 136.44 8.29 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.659 -0.701 . . . . 68.609999999999999 111.373 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.31 -13.92 7.24 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 116.072 1.189 . . . . 60.170000000000002 116.072 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . . . -100.68 10.37 41.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 119.32 1.56 . . . . 54.43 113.352 -170.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 37.4 t -60.52 -46.36 97.33 Favored Pre-proline 0 C--O 1.243 0.744 0 CA-C-O 118.34 -0.838 . . . . 49.859999999999999 112.531 -178.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -59.35 -40.55 66.82 Favored 'Trans proline' 0 CA--C 1.513 -0.542 0 CA-C-N 121.254 1.484 . . . . 52.979999999999997 112.92 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . . . -58.42 -49.72 76.28 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 119.365 -0.934 . . . . 54.280000000000001 110.605 176.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -56.55 -41.15 76.36 Favored 'General case' 0 C--O 1.24 0.602 0 O-C-N 122.321 -0.237 . . . . 49.130000000000003 111.293 -179.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 33.5 mt -72.62 -29.52 63.55 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 119.54 -0.864 . . . . 45.020000000000003 111.892 -175.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . . . -69.24 -47.63 64.19 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 118.949 -1.1 . . . . 51.619999999999997 110.18 175.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.2 mt -60.38 -42.73 91.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.596 0 CA-C-O 120.949 0.405 . . . . 68.650000000000006 110.674 178.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -62.99 -44.17 96.77 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 119.46 -0.896 . . . . 51.619999999999997 109.916 178.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -69.66 -48.36 60.11 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.368 -0.533 . . . . 60.960000000000001 111.26 -174.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -71.3 -22.58 61.93 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.739 0.644 . . . . 91.689999999999998 112.739 -175.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -129.14 -32.72 2.01 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 113.791 1.034 . . . . 71.180000000000007 113.791 -165.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -99.75 -33.99 5.1 Favored Glycine 0 C--N 1.333 0.375 0 N-CA-C 116.245 1.258 . . . . 54.670000000000002 116.245 -175.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 20.5 tp -56.49 -48.35 77.33 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 120.938 0.399 . . . . 55.890000000000001 111.844 -170.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.84 -34.01 85.45 Favored Glycine 0 C--N 1.334 0.468 0 C-N-CA 120.595 -0.812 . . . . 60.670000000000002 113.483 -178.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.3 mt -71.92 -56.56 9.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-N 117.663 0.731 . . . . 58.990000000000002 110.284 -179.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 14.8 tt -68.62 -31.01 49.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 119.615 -0.834 . . . . 49.549999999999997 110.849 -169.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 57.1 p -72.36 -9.3 58.32 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 118.364 -1.334 . . . . 49.380000000000003 112.143 179.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -66.18 -18.02 65.09 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 118.957 -1.097 . . . . 90.939999999999998 111.945 166.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' TYR . . . . . 0.463 ' OH ' ' OD2' ' A' ' 78' ' ' ASP . 52.2 m-85 -120.84 -23.87 5.81 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 115.019 1.489 . . . . 61.850000000000001 115.019 -172.634 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -134.02 153.37 51.83 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 119.704 1.138 . . . . 52.270000000000003 110.353 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . . . -90.39 113.49 25.4 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.198 -0.667 . . . . 55.93 109.198 178.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 24.1 tp -82.38 120.11 25.02 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 109.662 -0.496 . . . . 50.850000000000001 109.662 173.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 13.3 mmm-85 -101.97 -6.22 23.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.457 0.91 . . . . 119.01000000000001 113.457 174.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.43 142.51 4.35 Favored Glycine 0 C--O 1.237 0.323 0 CA-C-N 119.501 1.046 . . . . 53.939999999999998 114.369 178.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 34.6 t -135.89 124.01 23.0 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 117.201 0.5 . . . . 42.439999999999998 109.702 175.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -138.44 155.38 48.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.705 0.764 . . . . 57.140000000000001 110.212 -167.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 56.3 p -107.32 150.54 26.58 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.576 -0.898 . . . . 44.659999999999997 108.576 166.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -81.35 129.99 34.85 Favored 'General case' 0 CA--C 1.51 -0.591 0 C-N-CA 119.03 -1.068 . . . . 44.829999999999998 109.389 -178.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -100.51 3.43 42.84 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 123.506 0.723 . . . . 51.859999999999999 112.866 171.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.7 p -151.08 160.44 43.9 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 108.321 -0.992 . . . . 40.469999999999999 108.321 176.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.47 -129.93 12.83 Favored Glycine 0 N--CA 1.467 0.757 0 C-N-CA 119.83 -1.176 . . . . 39.469999999999999 111.551 -177.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 49.3 m -82.13 107.27 14.69 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 121.611 -0.934 . . . . 44.020000000000003 109.93 -177.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 47.6 mt -73.76 -179.17 3.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.879 0.847 . . . . 43.380000000000003 110.27 -177.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 59.1 40.53 21.84 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.734 -0.604 . . . . 61.25 111.208 -178.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 74.5 m -132.33 128.04 36.85 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.327 -0.62 . . . . 