data_5fey_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 5fey _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' ' ' SER . . . . . . . . . . . . . 28.3 p . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.835 0.35 . . . . 93.120000000000005 111.082 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HIS . . . . . 0.494 ' NE2' ' O ' ' B' ' 86' ' ' ILE . 18.4 p-80 -69.38 172.04 7.73 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 122.035 0.921 . . . . 133.44 110.646 -178.127 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 tt -163.2 143.42 9.04 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.299 -0.864 . . . . 83.920000000000002 108.817 178.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 40.5 t-20 -92.04 119.1 31.43 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 108.44 -0.948 . . . . 82.319999999999993 108.44 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.9 tp -74.41 -43.18 57.46 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.008 -0.677 . . . . 73.680000000000007 111.603 -174.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -66.03 -38.57 88.73 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.489 -0.485 . . . . 87.310000000000002 111.438 -179.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.25 -35.57 78.12 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.417 -0.513 . . . . 58.200000000000003 111.411 177.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 33.6 tp -62.44 -33.33 74.6 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.559 -0.456 . . . . 63.399999999999999 111.841 178.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.2 ttm105 -71.92 -37.99 69.96 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.079 -0.648 . . . . 119.45 111.385 176.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -61.87 -43.46 98.8 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.694 -0.403 . . . . 116.06999999999999 111.583 -178.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.3 m -73.18 -11.19 14.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 113.218 0.822 . . . . 52.700000000000003 113.218 -174.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.0 mt -94.57 -0.46 54.53 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.368 0.877 . . . . 57.369999999999997 113.368 -177.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -131.46 149.58 52.47 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 118.689 0.677 . . . . 95.569999999999993 109.682 175.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.3 t -62.13 130.79 93.15 Favored Pre-proline 0 C--O 1.238 0.484 0 CA-C-N 115.464 -0.789 . . . . 94.700000000000003 110.14 -178.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -71.27 -3.55 13.16 Favored 'Trans proline' 0 C--O 1.237 0.431 0 N-CA-C 114.178 0.799 . . . . 96.489999999999995 114.178 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 83.1 mt -101.07 -67.57 0.98 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-N 119.046 0.839 . . . . 102.55 109.97 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 19.0 p -82.96 -4.8 58.67 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.904 0.705 . . . . 104.17 112.904 -177.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 83.9 mmm 63.51 14.95 8.44 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 125.22 1.408 . . . . 135.41 113.392 174.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -93.02 147.08 23.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.312 0.577 . . . . 112.03 110.033 175.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.9 m -68.02 140.61 56.34 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.578 -0.737 . . . . 94.879999999999995 110.621 -179.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -62.63 144.67 55.97 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.683 0.754 . . . . 74.989999999999995 110.821 -179.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.3 p -123.7 177.02 5.9 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 123.928 0.891 . . . . 78.739999999999995 108.802 175.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLU . . . . . 0.479 ' O ' ' NH1' ' A' ' 33' ' ' ARG . 63.4 mt-10 -81.88 -24.35 35.78 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.833 0.679 . . . . 125.94 112.833 -179.023 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . 0.501 ' O ' ' NH2' ' A' ' 45' ' ' ARG . 6.3 pt-20 -122.23 -66.14 1.06 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 118.484 0.584 . . . . 125.27 111.589 -177.45 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.76 -65.84 0.61 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 119.086 0.857 . . . . 135.88 112.111 -175.562 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -97.6 52.57 1.1 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.214 0.53 . . . . 100.79000000000001 111.104 179.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ARG . . . . . 0.479 ' NH1' ' O ' ' A' ' 29' ' ' GLU . 56.0 ttt85 -67.05 128.67 93.93 Favored Pre-proline 0 C--O 1.237 0.417 0 O-C-N 121.966 -0.459 . . . . 69.079999999999998 109.919 -176.453 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -73.68 121.0 6.73 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 120.371 0.714 . . . . 57.340000000000003 110.635 -177.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LYS . . . . . 0.458 ' NZ ' ' OD1' ' A' ' 78' ' ' ASP . 29.5 mmmt -109.04 139.02 44.48 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.937 -0.574 . . . . 79.829999999999998 109.784 -177.33 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.3 mt -94.3 115.02 27.19 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.964 -0.562 . . . . 74.120000000000005 109.913 -179.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.5 mt -74.04 160.01 31.88 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.624 0.725 . . . . 86.079999999999998 109.726 168.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -65.34 -20.29 66.33 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.621 -0.718 . . . . 109.75 112.406 -177.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 19.1 p -78.58 -11.44 59.96 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 113.204 0.816 . . . . 78.609999999999999 113.204 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 104.13 -18.22 46.32 Favored Glycine 0 N--CA 1.445 -0.752 0 CA-C-O 119.184 -0.787 . . . . 72.859999999999999 115.007 178.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -75.71 156.26 34.87 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 118.291 1.045 . . . . 90.870000000000005 110.344 177.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 97.1 m -120.43 129.86 54.09 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.554 -0.748 . . . . 72.299999999999997 110.145 -173.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 17.9 pt -133.34 155.36 40.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 108.006 -1.109 . . . . 89.930000000000007 108.006 172.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.7 p -72.48 168.64 18.1 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.929 0.871 . . . . 77.709999999999994 110.198 -177.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . 0.501 ' NH2' ' O ' ' A' ' 30' ' ' GLU . 23.4 ttp180 -68.46 -41.08 80.74 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.479 -0.782 . . . . 117.22 111.41 -177.883 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -64.72 -45.89 84.65 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.386 -0.526 . . . . 133.00999999999999 111.243 -177.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 84.4 m -63.09 -31.79 73.01 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 119.839 -0.744 . . . . 108.89 111.118 174.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.3 tp -68.46 -32.22 72.08 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 121.156 -0.218 . . . . 120.0 111.577 176.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -64.92 -28.76 69.75 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 112.048 0.388 . . . . 174.75999999999999 112.048 179.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LYS . . . . . 0.537 ' NZ ' ' O ' ' A' ' 202' ' ' HOH . 97.7 mttt -63.98 -37.36 87.15 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.351 -0.54 . . . . 156.09 111.043 178.186 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 21.7 mt -80.27 -11.68 59.7 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.568 0.747 . . . . 144.96000000000001 112.84 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 22.3 tp -73.21 -8.82 57.45 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 123.718 0.807 . . . . 151.69999999999999 113.17 176.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.34 -29.65 66.11 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 118.562 0.619 . . . . 141.30000000000001 112.118 179.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 C--N 1.33 -0.274 0 O-C-N 122.001 -0.437 . . . . 140.83000000000001 110.751 175.383 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 N-CA-C 113.421 0.129 . . . . 123.61 113.421 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' VAL . . . . . 0.551 ' O ' ' N ' ' A' ' 68' ' ' THR . 72.7 t -123.1 131.51 73.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 108.549 -0.908 . . . . 109.88 108.549 -178.751 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.9 ttp180 -104.38 126.43 51.47 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.564 -0.532 . . . . 125.06 109.564 178.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 32.1 t -70.97 135.63 85.21 Favored Pre-proline 0 C--O 1.236 0.354 0 CA-C-N 116.336 -0.393 . . . . 103.58 110.408 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -84.98 -1.82 9.49 Favored 'Trans proline' 0 C--O 1.236 0.404 0 C-N-CA 121.294 1.329 . . . . 126.58 115.551 -176.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -104.04 -50.23 3.43 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.231 0.923 . . . . 140.59999999999999 112.241 179.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 2.7 p -111.88 137.99 49.1 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.846 -1.168 . . . . 118.37 107.846 162.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.7 m -75.31 11.48 1.2 Allowed 'General case' 0 C--O 1.236 0.352 0 N-CA-C 114.08 1.141 . . . . 119.05 114.08 -166.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -68.31 156.55 37.5 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 119.52 1.055 . . . . 137.5 110.339 174.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -115.64 149.02 17.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 108.539 -0.912 . . . . 103.67 108.539 -177.724 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' THR . . . . . 0.551 ' N ' ' O ' ' A' ' 59' ' ' VAL . 91.5 m -112.52 132.74 54.94 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.2 -0.909 . . . . 101.41 109.293 179.915 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 9.3 ttm105 -83.36 149.88 26.45 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.591 0.71 . . . . 164.33000000000001 111.145 -171.