data_3fit_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 3fit _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 118.8 -0.619 . . . . 65.540000000000006 110.36 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.93 9.02 32.8 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.959 1.096 . . . . 59.880000000000003 113.959 -178.775 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -118.85 132.6 56.12 Favored 'General case' 0 CA--C 1.458 -2.577 0 N-CA-C 110.177 -0.305 . . . . 48.32 110.177 -177.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -98.71 126.22 44.26 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.68 -0.691 . . . . 50.899999999999999 110.143 -178.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -134.01 83.88 2.08 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 108.398 -0.964 . . . . 34.649999999999999 108.398 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 81.74 -130.53 9.76 Favored Glycine 0 C--O 1.26 1.731 0 N-CA-C 105.333 -3.107 . . . . 38.409999999999997 105.333 -178.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -101.14 26.32 7.19 Favored 'General case' 0 C--O 1.249 1.049 0 N-CA-C 116.748 2.129 . . . . 58.25 116.748 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -140.59 148.25 40.66 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.445 -0.343 . . . . 56.979999999999997 110.917 176.115 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 20.9 mt -89.03 137.13 32.59 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.941 -0.572 . . . . 48.880000000000003 110.455 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.1 mm -102.57 125.81 56.82 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.562 0 CA-C-N 114.326 -1.306 . . . . 33.539999999999999 109.842 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -70.5 136.56 86.1 Favored Pre-proline 0 CA--C 1.494 -1.198 0 C-N-CA 119.682 -0.807 . . . . 66.299999999999997 109.539 -179.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -52.72 -27.18 32.78 Favored 'Trans proline' 0 C--N 1.32 -0.95 1 C-N-CA 125.326 4.017 . . . . 33.890000000000001 112.169 -179.887 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.7 p -60.14 -25.84 65.81 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.52 -0.764 . . . . 33.289999999999999 111.584 -179.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.8 m -103.81 3.84 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.019 0 C-N-CA 118.881 -1.128 . . . . 30.879999999999999 112.285 179.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . 0.567 ' O ' ' NH1' ' A' ' 143' ' ' ARG . 56.8 t -99.16 127.42 51.87 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.874 0 N-CA-C 105.114 -2.18 . . . . 23.789999999999999 105.114 177.486 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -112.93 0.01 14.97 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 116.83 2.159 . . . . 24.140000000000001 116.83 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 33.8 tp -157.25 144.79 18.82 Favored 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 107.988 -1.116 . . . . 27.039999999999999 107.988 178.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -154.15 129.71 9.94 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 115.048 -0.978 . . . . 67.810000000000002 108.385 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 82.4 p -115.06 -167.51 1.24 Allowed 'General case' 0 N--CA 1.436 -1.152 0 CA-C-O 122.912 1.339 . . . . 32.530000000000001 110.506 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -62.33 -34.9 77.54 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 113.17 -1.832 . . . . 73.870000000000005 106.876 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 10.4 mt -129.16 -10.83 4.72 Favored 'General case' 0 CA--C 1.509 -0.63 0 N-CA-C 118.748 2.87 . . . . 31.370000000000001 118.748 -175.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.08 176.84 8.22 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 112.941 0.719 . . . . 27.02 112.941 -177.983 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 16.8 p90 -157.25 154.18 28.73 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.218 -0.901 . . . . 23.0 109.013 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -124.33 141.17 52.29 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 115.939 -0.573 . . . . 21.239999999999998 109.535 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -135.16 158.0 45.48 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 124.572 1.149 . . . . 25.809999999999999 111.207 -177.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.2 m -93.24 158.81 2.85 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.014 0 N-CA-C 105.285 -2.117 . . . . 26.52 105.285 177.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -93.66 156.96 16.41 Favored 'General case' 0 N--CA 1.517 2.882 0 N-CA-C 117.034 2.235 . . . . 42.840000000000003 117.034 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ARG . . . . . 0.659 ' NH1' ' O ' ' A' ' 130' ' ' ARG . 14.7 tpp180 -75.29 -37.36 60.91 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 107.221 -1.4 . . . . 58.630000000000003 107.221 176.959 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -125.43 76.0 69.04 Favored Pre-proline 0 CA--C 1.546 0.814 0 CA-C-N 113.276 -1.784 . . . . 82.450000000000003 112.607 179.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.75 143.22 85.88 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 116.87 -1.62 . . . . 