47.130000000000003 109.327 -171.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 59.6 t -109.96 126.46 67.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 108.665 -0.865 . . . . 41.359999999999999 108.665 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.1 t -108.96 125.39 66.02 Favored 'Isoleucine or valine' 0 C--O 1.243 0.749 0 N-CA-C 108.571 -0.899 . . . . 39.939999999999998 108.571 -177.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -110.97 138.05 47.85 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.266 1.026 . . . . 43.619999999999997 110.061 174.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 49.5 m0 -110.23 110.3 21.08 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 108.963 -0.755 . . . . 67.980000000000004 108.963 171.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -106.76 133.75 50.96 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.531 -0.544 . . . . 48.450000000000003 109.531 177.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -112.07 131.88 55.17 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 123.432 0.693 . . . . 43.590000000000003 110.621 -177.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -131.65 157.44 43.71 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.479 -0.563 . . . . 51.659999999999997 109.479 175.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -65.31 -37.64 87.75 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 119.81 -0.756 . . . . 78.549999999999997 111.734 176.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -172.93 179.82 2.22 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 107.604 -1.258 . . . . 74.629999999999995 107.604 -176.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -63.86 -36.45 83.94 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.573 -0.74 . . . . 53.82 112.162 -176.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 20.8 p -77.58 -36.52 51.94 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 117.15 -1.82 . . . . 71.150000000000006 111.716 -176.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 30.0 m80 -60.68 -39.12 87.29 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 118.965 -1.094 . . . . 79.030000000000001 110.596 170.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 66.0 ttt-85 -61.39 -46.64 89.33 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 119.67 -0.812 . . . . 48.700000000000003 110.92 176.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.58 -39.55 94.08 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 119.272 -0.971 . . . . 52.130000000000003 110.745 -177.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.45 -40.93 73.43 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 120.483 -0.487 . . . . 56.210000000000001 111.739 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 39' ' ' TYR . 33.2 mt-30 -70.9 -29.11 65.09 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 119.339 -0.944 . . . . 60.509999999999998 111.858 179.646 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ARG . . . . . 0.6 ' NE ' ' O3 ' ' A' ' 201' ' ' SO4 . 15.5 mmm180 -73.49 -32.77 64.48 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 119.769 -0.772 . . . . 67.909999999999997 111.015 179.702 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 56.1 tt0 -64.59 -44.73 89.7 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.939 -0.704 . . . . 72.5 111.129 173.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . . . -64.59 -32.47 74.14 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 119.603 -0.839 . . . . 51.899999999999999 110.828 -179.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 31.7 tp -68.25 -45.63 72.67 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-O 120.846 0.355 . . . . 49.119999999999997 111.161 174.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -57.29 -38.78 74.48 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.998 -0.681 . . . . 52.119999999999997 111.175 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -77.62 -4.06 44.04 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 113.409 0.892 . . . . 66.790000000000006 113.409 -176.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASP . . . . . 0.463 ' OD2' ' OH ' ' A' ' 39' ' ' TYR . 16.9 t0 -76.9 123.38 87.42 Favored Pre-proline 0 C--N 1.315 -0.905 0 CA-C-N 118.683 0.674 . . . . 62.420000000000002 109.954 -175.104 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -63.14 -41.09 29.64 Favored 'Trans proline' 0 C--O 1.239 0.549 0 CA-C-N 118.955 0.663 . . . . 65.670000000000002 112.584 179.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -54.48 -49.93 68.95 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 120.363 -0.535 . . . . 75.269999999999996 111.083 174.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.6 t-105 -61.76 -41.29 97.48 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.522 -0.871 . . . . 57.549999999999997 111.317 -178.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.52 -31.18 72.1 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 119.25 -0.98 . . . . 74.150000000000006 111.568 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.45 -16.86 60.28 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 119.755 -0.778 . . . . 64.620000000000005 112.954 176.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -90.18 -45.66 8.95 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 113.841 1.052 . . . . 60.43 113.841 -175.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 38.3 p -53.66 -37.75 54.84 Favored Pre-proline 0 C--O 1.242 0.699 0 N-CA-C 114.751 1.389 . . . . 55.289999999999999 114.751 -173.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.04 -21.88 36.53 Favored 'Trans proline' 0 C--O 1.237 0.466 0 CA-C-N 121.887 1.709 . . . . 58.840000000000003 113.796 174.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.0 mtp85 -76.26 -31.17 58.16 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 118.845 -1.142 . . . . 70.890000000000001 112.396 178.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 9.1 pt -92.4 -26.17 4.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 C-N-CA 118.644 -1.222 . . . . 56.75 112.128 178.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.7 t -48.28 -43.33 58.06 Favored Pre-proline 0 C--O 1.243 0.735 0 N-CA-C 113.599 0.962 . . . . 53.68 113.599 -174.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -62.69 -18.65 65.17 Favored 'Trans proline' 0 N--CA 1.477 0.505 0 CA-C-N 120.791 1.318 . . . . 55.43 114.874 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -85.09 -20.14 30.82 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 113.837 1.051 . . . . 77.090000000000003 113.837 176.