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 115.332 -0.849 . . . . 120.31 111.68 -176.711 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 93.5 m . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.879 0.371 . . . . 114.81 111.213 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.8 tp60 -89.9 16.98 7.23 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.093 -0.503 . . . . 183.36000000000001 112.106 176.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.8 mt -67.66 141.39 56.71 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.156 0.503 . . . . 110.08 110.507 177.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.4 p -74.1 142.42 45.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.835 -0.62 . . . . 88.430000000000007 110.317 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASP . . . . . 0.458 ' OD1' ' NZ ' ' A' ' 35' ' ' LYS . 68.2 m-20 -74.53 157.94 34.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.81 0.814 . . . . 85.980000000000004 110.555 174.546 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASN . . . . . 0.473 ' ND2' ' O ' ' A' ' 201' ' ' HOH . 44.8 t-20 -82.3 92.72 7.0 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 106.013 -1.847 . . . . 56.299999999999997 106.013 171.464 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 81.3 mt -66.15 -29.32 69.6 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.701 -0.682 . . . . 59.979999999999997 112.005 -174.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.4 m -65.16 -45.4 85.1 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.76 -0.376 . . . . 48.560000000000002 111.082 179.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 78.3 t -64.97 -44.02 96.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 120.694 -0.402 . . . . 50.119999999999997 110.67 178.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.9 mt -63.75 -40.0 95.65 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 121.886 -0.508 . . . . 54.079999999999998 111.796 -175.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -64.9 -38.29 90.48 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.015 -0.674 . . . . 90.0 111.273 177.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 46.3 mt -66.87 -41.53 87.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 C-N-CA 120.779 -0.368 . . . . 59.530000000000001 110.946 -176.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 31.7 pt -92.46 6.54 5.86 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 O-C-N 121.739 -0.601 . . . . 61.030000000000001 110.161 -172.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -65.12 126.42 28.03 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.897 0.38 . . . . 88.140000000000001 110.469 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.2 m -132.38 39.05 3.42 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.484 0.659 . . . . 96.209999999999994 110.281 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.31 -21.94 63.82 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.383 0.512 . . . . 97.680000000000007 112.383 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 CA-C-N 118.109 0.413 . . . . 91.209999999999994 113.278 179.145 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' SER . . . . . . . . . . . . . 28.2 p . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.702 0.286 . . . . 95.090000000000003 111.041 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -95.51 161.75 13.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.654 0.74 . . . . 119.34999999999999 110.296 178.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 4.1 pp -156.91 148.85 22.77 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.519 -0.764 . . . . 76.030000000000001 109.468 -176.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 41.1 t-20 -87.48 120.8 29.15 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.325 -0.852 . . . . 81.140000000000001 108.962 -178.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 33.9 tp -72.6 -42.55 64.42 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.602 -0.439 . . . . 71.409999999999997 111.366 -174.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -65.61 -38.44 89.43 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.095 -0.642 . . . . 92.959999999999994 111.014 178.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.01 -35.93 79.13 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.242 -0.583 . . . . 49.859999999999999 111.022 176.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 32.9 tp -62.82 -33.3 74.93 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.309 -0.556 . . . . 54.299999999999997 111.221 176.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' ARG . . . . . 0.49 ' NH2' ' O ' ' B' ' 201' ' ' HOH . 5.2 ttm105 -71.77 -38.14 70.39 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.36 -0.536 . . . . 112.48999999999999 111.171 176.01 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -62.4 -44.81 95.58 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.851 0.357 . . . . 106.45999999999999 111.313 -179.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 18.8 m -74.15 -12.32 15.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 113.418 0.896 . . . . 49.939999999999998 113.418 -173.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 53.9 mt -94.76 -0.39 54.27 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 113.088 0.773 . . . . 60.189999999999998 113.088 -178.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -130.43 149.75 51.96 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.451 -0.574 . . . . 94.150000000000006 109.451 175.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' CYS . . . . . . . . . . . . . 53.2 t -62.3 129.83 92.63 Favored Pre-proline 0 C--O 1.239 0.536 0 CA-C-N 115.589 -0.732 . . . . 65.040000000000006 109.96 -178.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -71.43 -3.51 13.15 Favored 'Trans proline' 0 C--O 1.236 0.423 0 N-CA-C 113.994 0.729 . . . . 77.439999999999998 113.994 -179.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 84.1 mt -101.14 -67.15 1.04 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.391 0 CA-C-N 118.856 0.753 . . . . 90.620000000000005 109.926 -179.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' CYS . . . . . . . . . . . . . 19.6 p -83.46 -3.18 57.35 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.531 0.937 . . . . 97.150000000000006 113.531 -176.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 84.3 mmm 64.25 14.83 8.98 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.518 1.127 . . . . 143.49000000000001 112.909 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -93.2 146.14 23.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.364 0.602 . . . . 110.61 110.747 176.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 58.1 m -69.86 140.14 53.16 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.501 -0.772 . . . . 75.700000000000003 110.457 179.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -63.25 145.4 55.61 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.603 0.716 . . . . 62.109999999999999 110.848 -179.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 43.8 p -123.61 176.18 6.37 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 123.865 0.866 . . . . 70.829999999999998 109.199 175.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -82.15 -26.3 33.58 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.773 -0.649 . . . . 116.42 112.601 -177.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -123.47 -65.6 1.07 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 118.242 0.474 . . . . 131.38 111.711 -176.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.61 -64.18 1.04 Allowed 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.842 0.746 . . . . 124.04000000000001 111.241 -176.034 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -96.28 53.3 1.32 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.338 0.589 . . . . 78.280000000000001 111.087 179.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 56.5 ttt85 -66.77 128.59 93.93 Favored Pre-proline 0 C--O 1.236 0.379 0 O-C-N 122.069 -0.395 . . . . 67.810000000000002 110.123 -176.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -74.75 121.19 6.51 Favored 'Trans proline' 0 C--O 1.233 0.239 0 C-N-CA 120.431 0.754 . . . . 54.780000000000001 110.889 -177.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -109.07 139.74 43.56 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.942 -0.572 . . . . 71.989999999999995 109.947 -177.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 6.4 mt -93.69 115.9 28.36 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.947 -0.569 . . . . 62.960000000000001 109.827 -179.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 89.8 mt -73.84 159.93 32.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.752 0.787 . . . . 60.850000000000001 110.056 168.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' HIS . . . . . . . . . . . . . 60.0 m170 -65.79 -20.79 66.38 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.53 -0.759 . . . . 95.239999999999995 112.51 -177.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' CYS . . . . . . . . . . . . . 17.2 p -78.84 -10.74 59.89 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.822 0.675 . . . . 68.430000000000007 112.822 175.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' GLY . . . . . . . . . . . . . . . 104.49 -17.42 46.78 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-O 119.23 -0.761 . . . . 61.450000000000003 114.749 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' HIS . . . . . . . . . . . . . 54.7 m80 -75.43 155.83 35.94 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.177 0.989 . . . . 80.980000000000004 110.645 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 98.5 m -121.2 130.71 53.83 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.239 -0.891 . . . . 54.469999999999999 109.831 -174.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 17.5 pt -132.91 156.76 42.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 N-CA-C 107.983 -1.117 . . . . 81.760000000000005 107.983 172.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' CYS . . . . . . . . . . . . . 3.4 p -71.35 167.83 18.71 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 122.164 0.983 . . . . 71.640000000000001 110.749 -175.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 63.8 ttt-85 -66.66 -34.16 77.26 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 114.889 -1.05 . . . . 116.08 111.852 -177.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -75.24 -46.31 34.62 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.614 -0.434 . . . . 107.11 111.667 -176.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' CYS . . . . . . . . . . . . . 83.4 m -63.29 -31.79 73.03 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.398 -0.521 . . . . 84.340000000000003 111.907 176.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 39.4 tp -67.64 -33.19 74.47 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.269 -0.572 . . . . 91.609999999999999 111.663 178.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -66.3 -32.39 73.76 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.023 -0.671 . . . . 121.42 111.436 176.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -67.14 -38.73 86.04 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.38 -0.528 . . . . 122.56999999999999 111.267 177.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 22.9 mt -80.26 -20.02 45.46 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 119.72 -0.792 . . . . 122.84 112.307 177.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 22.2 tp -80.58 -19.13 46.26 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.804 -0.759 . . . . 124.28 111.628 171.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.39 -32.19 73.42 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.721 -0.392 . . . . 145.06999999999999 111.272 174.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' SER . . . . . . . . . . . . . 13.4 m -97.19 16.96 18.3 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 123.51 0.724 . . . . 143.99000000000001 112.436 176.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.267 0 CA-C-O 120.798 0.333 . . . . 143.13999999999999 111.294 -178.767 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 N-CA-C 113.654 0.221 . . . . 115.31 113.654 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' VAL . . . . . 0.426 ' N ' ' O ' ' B' ' 68' ' ' THR . 72.5 t -122.5 133.34 69.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 108.28 -1.007 . . . . 101.64 108.28 -178.739 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 -102.19 123.81 46.69 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.222 -0.659 . . . . 136.53999999999999 109.222 179.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 34.2 t -73.13 134.9 80.22 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 109.249 -0.649 . . . . 95.329999999999998 109.249 178.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -84.97 -2.02 9.53 Favored 'Trans proline' 0 C--O 1.236 0.423 0 N-CA-C 114.602 0.962 . . . . 93.780000000000001 114.602 -176.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -104.58 -50.09 3.39 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 118.83 0.741 . . . . 93.849999999999994 112.117 -179.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' CYS . . . . . . . . . . . . . 3.3 p -111.94 138.36 48.68 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.378 -0.971 . . . . 101.5 108.378 162.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.2 m -74.53 14.62 0.44 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 113.44 0.904 . . . . 107.2 113.44 -168.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -65.67 156.89 31.54 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 119.082 0.856 . . . . 117.92 110.629 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 3.1 mm -115.62 143.0 26.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-N 115.435 -0.802 . . . . 111.84999999999999 109.22 -176.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' THR . . . . . 0.426 ' O ' ' N ' ' B' ' 59' ' ' VAL . 81.9 m -117.42 123.54 46.64 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.983 -1.117 . . . . 92.430000000000007 107.983 174.481 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.48 104.91 17.36 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.369 -0.604 . . . . 150.27000000000001 109.369 -174.993 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' ILE . . . . . . . . . . . . . 4.3 pt -143.87 155.07 15.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.657 0.742 . . . . 108.42 109.194 176.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 5.5 t -118.41 -4.87 10.84 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.213 -0.903 . . . . 135.47999999999999 112.676 172.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 35.7 t -155.07 145.55 22.12 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 108.158 -1.052 . . . . 114.51000000000001 108.158 176.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -68.57 -21.95 64.5 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.189 -0.604 . . . . 96.409999999999997 112.537 -175.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 5.0 t -63.32 -20.02 65.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 118.207 0.458 . . . . 124.27 112.167 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -76.7 -21.45 55.33 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.634 0.605 . . . . 104.45 112.634 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 6.8 mt -85.96 140.75 30.05 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.081 0.467 . . . . 78.620000000000005 110.595 -178.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.49 143.23 44.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.643 -0.708 . . . . 92.569999999999993 110.845 178.608 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -74.47 158.07 34.48 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.807 0.813 . . . . 75.459999999999994 110.118 172.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -83.74 92.84 7.81 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 107.295 -1.372 . . . . 52.270000000000003 107.295 172.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 86.4 mt -64.36 -30.06 71.11 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.549 -0.75 . . . . 63.990000000000002 111.401 -175.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 2.0 m -66.1 -46.78 76.41 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.363 -0.535 . . . . 54.700000000000003 111.231 179.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' VAL . . . . . . . . . . . . . 77.7 t -64.66 -44.42 96.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 C-N-CA 120.65 -0.42 . . . . 53.340000000000003 110.777 179.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 60.6 mt -63.8 -38.9 92.81 Favored 'General case' 0 C--O 1.238 0.455 0 O-C-N 121.93 -0.481 . . . . 54.219999999999999 111.467 -176.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -63.41 -37.83 88.81 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.445 -0.502 . . . . 96.25 111.036 177.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ILE . . . . . . . . . . . . . 48.8 mt -66.66 -42.09 89.16 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 120.792 0.329 . . . . 59.009999999999998 111.033 -177.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' ILE . . . . . 0.494 ' O ' ' NE2' ' A' ' 8' ' ' HIS . 32.0 pt -94.34 6.12 7.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 O-C-N 121.746 -0.596 . . . . 70.359999999999999 111.488 -172.416 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ASP . . . . . . . . . . . . . 26.2 t70 . . . . . 0 C--N 1.33 -0.272 0 C-N-CA 120.552 -0.459 . . . . 105.94 111.568 179.669 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . 0.473 ' O ' ' ND2' ' A' ' 79' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . 0.537 ' O ' ' NZ ' ' A' ' 50' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' B' B ' 201' ' ' HOH . . . . . 0.49 ' O ' ' NH2' ' B' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 28.3 p . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.835 0.35 . . . . 93.120000000000005 111.082 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HIS . . . . . 0.494 ' NE2' ' O ' ' B' ' 86' ' ' ILE . 18.4 p-80 -69.38 172.04 7.73 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 122.035 0.921 . . . . 133.44 110.646 -178.127 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 tt -163.2 143.42 9.04 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.299 -0.864 . . . . 83.920000000000002 108.817 178.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 40.5 t-20 -92.04 119.1 31.43 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 108.44 -0.948 . . . . 82.319999999999993 108.44 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.9 tp -74.41 -43.18 57.46 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.008 -0.677 . . . . 73.680000000000007 111.603 -174.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -66.03 -38.57 88.73 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.489 -0.485 . . . . 87.310000000000002 111.438 -179.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.25 -35.57 78.12 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.417 -0.513 . . . . 58.200000000000003 111.411 177.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 33.6 tp -62.44 -33.33 74.6 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.559 -0.456 . . . . 63.399999999999999 111.841 178.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.2 ttm105 -71.92 -37.99 69.96 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.079 -0.648 . . . . 119.45 111.385 176.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -61.87 -43.46 98.8 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.694 -0.403 . . . . 116.06999999999999 111.583 -178.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' VAL . . . . . 0.446 ' HB ' HG23 ' B' ' 81' ' ' THR . 18.3 m -73.18 -11.19 14.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 113.218 0.822 . . . . 52.700000000000003 113.218 -174.182 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.0 mt -94.57 -0.46 54.53 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.368 0.877 . . . . 57.369999999999997 113.368 -177.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -131.46 149.58 52.47 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 118.689 0.677 . . . . 95.569999999999993 109.682 175.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.3 t -62.13 130.79 93.15 Favored Pre-proline 0 C--O 1.238 0.484 0 CA-C-N 115.464 -0.789 . . . . 94.700000000000003 110.14 -178.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -71.27 -3.55 13.16 Favored 'Trans proline' 0 C--O 1.237 0.431 0 N-CA-C 114.178 0.799 . . . . 96.489999999999995 114.178 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 83.1 mt -101.07 -67.57 0.98 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-N 119.046 0.839 . . . . 102.55 109.97 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 19.0 p -82.96 -4.8 58.67 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.904 0.705 . . . . 104.17 112.904 -177.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 83.9 mmm 63.51 14.95 8.44 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 125.22 1.408 . . . . 135.41 113.392 174.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -93.02 147.08 23.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.312 0.577 . . . . 112.03 110.033 175.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.9 m -68.02 140.61 56.34 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.578 -0.737 . . . . 94.879999999999995 110.621 -179.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -62.63 144.67 55.97 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.683 0.754 . . . . 74.989999999999995 110.821 -179.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.3 p -123.7 177.02 5.9 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 123.928 0.891 . . . . 78.739999999999995 108.802 175.