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 39.6 mt -78.62 105.28 9.8 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 123.507 0.723 . . . . 57.079999999999998 109.483 -169.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -80.08 -32.71 39.23 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 118.472 -1.291 . . . . 91.549999999999997 112.083 173.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 18.1 t60 -166.38 138.93 3.82 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 106.828 -1.545 . . . . 60.670000000000002 106.828 -166.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -129.09 139.97 51.77 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 109.442 -0.577 . . . . 48.810000000000002 109.442 -177.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -147.37 164.18 34.1 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 118.643 -1.223 . . . . 78.219999999999999 111.649 173.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.5 t -151.81 131.11 12.82 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.498 -1.228 . . . . 43.82 109.38 -166.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.6 p -128.2 137.64 56.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 O-C-N 124.617 1.198 . . . . 35.880000000000003 108.421 176.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -100.0 136.29 40.12 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.92 -0.582 . . . . 47.840000000000003 110.395 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 79.5 mt -129.06 134.85 48.27 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.917 -0.583 . . . . 35.909999999999997 109.883 -172.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 33.5 m -122.16 136.74 26.64 Favored Pre-proline 0 C--O 1.24 0.604 0 N-CA-C 108.252 -1.018 . . . . 41.020000000000003 108.252 176.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.26 146.23 85.74 Favored 'Trans proline' 0 C--N 1.323 -0.77 0 C-N-CA 120.637 0.891 . . . . 43.799999999999997 113.394 -171.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.99 168.33 19.7 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 114.938 -1.028 . . . . 45.729999999999997 110.068 165.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.73 -41.03 76.78 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.529 -0.759 . . . . 61.329999999999998 111.632 -175.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 31.2 p90 -95.36 16.95 15.46 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.819 0.674 . . . . 54.170000000000002 112.819 -177.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 49.9 t -64.41 122.94 81.09 Favored Pre-proline 0 C--O 1.239 0.549 0 C-N-CA 120.235 -0.586 . . . . 67.569999999999993 110.624 176.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.43 147.35 41.19 Favored 'Trans proline' 0 C--O 1.234 0.289 0 CA-C-N 119.561 0.879 . . . . 92.569999999999993 111.4 174.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.413 0 C-N-CA 120.032 -0.667 . . . . 84.680000000000007 112.187 -173.971 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' SO4 . . . . . 0.6 ' O3 ' ' NE ' ' A' ' 72' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.958 0 CA-C-O 122.335 1.064 . . . . 51.810000000000002 113.4 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -157.9 130.58 7.32 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 107.928 -1.138 . . . . 49.009999999999998 107.928 -173.801 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 2.3 t -107.0 138.36 33.26 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 N-CA-C 107.913 -1.143 . . . . 42.159999999999997 107.913 174.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 86.9 tt0 -105.24 119.43 39.04 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.197 -1.038 . . . . 47.18 108.197 163.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' MET . . . . . 0.4 ' HB3' HG13 ' A' ' 98' ' ' VAL . 46.9 ttp -100.86 118.58 37.19 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.566 -0.902 . . . . 56.539999999999999 108.566 175.423 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 67.9 mtp85 -117.55 129.0 55.51 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 109.091 -0.707 . . . . 45.880000000000003 109.091 -176.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.6 m -119.49 127.03 52.66 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.155 -0.475 . . . . 41.07 109.941 -177.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 16.9 m-30 -113.68 116.26 29.17 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 108.812 -0.81 . . . . 49.310000000000002 108.812 -177.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.3 ttm180 -84.37 121.43 27.53 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 108.36 -0.978 . . . . 83.290000000000006 108.36 169.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 49.9 mm -98.68 148.62 5.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 C-N-CA 125.825 1.65 . . . . 60.810000000000002 109.056 -174.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 27.6 m -41.57 125.98 2.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.957 -0.565 . . . . 52.829999999999998 111.065 164.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -46.91 136.44 8.29 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.659 -0.701 . . . . 68.609999999999999 111.373 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.31 -13.92 7.24 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 116.072 1.189 . . . . 60.170000000000002 116.072 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . . . -100.68 10.37 41.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 119.32 1.56 . . . . 54.43 113.352 -170.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 37.4 t -60.52 -46.36 97.33 Favored Pre-proline 0 C--O 1.243 0.744 0 CA-C-O 118.34 -0.838 . . . . 49.859999999999999 112.531 -178.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -59.35 -40.55 66.82 Favored 'Trans proline' 0 CA--C 1.513 -0.542 0 CA-C-N 121.254 1.484 . . . . 52.979999999999997 112.92 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . . . -58.42 -49.72 76.28 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 119.365 -0.934 . . . . 54.280000000000001 110.605 176.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -56.55 -41.15 76.36 Favored 'General case' 0 C--O 1.24 0.602 0 O-C-N 122.321 -0.237 . . . . 49.130000000000003 111.293 -179.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 33.5 mt -72.62 -29.52 63.55 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 119.54 -0.864 . . . . 45.020000000000003 111.892 -175.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . . . -69.24 -47.63 64.19 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 118.949 -1.1 . . . . 51.619999999999997 110.18 175.