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLU . . . . . 0.401 ' O ' ' NH1' ' A' ' 33' ' ' ARG . 63.4 mt-10 -81.88 -24.35 35.78 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.833 0.679 . . . . 125.94 112.833 -179.023 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -122.23 -66.14 1.06 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 118.484 0.584 . . . . 125.27 111.589 -177.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLN . . . . . 0.554 ' HB3' HD22 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -59.76 -65.84 0.61 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 119.086 0.857 . . . . 135.88 112.111 -175.562 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . 0.554 HD22 ' HB3' ' A' ' 31' ' ' GLN . 2.2 mm? -97.6 52.57 1.1 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.214 0.53 . . . . 100.79000000000001 111.104 179.755 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ARG . . . . . 0.401 ' NH1' ' O ' ' A' ' 29' ' ' GLU . 56.0 ttt85 -67.05 128.67 93.93 Favored Pre-proline 0 C--O 1.237 0.417 0 O-C-N 121.966 -0.459 . . . . 69.079999999999998 109.919 -176.453 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -73.68 121.0 6.73 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 120.371 0.714 . . . . 57.340000000000003 110.635 -177.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -109.04 139.02 44.48 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.937 -0.574 . . . . 79.829999999999998 109.784 -177.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.3 mt -94.3 115.02 27.19 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.964 -0.562 . . . . 74.120000000000005 109.913 -179.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.5 mt -74.04 160.01 31.88 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.624 0.725 . . . . 86.079999999999998 109.726 168.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -65.34 -20.29 66.33 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.621 -0.718 . . . . 109.75 112.406 -177.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 19.1 p -78.58 -11.44 59.96 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 113.204 0.816 . . . . 78.609999999999999 113.204 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 104.13 -18.22 46.32 Favored Glycine 0 N--CA 1.445 -0.752 0 CA-C-O 119.184 -0.787 . . . . 72.859999999999999 115.007 178.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -75.71 156.26 34.87 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 118.291 1.045 . . . . 90.870000000000005 110.344 177.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 97.1 m -120.43 129.86 54.09 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.554 -0.748 . . . . 72.299999999999997 110.145 -173.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 17.9 pt -133.34 155.36 40.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 108.006 -1.109 . . . . 89.930000000000007 108.006 172.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.7 p -72.48 168.64 18.1 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.929 0.871 . . . . 77.709999999999994 110.198 -177.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . 0.41 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 23.4 ttp180 -68.46 -41.08 80.74 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.479 -0.782 . . . . 117.22 111.41 -177.883 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -64.72 -45.89 84.65 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.386 -0.526 . . . . 133.00999999999999 111.243 -177.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 84.4 m -63.09 -31.79 73.01 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 119.839 -0.744 . . . . 108.89 111.118 174.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . 0.476 HD21 HD12 ' A' ' 76' ' ' LEU . 44.3 tp -68.46 -32.22 72.08 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 121.156 -0.218 . . . . 120.0 111.577 176.08 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 45' ' ' ARG . 97.7 mt-10 -64.92 -28.76 69.75 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 112.048 0.388 . . . . 174.75999999999999 112.048 179.206 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -63.98 -37.36 87.15 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.351 -0.54 . . . . 156.09 111.043 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 21.7 mt -80.27 -11.68 59.7 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.568 0.747 . . . . 144.96000000000001 112.84 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 22.3 tp -73.21 -8.82 57.45 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 123.718 0.807 . . . . 151.69999999999999 113.17 176.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.34 -29.65 66.11 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 118.562 0.619 . . . . 141.30000000000001 112.118 179.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 C--N 1.33 -0.274 0 O-C-N 122.001 -0.437 . . . . 140.83000000000001 110.751 175.383 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 N-CA-C 113.421 0.129 . . . . 123.61 113.421 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 72.7 t -123.1 131.51 73.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 108.549 -0.908 . . . . 109.88 108.549 -178.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ARG . . . . . 0.535 ' HG3' HG22 ' A' ' 67' ' ' ILE . 16.9 ttp180 -104.38 126.43 51.47 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.564 -0.532 . . . . 125.06 109.564 178.543 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 32.1 t -70.97 135.63 85.21 Favored Pre-proline 0 C--O 1.236 0.354 0 CA-C-N 116.336 -0.393 . . . . 103.58 110.408 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -84.98 -1.82 9.49 Favored 'Trans proline' 0 C--O 1.236 0.404 0 C-N-CA 121.294 1.329 . . . . 126.58 115.551 -176.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -104.04 -50.23 3.43 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.231 0.923 . . . . 140.59999999999999 112.241 179.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 2.7 p -111.88 137.99 49.1 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.846 -1.168 . . . . 118.37 107.846 162.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.7 m -75.31 11.48 1.2 Allowed 'General case' 0 C--O 1.236 0.352 0 N-CA-C 114.08 1.141 . . . . 119.05 114.08 -166.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -68.31 156.55 37.5 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 119.52 1.055 . . . . 137.5 110.339 174.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ILE . . . . . 0.535 HG22 ' HG3' ' A' ' 60' ' ' ARG . 0.6 OUTLIER -115.64 149.02 17.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 108.539 -0.912 . . . . 103.67 108.539 -177.724 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 91.5 m -112.52 132.74 54.94 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.2 -0.909 . . . . 101.41 109.293 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 9.3 ttm105 -83.36 149.88 26.45 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.591 0.71 . . . . 164.33000000000001 111.145 -171.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 115.332 -0.849 . . . . 120.31 111.68 -176.711 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 93.5 m . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.879 0.371 . . . . 114.81 111.213 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.8 tp60 -89.9 16.98 7.23 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.093 -0.503 . . . . 183.36000000000001 112.106 176.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . 0.476 HD12 HD21 ' A' ' 48' ' ' LEU . 6.8 mt -67.66 141.39 56.71 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.156 0.503 . . . . 110.08 110.507 177.66 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.4 p -74.1 142.42 45.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.835 -0.62 . . . . 88.430000000000007 110.317 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -74.53 157.94 34.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.81 0.814 . . . . 85.980000000000004 110.555 174.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASN . . . . . 0.473 ' ND2' ' O ' ' A' ' 201' ' ' HOH . 44.8 t-20 -82.3 92.72 7.0 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 106.013 -1.847 . . . . 56.299999999999997 106.013 171.464 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 81.3 mt -66.15 -29.32 69.6 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.701 -0.682 . . . . 59.979999999999997 112.005 -174.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' THR . . . . . 0.515 HG23 ' HB ' ' B' ' 17' ' ' VAL . 2.4 m -65.16 -45.4 85.1 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.76 -0.376 . . . . 48.560000000000002 111.082 179.221 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 78.3 t -64.97 -44.02 96.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 120.694 -0.402 . . . . 50.119999999999997 110.67 178.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.9 mt -63.75 -40.0 95.65 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 121.886 -0.508 . . . . 54.079999999999998 111.796 -175.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -64.9 -38.29 90.48 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.015 -0.674 . . . . 90.0 111.273 177.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 46.3 mt -66.87 -41.53 87.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 C-N-CA 120.779 -0.368 . . . . 59.530000000000001 110.946 -176.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 31.7 pt -92.46 6.54 5.86 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 O-C-N 121.739 -0.601 . . . . 61.030000000000001 110.161 -172.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -65.12 126.42 28.03 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.897 0.38 . . . . 88.140000000000001 110.469 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.2 m -132.38 39.05 3.42 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.484 0.659 . . . . 96.209999999999994 110.281 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.31 -21.94 63.82 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.383 0.512 . . . . 97.680000000000007 112.383 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 CA-C-N 118.109 0.413 . . . . 91.209999999999994 113.278 179.145 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 7' ' ' SER . . . . . . . . . . . . . 28.2 p . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.702 0.286 . . . . 95.090000000000003 111.041 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 8' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -95.51 161.75 13.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.654 0.74 . . . . 119.34999999999999 110.296 178.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 4.1 pp -156.91 148.85 22.77 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.519 -0.764 . . . . 76.030000000000001 109.468 -176.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 41.1 t-20 -87.48 120.8 29.15 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.325 -0.852 . . . . 81.140000000000001 108.962 -178.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 33.9 tp -72.6 -42.55 64.42 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.602 -0.439 . . . . 71.409999999999997 111.366 -174.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -65.61 -38.44 89.43 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.095 -0.642 . . . . 92.959999999999994 111.014 178.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.01 -35.93 79.13 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.242 -0.583 . . . . 49.859999999999999 111.022 176.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 32.9 tp -62.82 -33.3 74.93 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.309 -0.556 . . . . 54.299999999999997 111.221 176.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' ARG . . . . . 0.484 ' NH2' ' O ' ' B' ' 201' ' ' HOH . 5.2 ttm105 -71.77 -38.14 70.39 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.36 -0.536 . . . . 112.48999999999999 111.171 176.01 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -62.4 -44.81 95.58 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.851 0.357 . . . . 106.45999999999999 111.313 -179.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' VAL . . . . . 0.515 ' HB ' HG23 ' A' ' 81' ' ' THR . 18.8 m -74.15 -12.32 15.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 113.418 0.896 . . . . 49.939999999999998 113.418 -173.753 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 53.9 mt -94.76 -0.39 54.27 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 113.088 0.773 . . . . 60.189999999999998 113.088 -178.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' B' ' 26' ' ' SER . 12.7 pt-20 -130.43 149.75 51.96 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.451 -0.574 . . . . 94.150000000000006 109.451 175.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' CYS . . . . . . . . . . . . . 53.2 t -62.3 129.83 92.63 Favored Pre-proline 0 C--O 1.239 0.536 0 CA-C-N 115.589 -0.732 . . . . 65.040000000000006 109.96 -178.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' PRO . . . . . 0.439 ' HB2' ' CZ ' ' B' ' 63' ' ' PHE . 68.4 Cg_endo -71.43 -3.51 13.15 Favored 'Trans proline' 0 C--O 1.236 0.423 0 N-CA-C 113.994 0.729 . . . . 77.439999999999998 113.994 -179.292 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 84.1 mt -101.14 -67.15 1.04 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.391 0 CA-C-N 118.856 0.753 . . . . 90.620000000000005 109.926 -179.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' CYS . . . . . 0.405 ' HB3' ' SG ' ' B' ' 47' ' ' CYS . 19.6 p -83.46 -3.18 57.35 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.531 0.937 . . . . 97.150000000000006 113.531 -176.39 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 84.3 mmm 64.25 14.83 8.98 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.518 1.127 . . . . 143.49000000000001 112.909 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -93.2 146.14 23.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.364 0.602 . . . . 110.61 110.747 176.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' B' ' 19' ' ' GLU . 58.1 m -69.86 140.14 53.16 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.501 -0.772 . . . . 75.700000000000003 110.457 179.23 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -63.25 145.4 55.61 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.603 0.716 . . . . 62.109999999999999 110.848 -179.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 43.8 p -123.61 176.18 6.37 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 123.865 0.866 . . . . 70.829999999999998 109.199 175.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -82.15 -26.3 33.58 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.773 -0.649 . . . . 116.42 112.601 -177.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -123.47 -65.6 1.07 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 118.242 0.474 . . . . 131.38 111.711 -176.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' GLN . . . . . 0.533 ' HB3' HD22 ' B' ' 32' ' ' LEU . 1.0 OUTLIER -59.61 -64.18 1.04 Allowed 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.842 0.746 . . . . 124.04000000000001 111.241 -176.034 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 32' ' ' LEU . . . . . 0.533 HD22 ' HB3' ' B' ' 31' ' ' GLN . 2.3 mm? -96.28 53.3 1.32 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.338 0.589 . . . . 78.280000000000001 111.087 179.933 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 56.5 ttt85 -66.77 128.59 93.93 Favored Pre-proline 0 C--O 1.236 0.379 0 O-C-N 122.069 -0.395 . . . . 67.810000000000002 110.123 -176.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -74.75 121.19 6.51 Favored 'Trans proline' 0 C--O 1.233 0.239 0 C-N-CA 120.431 0.754 . . . . 54.780000000000001 110.889 -177.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -109.07 139.74 43.56 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.942 -0.572 . . . . 71.989999999999995 109.947 -177.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 6.4 mt -93.69 115.9 28.36 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.947 -0.569 . . . . 62.960000000000001 109.827 -179.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 89.8 mt -73.84 159.93 32.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.752 0.787 . . . . 60.850000000000001 110.056 168.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' HIS . . . . . . . . . . . . . 60.0 m170 -65.79 -20.79 66.38 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.53 -0.759 . . . . 95.239999999999995 112.51 -177.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' CYS . . . . . . . . . . . . . 17.2 p -78.84 -10.74 59.89 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.822 0.675 . . . . 68.430000000000007 112.822 175.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' GLY . . . . . . . . . . . . . . . 104.49 -17.42 46.78 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-O 119.23 -0.761 . . . . 61.450000000000003 114.749 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' HIS . . . . . . . . . . . . . 54.7 m80 -75.43 155.83 35.94 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.177 0.989 . . . . 80.980000000000004 110.645 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 98.5 m -121.2 130.71 53.83 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.239 -0.891 . . . . 54.469999999999999 109.831 -174.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ILE . . . . . 0.533 HD11 HD13 ' B' ' 48' ' ' LEU . 17.5 pt -132.91 156.76 42.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 N-CA-C 107.983 -1.117 . . . . 81.760000000000005 107.983 172.688 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' CYS . . . . . . . . . . . . . 3.4 p -71.35 167.83 18.71 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 122.164 0.983 . . . . 71.640000000000001 110.749 -175.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 63.8 ttt-85 -66.66 -34.16 77.26 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 114.889 -1.05 . . . . 116.08 111.852 -177.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -75.24 -46.31 34.62 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.614 -0.434 . . . . 107.11 111.667 -176.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' CYS . . . . . 0.405 ' SG ' ' HB3' ' B' ' 23' ' ' CYS . 83.4 m -63.29 -31.79 73.03 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.398 -0.521 . . . . 84.340000000000003 111.907 176.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LEU . . . . . 0.546 HD21 HD12 ' B' ' 76' ' ' LEU . 39.4 tp -67.64 -33.19 74.47 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.269 -0.572 . . . . 91.609999999999999 111.663 178.334 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -66.3 -32.39 73.76 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.023 -0.671 . . . . 121.42 111.436 176.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -67.14 -38.73 86.04 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.38 -0.528 . . . . 122.56999999999999 111.267 177.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 22.9 mt -80.26 -20.02 45.46 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 119.72 -0.792 . . . . 122.84 112.307 177.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 22.2 tp -80.58 -19.13 46.26 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.804 -0.759 . . . . 124.28 111.628 171.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.39 -32.19 73.42 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.721 -0.392 . . . . 145.06999999999999 111.272 174.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' SER . . . . . . . . . . . . . 13.4 m -97.19 16.96 18.3 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 123.51 0.724 . . . . 143.99000000000001 112.436 176.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.267 0 CA-C-O 120.798 0.333 . . . . 143.13999999999999 111.294 -178.767 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 N-CA-C 113.654 0.221 . . . . 115.31 113.654 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 72.5 t -122.5 133.34 69.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 108.28 -1.007 . . . . 101.64 108.28 -178.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 -102.19 123.81 46.69 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.222 -0.659 . . . . 136.53999999999999 109.222 179.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 34.2 t -73.13 134.9 80.22 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 109.249 -0.649 . . . . 95.329999999999998 109.249 178.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -84.97 -2.02 9.53 Favored 'Trans proline' 0 C--O 1.236 0.423 0 N-CA-C 114.602 0.962 . . . . 93.780000000000001 114.602 -176.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' PHE . . . . . 0.439 ' CZ ' ' HB2' ' B' ' 21' ' ' PRO . 90.4 m-85 -104.58 -50.09 3.39 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 118.83 0.741 . . . . 93.849999999999994 112.117 -179.676 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 64' ' ' CYS . . . . . . . . . . . . . 3.3 p -111.94 138.36 48.68 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.378 -0.971 . . . . 101.5 108.378 162.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.2 m -74.53 14.62 0.44 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 113.44 0.904 . . . . 107.2 113.44 -168.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -65.67 156.89 31.54 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 119.082 0.856 . . . . 117.92 110.629 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 3.1 mm -115.62 143.0 26.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-N 115.435 -0.802 . . . . 111.84999999999999 109.22 -176.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 81.9 m -117.42 123.54 46.64 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.983 -1.117 . . . . 92.430000000000007 107.983 174.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.48 104.91 17.36 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.369 -0.604 . . . . 150.27000000000001 109.369 -174.993 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 70' ' ' ILE . . . . . . . . . . . . . 