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.2 mt -60.38 -42.73 91.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.596 0 CA-C-O 120.949 0.405 . . . . 68.650000000000006 110.674 178.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -62.99 -44.17 96.77 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 119.46 -0.896 . . . . 51.619999999999997 109.916 178.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -69.66 -48.36 60.11 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.368 -0.533 . . . . 60.960000000000001 111.26 -174.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -71.3 -22.58 61.93 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.739 0.644 . . . . 91.689999999999998 112.739 -175.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -129.14 -32.72 2.01 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 113.791 1.034 . . . . 71.180000000000007 113.791 -165.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -99.75 -33.99 5.1 Favored Glycine 0 C--N 1.333 0.375 0 N-CA-C 116.245 1.258 . . . . 54.670000000000002 116.245 -175.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 20.5 tp -56.49 -48.35 77.33 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 120.938 0.399 . . . . 55.890000000000001 111.844 -170.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.84 -34.01 85.45 Favored Glycine 0 C--N 1.334 0.468 0 C-N-CA 120.595 -0.812 . . . . 60.670000000000002 113.483 -178.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.3 mt -71.92 -56.56 9.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-N 117.663 0.731 . . . . 58.990000000000002 110.284 -179.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 14.8 tt -68.62 -31.01 49.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 119.615 -0.834 . . . . 49.549999999999997 110.849 -169.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 57.1 p -72.36 -9.3 58.32 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 118.364 -1.334 . . . . 49.380000000000003 112.143 179.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -66.18 -18.02 65.09 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 118.957 -1.097 . . . . 90.939999999999998 111.945 166.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' TYR . . . . . 0.439 ' OH ' ' OD2' ' A' ' 78' ' ' ASP . 52.2 m-85 -120.84 -23.87 5.81 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 115.019 1.489 . . . . 61.850000000000001 115.019 -172.634 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -134.02 153.37 51.83 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 119.704 1.138 . . . . 52.270000000000003 110.353 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . . . -90.39 113.49 25.4 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.198 -0.667 . . . . 55.93 109.198 178.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 24.1 tp -82.38 120.11 25.02 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 109.662 -0.496 . . . . 50.850000000000001 109.662 173.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 13.3 mmm-85 -101.97 -6.22 23.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.457 0.91 . . . . 119.01000000000001 113.457 174.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.43 142.51 4.35 Favored Glycine 0 C--O 1.237 0.323 0 CA-C-N 119.501 1.046 . . . . 53.939999999999998 114.369 178.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 34.6 t -135.89 124.01 23.0 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 117.201 0.5 . . . . 42.439999999999998 109.702 175.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -138.44 155.38 48.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.705 0.764 . . . . 57.140000000000001 110.212 -167.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 56.3 p -107.32 150.54 26.58 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.576 -0.898 . . . . 44.659999999999997 108.576 166.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -81.35 129.99 34.85 Favored 'General case' 0 CA--C 1.51 -0.591 0 C-N-CA 119.03 -1.068 . . . . 44.829999999999998 109.389 -178.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -100.51 3.43 42.84 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 123.506 0.723 . . . . 51.859999999999999 112.866 171.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.7 p -151.08 160.44 43.9 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 108.321 -0.992 . . . . 40.469999999999999 108.321 176.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.47 -129.93 12.83 Favored Glycine 0 N--CA 1.467 0.757 0 C-N-CA 119.83 -1.176 . . . . 39.469999999999999 111.551 -177.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 49.3 m -82.13 107.27 14.69 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 121.611 -0.934 . . . . 44.020000000000003 109.93 -177.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 47.6 mt -73.76 -179.17 3.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.879 0.847 . . . . 43.380000000000003 110.27 -177.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 59.1 40.53 21.84 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.734 -0.604 . . . . 61.25 111.208 -178.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 74.5 m -132.33 128.04 36.85 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.327 -0.62 . . . . 47.130000000000003 109.327 -171.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 59.6 t -109.96 126.46 67.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 108.665 -0.865 . . . . 41.359999999999999 108.665 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.1 t -108.96 125.39 66.02 Favored 'Isoleucine or valine' 0 C--O 1.243 0.749 0 N-CA-C 108.571 -0.899 . . . . 39.939999999999998 108.571 -177.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -110.97 138.05 47.85 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.266 1.026 . . . . 43.619999999999997 110.061 174.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 49.5 m0 -110.23 110.3 21.08 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 108.963 -0.755 . . . . 67.980000000000004 108.963 171.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -106.76 133.75 50.96 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.531 -0.544 . . . . 48.450000000000003 109.531 177.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -112.07 131.88 55.17 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 123.432 0.693 . . . . 43.590000000000003 110.621 -177.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -131.65 157.44 43.71 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.479 -0.563 . . . . 51.659999999999997 109.479 175.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -65.31 -37.64 87.75 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 119.81 -0.756 . . . . 78.549999999999997 111.734 176.