4.3 pt -143.87 155.07 15.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.657 0.742 . . . . 108.42 109.194 176.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 5.5 t -118.41 -4.87 10.84 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.213 -0.903 . . . . 135.47999999999999 112.676 172.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 35.7 t -155.07 145.55 22.12 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 108.158 -1.052 . . . . 114.51000000000001 108.158 176.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -68.57 -21.95 64.5 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.189 -0.604 . . . . 96.409999999999997 112.537 -175.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 5.0 t -63.32 -20.02 65.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 118.207 0.458 . . . . 124.27 112.167 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -76.7 -21.45 55.33 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.634 0.605 . . . . 104.45 112.634 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' LEU . . . . . 0.546 HD12 HD21 ' B' ' 48' ' ' LEU . 6.8 mt -85.96 140.75 30.05 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.081 0.467 . . . . 78.620000000000005 110.595 -178.53 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.49 143.23 44.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.643 -0.708 . . . . 92.569999999999993 110.845 178.608 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -74.47 158.07 34.48 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.807 0.813 . . . . 75.459999999999994 110.118 172.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -83.74 92.84 7.81 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 107.295 -1.372 . . . . 52.270000000000003 107.295 172.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 86.4 mt -64.36 -30.06 71.11 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.549 -0.75 . . . . 63.990000000000002 111.401 -175.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' THR . . . . . 0.446 HG23 ' HB ' ' A' ' 17' ' ' VAL . 2.0 m -66.1 -46.78 76.41 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.363 -0.535 . . . . 54.700000000000003 111.231 179.609 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 82' ' ' VAL . . . . . . . . . . . . . 77.7 t -64.66 -44.42 96.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 C-N-CA 120.65 -0.42 . . . . 53.340000000000003 110.777 179.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 60.6 mt -63.8 -38.9 92.81 Favored 'General case' 0 C--O 1.238 0.455 0 O-C-N 121.93 -0.481 . . . . 54.219999999999999 111.467 -176.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -63.41 -37.83 88.81 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.445 -0.502 . . . . 96.25 111.036 177.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ILE . . . . . . . . . . . . . 48.8 mt -66.66 -42.09 89.16 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 120.792 0.329 . . . . 59.009999999999998 111.033 -177.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' ILE . . . . . 0.494 ' O ' ' NE2' ' A' ' 8' ' ' HIS . 32.0 pt -94.34 6.12 7.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 O-C-N 121.746 -0.596 . . . . 70.359999999999999 111.488 -172.416 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ASP . . . . . . . . . . . . . 26.2 t70 . . . . . 0 C--N 1.33 -0.272 0 C-N-CA 120.552 -0.459 . . . . 105.94 111.568 179.669 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . 0.473 ' O ' ' ND2' ' A' ' 79' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' B' B ' 201' ' ' HOH . . . . . 0.484 ' O ' ' NH2' ' B' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 28.3 p . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.835 0.35 . . . . 93.120000000000005 111.082 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.494 ' NE2' ' O ' ' B' ' 86' ' ' ILE . 18.4 p-80 -69.38 172.04 7.73 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 122.035 0.921 . . . . 133.44 110.646 -178.127 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 tt -163.2 143.42 9.04 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.299 -0.864 . . . . 83.920000000000002 108.817 178.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 40.5 t-20 -92.04 119.1 31.43 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 108.44 -0.948 . . . . 82.319999999999993 108.44 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.9 tp -74.41 -43.18 57.46 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.008 -0.677 . . . . 73.680000000000007 111.603 -174.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -66.03 -38.57 88.73 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.489 -0.485 . . . . 87.310000000000002 111.438 -179.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.25 -35.57 78.12 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.417 -0.513 . . . . 58.200000000000003 111.411 177.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 33.6 tp -62.44 -33.33 74.6 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.559 -0.456 . . . . 63.399999999999999 111.841 178.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.2 ttm105 -71.92 -37.99 69.96 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.079 -0.648 . . . . 119.45 111.385 176.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -61.87 -43.46 98.8 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.694 -0.403 . . . . 116.06999999999999 111.583 -178.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.446 ' HB ' HG23 ' B' ' 81' ' ' THR . 18.3 m -73.18 -11.19 14.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 113.218 0.822 . . . . 52.700000000000003 113.218 -174.182 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.0 mt -94.57 -0.46 54.53 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.368 0.877 . . . . 57.369999999999997 113.368 -177.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -131.46 149.58 52.47 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 118.689 0.677 . . . . 95.569999999999993 109.682 175.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.3 t -62.13 130.79 93.15 Favored Pre-proline 0 C--O 1.238 0.484 0 CA-C-N 115.464 -0.789 . . . . 94.700000000000003 110.14 -178.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -71.27 -3.55 13.16 Favored 'Trans proline' 0 C--O 1.237 0.431 0 N-CA-C 114.178 0.799 . . . . 96.489999999999995 114.178 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 83.1 mt -101.07 -67.57 0.98 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-N 119.046 0.839 . . . . 102.55 109.97 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 19.0 p -82.96 -4.8 58.67 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.904 0.705 . . . . 104.17 112.904 -177.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 83.9 mmm 63.51 14.95 8.44 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 125.22 1.408 . . . . 135.41 113.392 174.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -93.02 147.08 23.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.312 0.577 . . . . 112.03 110.033 175.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.9 m -68.02 140.61 56.34 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.578 -0.737 . . . . 94.879999999999995 110.621 -179.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -62.63 144.67 55.97 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.683 0.754 . . . . 74.989999999999995 110.821 -179.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.3 p -123.7 177.02 5.9 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 123.928 0.891 . . . . 78.739999999999995 108.802 175.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.401 ' O ' ' NH1' ' A' ' 33' ' ' ARG . 63.4 mt-10 -81.88 -24.35 35.78 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.833 0.679 . . . . 125.94 112.833 -179.023 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -122.23 -66.14 1.06 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 118.484 0.584 . . . . 125.27 111.589 -177.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.554 ' HB3' HD22 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -59.76 -65.84 0.61 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 119.086 0.857 . . . . 135.88 112.111 -175.562 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.554 HD22 ' HB3' ' A' ' 31' ' ' GLN . 2.2 mm? -97.6 52.57 1.1 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.214 0.53 . . . . 100.79000000000001 111.104 179.755 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.401 ' NH1' ' O ' ' A' ' 29' ' ' GLU . 56.0 ttt85 -67.05 128.67 93.93 Favored Pre-proline 0 C--O 1.237 0.417 0 O-C-N 121.966 -0.459 . . . . 69.079999999999998 109.919 -176.453 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -73.68 121.0 6.73 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 120.371 0.714 . . . . 57.340000000000003 110.635 -177.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -109.04 139.02 44.48 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.937 -0.574 . . . . 79.829999999999998 109.784 -177.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.3 mt -94.3 115.02 27.19 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.964 -0.562 . . . . 74.120000000000005 109.913 -179.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.5 mt -74.04 160.01 31.88 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.624 0.725 . . . . 86.079999999999998 109.726 168.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -65.34 -20.29 66.33 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.621 -0.718 . . . . 109.75 112.406 -177.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 19.1 p -78.58 -11.44 59.96 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 113.204 0.816 . . . . 78.609999999999999 113.204 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 104.13 -18.22 46.32 Favored Glycine 0 N--CA 1.445 -0.752 0 CA-C-O 119.184 -0.787 . . . . 72.859999999999999 115.007 178.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -75.71 156.26 34.87 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 118.291 1.045 . . . . 90.870000000000005 110.344 177.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 97.1 m -120.43 129.86 54.09 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.554 -0.748 . . . . 72.299999999999997 110.145 -173.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 17.9 pt -133.34 155.36 40.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 108.006 -1.109 . . . . 89.930000000000007 108.006 172.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.7 p -72.48 168.64 18.1 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.929 0.871 . . . . 77.709999999999994 110.198 -177.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.41 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 23.4 ttp180 -68.46 -41.08 80.74 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.479 -0.782 . . . . 117.22 111.41 -177.883 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -64.72 -45.89 84.65 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.386 -0.526 . . . . 133.00999999999999 111.243 -177.