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -172.93 179.82 2.22 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 107.604 -1.258 . . . . 74.629999999999995 107.604 -176.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -63.86 -36.45 83.94 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.573 -0.74 . . . . 53.82 112.162 -176.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 20.8 p -77.58 -36.52 51.94 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 117.15 -1.82 . . . . 71.150000000000006 111.716 -176.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 30.0 m80 -60.68 -39.12 87.29 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 118.965 -1.094 . . . . 79.030000000000001 110.596 170.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 66.0 ttt-85 -61.39 -46.64 89.33 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 119.67 -0.812 . . . . 48.700000000000003 110.92 176.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.58 -39.55 94.08 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 119.272 -0.971 . . . . 52.130000000000003 110.745 -177.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.45 -40.93 73.43 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 120.483 -0.487 . . . . 56.210000000000001 111.739 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -70.9 -29.11 65.09 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 119.339 -0.944 . . . . 60.509999999999998 111.858 179.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 15.5 mmm180 -73.49 -32.77 64.48 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 119.769 -0.772 . . . . 67.909999999999997 111.015 179.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 56.1 tt0 -64.59 -44.73 89.7 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.939 -0.704 . . . . 72.5 111.129 173.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . . . -64.59 -32.47 74.14 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 119.603 -0.839 . . . . 51.899999999999999 110.828 -179.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 31.7 tp -68.25 -45.63 72.67 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-O 120.846 0.355 . . . . 49.119999999999997 111.161 174.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -57.29 -38.78 74.48 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.998 -0.681 . . . . 52.119999999999997 111.175 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -77.62 -4.06 44.04 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 113.409 0.892 . . . . 66.790000000000006 113.409 -176.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASP . . . . . 0.439 ' OD2' ' OH ' ' A' ' 39' ' ' TYR . 16.9 t0 -76.9 123.38 87.42 Favored Pre-proline 0 C--N 1.315 -0.905 0 CA-C-N 118.683 0.674 . . . . 62.420000000000002 109.954 -175.104 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -63.14 -41.09 29.64 Favored 'Trans proline' 0 C--O 1.239 0.549 0 CA-C-N 118.955 0.663 . . . . 65.670000000000002 112.584 179.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -54.48 -49.93 68.95 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 120.363 -0.535 . . . . 75.269999999999996 111.083 174.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.6 t-105 -61.76 -41.29 97.48 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.522 -0.871 . . . . 57.549999999999997 111.317 -178.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.52 -31.18 72.1 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 119.25 -0.98 . . . . 74.150000000000006 111.568 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.45 -16.86 60.28 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 119.755 -0.778 . . . . 64.620000000000005 112.954 176.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -90.18 -45.66 8.95 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 113.841 1.052 . . . . 60.43 113.841 -175.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' THR . . . . . 0.406 ' OG1' ' HD3' ' A' ' 86' ' ' PRO . 38.3 p -53.66 -37.75 54.84 Favored Pre-proline 0 C--O 1.242 0.699 0 N-CA-C 114.751 1.389 . . . . 55.289999999999999 114.751 -173.508 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PRO . . . . . 0.406 ' HD3' ' OG1' ' A' ' 85' ' ' THR . 52.3 Cg_exo -56.04 -21.88 36.53 Favored 'Trans proline' 0 C--O 1.237 0.466 0 CA-C-N 121.887 1.709 . . . . 58.840000000000003 113.796 174.919 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.0 mtp85 -76.26 -31.17 58.16 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 118.845 -1.142 . . . . 70.890000000000001 112.396 178.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 9.1 pt -92.4 -26.17 4.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 C-N-CA 118.644 -1.222 . . . . 56.75 112.128 178.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.7 t -48.28 -43.33 58.06 Favored Pre-proline 0 C--O 1.243 0.735 0 N-CA-C 113.599 0.962 . . . . 53.68 113.599 -174.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -62.69 -18.65 65.17 Favored 'Trans proline' 0 N--CA 1.477 0.505 0 CA-C-N 120.791 1.318 . . . . 55.43 114.874 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -85.09 -20.14 30.82 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 113.837 1.051 . . . . 77.090000000000003 113.837 176.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 39.6 mt -78.62 105.28 9.8 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 123.507 0.723 . . . . 57.079999999999998 109.483 -169.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -80.08 -32.71 39.23 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 118.472 -1.291 . . . . 91.549999999999997 112.083 173.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 18.1 t60 -166.38 138.93 3.82 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 106.828 -1.545 . . . . 60.670000000000002 106.828 -166.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -129.09 139.97 51.77 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 109.442 -0.577 . . . . 48.810000000000002 109.442 -177.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -147.37 164.18 34.1 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 118.643 -1.223 . . . . 78.219999999999999 111.649 173.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.5 t -151.81 131.11 12.82 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.498 -1.228 . . . . 43.82 109.38 -166.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' VAL . . . . . 0.4 HG13 ' HB3' ' A' ' 11' ' ' MET . 6.6 p -128.2 137.64 56.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 O-C-N 124.617 1.198 . . . . 35.880000000000003 108.421 176.41 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -100.0 136.29 40.12 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.92 -0.582 . . . . 47.840000000000003 110.395 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 79.5 mt -129.06 134.85 48.27 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.917 -0.583 . . . . 35.909999999999997 109.883 -172.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 33.5 m -122.16 136.74 26.64 Favored Pre-proline 0 C--O 1.24 0.604 0 N-CA-C 108.252 -1.018 . . . . 41.020000000000003 108.252 176.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.26 146.23 85.74 Favored 'Trans proline' 0 C--N 1.323 -0.77 0 C-N-CA 120.637 0.891 . . . . 43.799999999999997 113.394 -171.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.99 168.33 19.7 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 114.938 -1.028 . . . . 45.729999999999997 110.068 165.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.73 -41.03 76.78 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.529 -0.759 . . . . 61.329999999999998 111.632 -175.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 31.2 p90 -95.36 16.95 15.46 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.819 0.674 . . . . 54.170000000000002 112.819 -177.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 49.9 t -64.41 122.94 81.09 Favored Pre-proline 0 C--O 1.239 0.549 0 C-N-CA 120.235 -0.586 . . . . 67.569999999999993 110.624 176.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.43 147.35 41.19 Favored 'Trans proline' 0 C--O 1.234 0.289 0 CA-C-N 119.561 0.879 . . . . 92.569999999999993 111.4 174.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.413 0 C-N-CA 120.032 -0.667 . . . . 84.680000000000007 112.187 -173.971 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.958 0 CA-C-O 122.335 1.064 . . . . 51.810000000000002 113.4 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -157.9 130.58 7.32 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 107.928 -1.138 . . . . 49.009999999999998 107.928 -173.801 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 2.3 t -107.0 138.36 33.26 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.634 0 N-CA-C 107.913 -1.143 . . . . 42.159999999999997 107.913 174.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 86.9 tt0 -105.24 119.43 39.04 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.197 -1.038 . . . . 47.18 108.197 163.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' MET . . . . . 0.4 ' HB3' HG13 ' A' ' 98' ' ' VAL . 46.9 ttp -100.86 118.58 37.19 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.566 -0.902 . . . . 56.539999999999999 108.566 175.423 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 67.9 mtp85 -117.55 129.0 55.51 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 109.091 -0.707 . . . . 45.880000000000003 109.091 -176.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.6 m -119.49 127.03 52.66 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.155 -0.475 . . . . 41.07 109.941 -177.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 16.9 m-30 -113.68 116.26 29.17 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 108.812 -0.81 . . . . 49.310000000000002 108.812 -177.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.3 ttm180 -84.37 121.43 27.53 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 108.36 -0.978 . . . . 83.290000000000006 108.36 169.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 49.9 mm -98.68 148.62 5.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 C-N-CA 125.825 1.65 . . . . 60.810000000000002 109.056 -174.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 27.6 m -41.57 125.98 2.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.957 -0.565 . . . . 52.829999999999998 111.065 164.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -46.91 136.44 8.29 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.659 -0.701 . . . . 68.609999999999999 111.373 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.31 -13.92 7.24 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 116.072 1.189 . . . . 60.170000000000002 116.072 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . . . -100.68 10.37 41.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 119.32 1.56 . . . . 54.43 113.352 -170.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 37.4 t -60.52 -46.36 97.33 Favored Pre-proline 0 C--O 1.243 0.744 0 CA-C-O 118.34 -0.838 . . . . 49.859999999999999 112.531 -178.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -59.35 -40.55 66.82 Favored 'Trans proline' 0 CA--C 1.513 -0.542 0 CA-C-N 121.254 1.484 . . . . 52.979999999999997 112.92 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . . . -58.42 -49.72 76.28 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 119.365 -0.934 . . . . 54.280000000000001 110.605 176.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -56.55 -41.15 76.36 Favored 'General case' 0 C--O 1.24 0.602 0 O-C-N 122.321 -0.237 . . . . 49.130000000000003 111.293 -179.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 33.5 mt -72.62 -29.52 63.55 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 119.54 -0.864 . . . . 45.020000000000003 111.892 -175.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . . . -69.24 -47.63 64.19 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 118.949 -1.1 . . . . 51.619999999999997 110.18 175.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.2 mt -60.38 -42.73 91.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.596 0 CA-C-O 120.949 0.405 . . . . 68.650000000000006 110.674 178.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -62.99 -44.17 96.77 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 119.46 -0.896 . . . . 51.619999999999997 109.916 178.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -69.66 -48.36 60.11 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.368 -0.533 . . . . 60.960000000000001 111.26 -174.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -71.3 -22.58 61.93 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.739 0.644 . . . . 91.689999999999998 112.739 -175.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -129.14 -32.72 2.01 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 113.791 1.034 . . . . 71.180000000000007 113.791 -165.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -99.75 -33.99 5.1 Favored Glycine 0 C--N 1.333 0.375 0 N-CA-C 116.245 1.258 . . . . 54.670000000000002 116.245 -175.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 20.5 tp -56.49 -48.35 77.33 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 120.938 0.399 . . . . 55.890000000000001 111.844 -170.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.84 -34.01 85.45 Favored Glycine 0 C--N 1.334 0.468 0 C-N-CA 120.595 -0.812 . . . . 60.670000000000002 113.483 -178.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.3 mt -71.92 -56.56 9.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-N 117.663 0.731 . . . . 