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 84.4 m -63.09 -31.79 73.01 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 119.839 -0.744 . . . . 108.89 111.118 174.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.476 HD21 HD12 ' A' ' 76' ' ' LEU . 44.3 tp -68.46 -32.22 72.08 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 121.156 -0.218 . . . . 120.0 111.577 176.08 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 45' ' ' ARG . 97.7 mt-10 -64.92 -28.76 69.75 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 112.048 0.388 . . . . 174.75999999999999 112.048 179.206 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -63.98 -37.36 87.15 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.351 -0.54 . . . . 156.09 111.043 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 21.7 mt -80.27 -11.68 59.7 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.568 0.747 . . . . 144.96000000000001 112.84 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 22.3 tp -73.21 -8.82 57.45 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 123.718 0.807 . . . . 151.69999999999999 113.17 176.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.34 -29.65 66.11 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 118.562 0.619 . . . . 141.30000000000001 112.118 179.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 C--N 1.33 -0.274 0 O-C-N 122.001 -0.437 . . . . 140.83000000000001 110.751 175.383 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 N-CA-C 113.421 0.129 . . . . 123.61 113.421 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 72.7 t -123.1 131.51 73.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 108.549 -0.908 . . . . 109.88 108.549 -178.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.535 ' HG3' HG22 ' A' ' 67' ' ' ILE . 16.9 ttp180 -104.38 126.43 51.47 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.564 -0.532 . . . . 125.06 109.564 178.543 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 32.1 t -70.97 135.63 85.21 Favored Pre-proline 0 C--O 1.236 0.354 0 CA-C-N 116.336 -0.393 . . . . 103.58 110.408 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -84.98 -1.82 9.49 Favored 'Trans proline' 0 C--O 1.236 0.404 0 C-N-CA 121.294 1.329 . . . . 126.58 115.551 -176.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -104.04 -50.23 3.43 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.231 0.923 . . . . 140.59999999999999 112.241 179.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 2.7 p -111.88 137.99 49.1 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.846 -1.168 . . . . 118.37 107.846 162.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.7 m -75.31 11.48 1.2 Allowed 'General case' 0 C--O 1.236 0.352 0 N-CA-C 114.08 1.141 . . . . 119.05 114.08 -166.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -68.31 156.55 37.5 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 119.52 1.055 . . . . 137.5 110.339 174.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.535 HG22 ' HG3' ' A' ' 60' ' ' ARG . 0.6 OUTLIER -115.64 149.02 17.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 N-CA-C 108.539 -0.912 . . . . 103.67 108.539 -177.724 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 91.5 m -112.52 132.74 54.94 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.2 -0.909 . . . . 101.41 109.293 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 9.3 ttm105 -83.36 149.88 26.45 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.591 0.71 . . . . 164.33000000000001 111.145 -171.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 115.332 -0.849 . . . . 120.31 111.68 -176.711 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 93.5 m . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.879 0.371 . . . . 114.81 111.213 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.8 tp60 -89.9 16.98 7.23 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.093 -0.503 . . . . 183.36000000000001 112.106 176.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.476 HD12 HD21 ' A' ' 48' ' ' LEU . 6.8 mt -67.66 141.39 56.71 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.156 0.503 . . . . 110.08 110.507 177.66 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.4 p -74.1 142.42 45.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.835 -0.62 . . . . 88.430000000000007 110.317 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -74.53 157.94 34.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.81 0.814 . . . . 85.980000000000004 110.555 174.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.473 ' ND2' ' O ' ' A' ' 201' ' ' HOH . 44.8 t-20 -82.3 92.72 7.0 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 106.013 -1.847 . . . . 56.299999999999997 106.013 171.464 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 81.3 mt -66.15 -29.32 69.6 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.701 -0.682 . . . . 59.979999999999997 112.005 -174.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' THR . . . . . 0.515 HG23 ' HB ' ' B' ' 17' ' ' VAL . 2.4 m -65.16 -45.4 85.1 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.76 -0.376 . . . . 48.560000000000002 111.082 179.221 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 78.3 t -64.97 -44.02 96.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 120.694 -0.402 . . . . 50.119999999999997 110.67 178.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.9 mt -63.75 -40.0 95.65 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 121.886 -0.508 . . . . 54.079999999999998 111.796 -175.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -64.9 -38.29 90.48 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.015 -0.674 . . . . 90.0 111.273 177.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 46.3 mt -66.87 -41.53 87.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 C-N-CA 120.779 -0.368 . . . . 59.530000000000001 110.946 -176.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 31.7 pt -92.46 6.54 5.86 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 O-C-N 121.739 -0.601 . . . . 61.030000000000001 110.161 -172.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -65.12 126.42 28.03 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.897 0.38 . . . . 88.140000000000001 110.469 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.2 m -132.38 39.05 3.42 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.484 0.659 . . . . 96.209999999999994 110.281 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.31 -21.94 63.82 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.383 0.512 . . . . 97.680000000000007 112.383 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 CA-C-N 118.109 0.413 . . . . 91.209999999999994 113.278 179.145 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' SER . . . . . . . . . . . . . 28.2 p . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.702 0.286 . . . . 95.090000000000003 111.041 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -95.51 161.75 13.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.654 0.74 . . . . 119.34999999999999 110.296 178.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 4.1 pp -156.91 148.85 22.77 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.519 -0.764 . . . . 76.030000000000001 109.468 -176.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 41.1 t-20 -87.48 120.8 29.15 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.325 -0.852 . . . . 81.140000000000001 108.962 -178.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 33.9 tp -72.6 -42.55 64.42 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.602 -0.439 . . . . 71.409999999999997 111.366 -174.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -65.61 -38.44 89.43 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.095 -0.642 . . . . 92.959999999999994 111.014 178.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.01 -35.93 79.13 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.242 -0.583 . . . . 49.859999999999999 111.022 176.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 32.9 tp -62.82 -33.3 74.93 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.309 -0.556 . . . . 54.299999999999997 111.221 176.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' ARG . . . . . 0.484 ' NH2' ' O ' ' B' ' 201' ' ' HOH . 5.2 ttm105 -71.77 -38.14 70.39 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.36 -0.536 . . . . 112.48999999999999 111.171 176.01 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -62.4 -44.81 95.58 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.851 0.357 . . . . 106.45999999999999 111.313 -179.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.515 ' HB ' HG23 ' A' ' 81' ' ' THR . 18.8 m -74.15 -12.32 15.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 113.418 0.896 . . . . 49.939999999999998 113.418 -173.753 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 53.9 mt -94.76 -0.39 54.27 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 113.088 0.773 . . . . 60.189999999999998 113.088 -178.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' B' ' 26' ' ' SER . 12.7 pt-20 -130.43 149.75 51.96 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.451 -0.574 . . . . 94.150000000000006 109.451 175.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' CYS . . . . . . . . . . . . . 53.2 t -62.3 129.83 92.63 Favored Pre-proline 0 C--O 1.239 0.536 0 CA-C-N 115.589 -0.732 . . . . 65.040000000000006 109.96 -178.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' PRO . . . . . 0.439 ' HB2' ' CZ ' ' B' ' 63' ' ' PHE . 68.4 Cg_endo -71.43 -3.51 13.15 Favored 'Trans proline' 0 C--O 1.236 0.423 0 N-CA-C 113.994 0.729 . . . . 77.439999999999998 113.994 -179.292 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 84.1 mt -101.14 -67.15 1.04 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.391 0 CA-C-N 118.856 0.753 . . . . 90.620000000000005 109.926 -179.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' CYS . . . . . 0.405 ' HB3' ' SG ' ' B' ' 47' ' ' CYS . 19.6 p -83.46 -3.18 57.35 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.531 0.937 . . . . 97.150000000000006 113.531 -176.39 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 84.3 mmm 64.25 14.83 8.98 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.518 1.127 . . . . 143.49000000000001 112.909 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -93.2 146.14 23.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.364 0.602 . . . . 110.61 110.747 176.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' B' ' 19' ' ' GLU . 58.1 m -69.86 140.14 53.16 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.501 -0.772 . . . . 75.700000000000003 110.457 179.23 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -63.25 145.4 55.61 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.603 0.716 . . . . 62.109999999999999 110.848 -179.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 43.8 p -123.61 176.18 6.37 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 123.865 0.866 . . . . 70.829999999999998 109.199 175.