58.990000000000002 110.284 -179.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 14.8 tt -68.62 -31.01 49.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 119.615 -0.834 . . . . 49.549999999999997 110.849 -169.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 57.1 p -72.36 -9.3 58.32 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 118.364 -1.334 . . . . 49.380000000000003 112.143 179.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -66.18 -18.02 65.09 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 118.957 -1.097 . . . . 90.939999999999998 111.945 166.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.439 ' OH ' ' OD2' ' A' ' 78' ' ' ASP . 52.2 m-85 -120.84 -23.87 5.81 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 115.019 1.489 . . . . 61.850000000000001 115.019 -172.634 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -134.02 153.37 51.83 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 119.704 1.138 . . . . 52.270000000000003 110.353 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . . . -90.39 113.49 25.4 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.198 -0.667 . . . . 55.93 109.198 178.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 24.1 tp -82.38 120.11 25.02 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 109.662 -0.496 . . . . 50.850000000000001 109.662 173.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 13.3 mmm-85 -101.97 -6.22 23.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.457 0.91 . . . . 119.01000000000001 113.457 174.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.43 142.51 4.35 Favored Glycine 0 C--O 1.237 0.323 0 CA-C-N 119.501 1.046 . . . . 53.939999999999998 114.369 178.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 34.6 t -135.89 124.01 23.0 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 117.201 0.5 . . . . 42.439999999999998 109.702 175.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -138.44 155.38 48.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.705 0.764 . . . . 57.140000000000001 110.212 -167.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 56.3 p -107.32 150.54 26.58 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.576 -0.898 . . . . 44.659999999999997 108.576 166.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -81.35 129.99 34.85 Favored 'General case' 0 CA--C 1.51 -0.591 0 C-N-CA 119.03 -1.068 . . . . 44.829999999999998 109.389 -178.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -100.51 3.43 42.84 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 123.506 0.723 . . . . 51.859999999999999 112.866 171.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.7 p -151.08 160.44 43.9 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 108.321 -0.992 . . . . 40.469999999999999 108.321 176.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.47 -129.93 12.83 Favored Glycine 0 N--CA 1.467 0.757 0 C-N-CA 119.83 -1.176 . . . . 39.469999999999999 111.551 -177.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 49.3 m -82.13 107.27 14.69 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 121.611 -0.934 . . . . 44.020000000000003 109.93 -177.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 47.6 mt -73.76 -179.17 3.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.879 0.847 . . . . 43.380000000000003 110.27 -177.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 59.1 40.53 21.84 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.734 -0.604 . . . . 61.25 111.208 -178.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 74.5 m -132.33 128.04 36.85 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.327 -0.62 . . . . 47.130000000000003 109.327 -171.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 59.6 t -109.96 126.46 67.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 108.665 -0.865 . . . . 41.359999999999999 108.665 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.1 t -108.96 125.39 66.02 Favored 'Isoleucine or valine' 0 C--O 1.243 0.749 0 N-CA-C 108.571 -0.899 . . . . 39.939999999999998 108.571 -177.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -110.97 138.05 47.85 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.266 1.026 . . . . 43.619999999999997 110.061 174.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 49.5 m0 -110.23 110.3 21.08 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 108.963 -0.755 . . . . 67.980000000000004 108.963 171.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -106.76 133.75 50.96 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.531 -0.544 . . . . 48.450000000000003 109.531 177.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -112.07 131.88 55.17 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 123.432 0.693 . . . . 43.590000000000003 110.621 -177.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -131.65 157.44 43.71 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.479 -0.563 . . . . 51.659999999999997 109.479 175.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -65.31 -37.64 87.75 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 119.81 -0.756 . . . . 78.549999999999997 111.734 176.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -172.93 179.82 2.22 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 107.604 -1.258 . . . . 74.629999999999995 107.604 -176.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -63.86 -36.45 83.94 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.573 -0.74 . . . . 53.82 112.162 -176.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 20.8 p -77.58 -36.52 51.94 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 117.15 -1.82 . . . . 71.150000000000006 111.716 -176.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 30.0 m80 -60.68 -39.12 87.29 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 118.965 -1.094 . . . . 79.030000000000001 110.596 170.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 66.0 ttt-85 -61.39 -46.64 89.33 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 119.67 -0.812 . . . . 48.700000000000003 110.92 176.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.58 -39.55 94.08 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 119.272 -0.971 . . . . 52.130000000000003 110.745 -177.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.45 -40.93 73.43 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 120.483 -0.487 . . . . 56.210000000000001 111.739 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -70.9 -29.11 65.09 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 119.339 -0.944 . . . . 60.509999999999998 111.858 179.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 15.5 mmm180 -73.49 -32.77 64.48 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 119.769 -0.772 . . . . 