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -82.15 -26.3 33.58 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.773 -0.649 . . . . 116.42 112.601 -177.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -123.47 -65.6 1.07 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 118.242 0.474 . . . . 131.38 111.711 -176.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' GLN . . . . . 0.533 ' HB3' HD22 ' B' ' 32' ' ' LEU . 1.0 OUTLIER -59.61 -64.18 1.04 Allowed 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.842 0.746 . . . . 124.04000000000001 111.241 -176.034 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.533 HD22 ' HB3' ' B' ' 31' ' ' GLN . 2.3 mm? -96.28 53.3 1.32 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.338 0.589 . . . . 78.280000000000001 111.087 179.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 56.5 ttt85 -66.77 128.59 93.93 Favored Pre-proline 0 C--O 1.236 0.379 0 O-C-N 122.069 -0.395 . . . . 67.810000000000002 110.123 -176.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -74.75 121.19 6.51 Favored 'Trans proline' 0 C--O 1.233 0.239 0 C-N-CA 120.431 0.754 . . . . 54.780000000000001 110.889 -177.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -109.07 139.74 43.56 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.942 -0.572 . . . . 71.989999999999995 109.947 -177.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 6.4 mt -93.69 115.9 28.36 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.947 -0.569 . . . . 62.960000000000001 109.827 -179.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 89.8 mt -73.84 159.93 32.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.752 0.787 . . . . 60.850000000000001 110.056 168.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' HIS . . . . . . . . . . . . . 60.0 m170 -65.79 -20.79 66.38 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.53 -0.759 . . . . 95.239999999999995 112.51 -177.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' CYS . . . . . . . . . . . . . 17.2 p -78.84 -10.74 59.89 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.822 0.675 . . . . 68.430000000000007 112.822 175.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' GLY . . . . . . . . . . . . . . . 104.49 -17.42 46.78 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-O 119.23 -0.761 . . . . 61.450000000000003 114.749 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' HIS . . . . . . . . . . . . . 54.7 m80 -75.43 155.83 35.94 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.177 0.989 . . . . 80.980000000000004 110.645 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 98.5 m -121.2 130.71 53.83 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.239 -0.891 . . . . 54.469999999999999 109.831 -174.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.533 HD11 HD13 ' B' ' 48' ' ' LEU . 17.5 pt -132.91 156.76 42.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 N-CA-C 107.983 -1.117 . . . . 81.760000000000005 107.983 172.688 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' CYS . . . . . . . . . . . . . 3.4 p -71.35 167.83 18.71 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 122.164 0.983 . . . . 71.640000000000001 110.749 -175.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 63.8 ttt-85 -66.66 -34.16 77.26 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 114.889 -1.05 . . . . 116.08 111.852 -177.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -75.24 -46.31 34.62 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.614 -0.434 . . . . 107.11 111.667 -176.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' CYS . . . . . 0.405 ' SG ' ' HB3' ' B' ' 23' ' ' CYS . 83.4 m -63.29 -31.79 73.03 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.398 -0.521 . . . . 84.340000000000003 111.907 176.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.546 HD21 HD12 ' B' ' 76' ' ' LEU . 39.4 tp -67.64 -33.19 74.47 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.269 -0.572 . . . . 91.609999999999999 111.663 178.334 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -66.3 -32.39 73.76 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.023 -0.671 . . . . 121.42 111.436 176.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -67.14 -38.73 86.04 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.38 -0.528 . . . . 122.56999999999999 111.267 177.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 22.9 mt -80.26 -20.02 45.46 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 119.72 -0.792 . . . . 122.84 112.307 177.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 22.2 tp -80.58 -19.13 46.26 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.804 -0.759 . . . . 124.28 111.628 171.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.39 -32.19 73.42 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.721 -0.392 . . . . 145.06999999999999 111.272 174.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' SER . . . . . . . . . . . . . 13.4 m -97.19 16.96 18.3 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 123.51 0.724 . . . . 143.99000000000001 112.436 176.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.267 0 CA-C-O 120.798 0.333 . . . . 143.13999999999999 111.294 -178.767 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 N-CA-C 113.654 0.221 . . . . 115.31 113.654 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 72.5 t -122.5 133.34 69.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 108.28 -1.007 . . . . 101.64 108.28 -178.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 -102.19 123.81 46.69 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.222 -0.659 . . . . 136.53999999999999 109.222 179.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 34.2 t -73.13 134.9 80.22 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 109.249 -0.649 . . . . 95.329999999999998 109.249 178.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -84.97 -2.02 9.53 Favored 'Trans proline' 0 C--O 1.236 0.423 0 N-CA-C 114.602 0.962 . . . . 93.780000000000001 114.602 -176.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' PHE . . . . . 0.439 ' CZ ' ' HB2' ' B' ' 21' ' ' PRO . 90.4 m-85 -104.58 -50.09 3.39 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 118.83 0.741 . . . . 93.849999999999994 112.117 -179.676 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' CYS . . . . . . . . . . . . . 3.3 p -111.94 138.36 48.68 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.378 -0.971 . . . . 101.5 108.378 162.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.2 m -74.53 14.62 0.44 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 113.44 0.904 . . . . 107.2 113.44 -168.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -65.67 156.89 31.54 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 119.082 0.856 . . . . 117.92 110.629 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 3.1 mm -115.62 143.0 26.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-N 115.435 -0.802 . . . . 111.84999999999999 109.22 -176.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 81.9 m -117.42 123.54 46.64 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.983 -1.117 . . . . 92.430000000000007 107.983 174.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.48 104.91 17.36 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.369 -0.604 . . . . 150.27000000000001 109.369 -174.993 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' ILE . . . . . . . . . . . . . 4.3 pt -143.87 155.07 15.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.657 0.742 . . . . 108.42 109.194 176.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 5.5 t -118.41 -4.87 10.84 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.213 -0.903 . . . . 135.47999999999999 112.676 172.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 35.7 t -155.07 145.55 22.12 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 108.158 -1.052 . . . . 114.51000000000001 108.158 176.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -68.57 -21.95 64.5 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.189 -0.604 . . . . 96.409999999999997 112.537 -175.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 5.0 t -63.32 -20.02 65.13 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 118.207 0.458 . . . . 124.27 112.167 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -76.7 -21.45 55.33 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.634 0.605 . . . . 104.45 112.634 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' LEU . . . . . 0.546 HD12 HD21 ' B' ' 48' ' ' LEU . 6.8 mt -85.96 140.75 30.05 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.081 0.467 . . . . 78.620000000000005 110.595 -178.53 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.49 143.23 44.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.643 -0.708 . . . . 92.569999999999993 110.845 178.608 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -74.47 158.07 34.48 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.807 0.813 . . . . 75.459999999999994 110.118 172.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -83.74 92.84 7.81 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 107.295 -1.372 . . . . 52.270000000000003 107.295 172.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 86.4 mt -64.36 -30.06 71.11 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.549 -0.75 . . . . 63.990000000000002 111.401 -175.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' THR . . . . . 0.446 HG23 ' HB ' ' A' ' 17' ' ' VAL . 2.0 m -66.1 -46.78 76.41 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.363 -0.535 . . . . 54.700000000000003 111.231 179.609 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' VAL . . . . . . . . . . . . . 77.7 t -64.66 -44.42 96.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 C-N-CA 120.65 -0.42 . . . . 53.340000000000003 110.777 179.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 60.6 mt -63.8 -38.9 92.81 Favored 'General case' 0 C--O 1.238 0.455 0 O-C-N 121.93 -0.481 . . . . 54.219999999999999 111.467 -176.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -63.41 -37.83 88.81 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.445 -0.502 . . . . 96.25 111.036 177.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ILE . . . . . . . . . . . . . 48.8 mt -66.66 -42.09 89.16 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 120.792 0.329 . . . . 59.009999999999998 111.033 -177.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' ILE . . . . . 0.494 ' O ' ' NE2' ' A' ' 8' ' ' HIS . 32.0 pt -94.34 6.12 7.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 O-C-N 121.746 -0.596 . . . . 70.359999999999999 111.488 -172.416 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ASP . . . . . . . . . . . . . 26.2 t70 . . . . . 0 C--N 1.33 -0.272 0 C-N-CA 120.552 -0.459 . . . . 105.94 111.568 179.669 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . 0.473 ' O ' ' ND2' ' A' ' 79' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' B' B ' 201' ' ' HOH . . . . . 0.484 ' O ' ' NH2' ' B' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_