67.909999999999997 111.015 179.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 56.1 tt0 -64.59 -44.73 89.7 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.939 -0.704 . . . . 72.5 111.129 173.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . . . -64.59 -32.47 74.14 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 119.603 -0.839 . . . . 51.899999999999999 110.828 -179.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 31.7 tp -68.25 -45.63 72.67 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-O 120.846 0.355 . . . . 49.119999999999997 111.161 174.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -57.29 -38.78 74.48 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.998 -0.681 . . . . 52.119999999999997 111.175 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -77.62 -4.06 44.04 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 113.409 0.892 . . . . 66.790000000000006 113.409 -176.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.439 ' OD2' ' OH ' ' A' ' 39' ' ' TYR . 16.9 t0 -76.9 123.38 87.42 Favored Pre-proline 0 C--N 1.315 -0.905 0 CA-C-N 118.683 0.674 . . . . 62.420000000000002 109.954 -175.104 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -63.14 -41.09 29.64 Favored 'Trans proline' 0 C--O 1.239 0.549 0 CA-C-N 118.955 0.663 . . . . 65.670000000000002 112.584 179.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -54.48 -49.93 68.95 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 120.363 -0.535 . . . . 75.269999999999996 111.083 174.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.6 t-105 -61.76 -41.29 97.48 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.522 -0.871 . . . . 57.549999999999997 111.317 -178.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.52 -31.18 72.1 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 119.25 -0.98 . . . . 74.150000000000006 111.568 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.45 -16.86 60.28 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 119.755 -0.778 . . . . 64.620000000000005 112.954 176.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -90.18 -45.66 8.95 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 113.841 1.052 . . . . 60.43 113.841 -175.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' THR . . . . . 0.406 ' OG1' ' HD3' ' A' ' 86' ' ' PRO . 38.3 p -53.66 -37.75 54.84 Favored Pre-proline 0 C--O 1.242 0.699 0 N-CA-C 114.751 1.389 . . . . 55.289999999999999 114.751 -173.508 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PRO . . . . . 0.406 ' HD3' ' OG1' ' A' ' 85' ' ' THR . 52.3 Cg_exo -56.04 -21.88 36.53 Favored 'Trans proline' 0 C--O 1.237 0.466 0 CA-C-N 121.887 1.709 . . . . 58.840000000000003 113.796 174.919 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.0 mtp85 -76.26 -31.17 58.16 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 118.845 -1.142 . . . . 70.890000000000001 112.396 178.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 9.1 pt -92.4 -26.17 4.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 C-N-CA 118.644 -1.222 . . . . 56.75 112.128 178.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.7 t -48.28 -43.33 58.06 Favored Pre-proline 0 C--O 1.243 0.735 0 N-CA-C 113.599 0.962 . . . . 53.68 113.599 -174.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -62.69 -18.65 65.17 Favored 'Trans proline' 0 N--CA 1.477 0.505 0 CA-C-N 120.791 1.318 . . . . 55.43 114.874 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -85.09 -20.14 30.82 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 113.837 1.051 . . . . 77.090000000000003 113.837 176.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 39.6 mt -78.62 105.28 9.8 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 123.507 0.723 . . . . 57.079999999999998 109.483 -169.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -80.08 -32.71 39.23 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 118.472 -1.291 . . . . 91.549999999999997 112.083 173.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 18.1 t60 -166.38 138.93 3.82 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 106.828 -1.545 . . . . 60.670000000000002 106.828 -166.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -129.09 139.97 51.77 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 109.442 -0.577 . . . . 48.810000000000002 109.442 -177.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -147.37 164.18 34.1 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 118.643 -1.223 . . . . 78.219999999999999 111.649 173.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.5 t -151.81 131.11 12.82 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.498 -1.228 . . . . 43.82 109.38 -166.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.4 HG13 ' HB3' ' A' ' 11' ' ' MET . 6.6 p -128.2 137.64 56.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 O-C-N 124.617 1.198 . . . . 35.880000000000003 108.421 176.41 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -100.0 136.29 40.12 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.92 -0.582 . . . . 47.840000000000003 110.395 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 79.5 mt -129.06 134.85 48.27 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.917 -0.583 . . . . 35.909999999999997 109.883 -172.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 33.5 m -122.16 136.74 26.64 Favored Pre-proline 0 C--O 1.24 0.604 0 N-CA-C 108.252 -1.018 . . . . 41.020000000000003 108.252 176.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.26 146.23 85.74 Favored 'Trans proline' 0 C--N 1.323 -0.77 0 C-N-CA 120.637 0.891 . . . . 43.799999999999997 113.394 -171.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.99 168.33 19.7 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 114.938 -1.028 . . . . 45.729999999999997 110.068 165.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.73 -41.03 76.78 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.529 -0.759 . . . . 61.329999999999998 111.632 -175.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 31.2 p90 -95.36 16.95 15.46 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.819 0.674 . . . . 54.170000000000002 112.819 -177.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 49.9 t -64.41 122.94 81.09 Favored Pre-proline 0 C--O 1.239 0.549 0 C-N-CA 120.235 -0.586 . . . . 67.569999999999993 110.624 176.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.43 147.35 41.19 Favored 'Trans proline' 0 C--O 1.234 0.289 0 CA-C-N 119.561 0.879 . . . . 92.569999999999993 111.4 174.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.413 0 C-N-CA 120.032 -0.667 . . . . 84.680000000000007 112.187 -173.971 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_