40.399999999999999 109.531 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.0 t -81.05 -28.12 10.97 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.288 0 CA-C-O 122.832 1.301 . . . . 32.509999999999998 109.475 -179.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -148.16 147.58 26.65 Favored Pre-proline 0 N--CA 1.436 -1.155 0 N-CA-C 102.047 -3.316 . . . . 28.489999999999998 102.047 -177.741 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -56.5 127.55 26.38 Favored 'Trans proline' 0 CA--C 1.496 -1.408 0 N-CA-C 110.737 -0.524 . . . . 28.309999999999999 110.737 -179.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 95.87 1.55 61.55 Favored Glycine 0 N--CA 1.435 -1.426 0 CA-C-O 118.868 -0.962 . . . . 25.489999999999998 112.177 177.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.8 t-160 -61.82 110.52 1.56 Allowed 'General case' 0 C--O 1.213 -0.821 0 N-CA-C 105.683 -1.969 . . . . 24.530000000000001 105.683 177.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 24.6 m -126.2 168.4 19.19 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.191 0 C-N-CA 123.265 0.626 . . . . 24.460000000000001 111.14 179.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 84.7 mt -125.27 139.06 54.05 Favored 'General case' 0 CA--C 1.483 -1.602 0 C-N-CA 120.322 -0.551 . . . . 25.359999999999999 110.389 -177.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.7 t -118.21 116.03 50.17 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.197 0 N-CA-C 104.692 -2.336 . . . . 21.670000000000002 104.692 177.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 1.7 m -122.76 155.32 63.45 Favored Pre-proline 0 C--O 1.257 1.477 0 N-CA-C 114.477 1.288 . . . . 32.909999999999997 114.477 -178.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -74.97 151.41 39.64 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 113.439 -3.908 . . . . 27.07 103.177 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.6 mt -62.98 -35.87 81.63 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 118.437 -1.305 . . . . 30.170000000000002 110.71 178.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 52.7 ttp85 -79.84 123.76 83.64 Favored Pre-proline 0 CA--C 1.478 -1.817 0 N-CA-C 105.89 -1.892 . . . . 42.619999999999997 105.89 -178.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_endo -76.85 95.81 1.08 Allowed 'Trans proline' 0 C--N 1.306 -1.673 0 C-N-CA 120.824 1.016 . . . . 37.740000000000002 112.53 -179.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' VAL . . . . . 0.444 ' CG2' ' CD1' ' A' ' 50' ' ' LEU . 6.7 m -112.1 149.39 14.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 101.982 -3.34 . . . . 37.399999999999999 101.982 177.049 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -84.54 -38.29 20.19 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 119.076 2.991 . . . . 57.719999999999999 119.076 -178.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.7 mmm-85 -122.76 149.74 43.71 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.223 -1.029 . . . . 32.68 108.223 -179.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -59.38 -33.85 71.7 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 125.467 1.507 . . . . 22.41 113.553 -176.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -66.87 -19.41 65.73 Favored 'General case' 0 CA--C 1.49 -1.346 0 CA-C-O 118.912 -0.566 . . . . 43.5 111.268 -178.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -74.43 -14.12 60.8 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 117.09 2.256 . . . . 38.280000000000001 117.09 178.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . 0.444 ' CD1' ' CG2' ' A' ' 44' ' ' VAL . 9.9 mp -79.75 141.45 36.31 Favored 'General case' 0 CA--C 1.486 -1.506 0 CA-C-O 121.283 0.563 . . . . 32.450000000000003 112.244 179.769 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 6.4 mtm-85 -74.95 157.03 85.94 Favored Pre-proline 0 N--CA 1.429 -1.517 0 N-CA-C 104.975 -2.231 . . . . 57.43 104.975 175.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -52.79 -34.61 65.98 Favored 'Trans proline' 0 C--N 1.313 -1.342 0 C-N-CA 122.817 2.344 . . . . 33.789999999999999 114.198 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -72.34 -35.5 68.56 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 118.366 -1.333 . . . . 51.259999999999998 111.367 -178.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -66.64 -33.74 76.32 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 108.058 -1.09 . . . . 37.090000000000003 108.058 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.83 -48.91 73.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-N 115.317 -0.856 . . . . 28.73 111.17 178.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.16 -45.58 90.64 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 119.779 -0.768 . . . . 25.93 110.593 178.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -66.6 -44.66 81.54 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.926 -0.579 . . . . 33.159999999999997 111.031 -179.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 20.9 tp -50.98 -47.72 61.37 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 121.299 0.571 . . . . 24.030000000000001 110.238 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . 0.334 96.8 m-85 -85.75 -27.72 25.05 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 118.116 2.636 . . . . 21.149999999999999 118.116 -177.228 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -67.64 -37.13 82.0 Favored 'General case' 0 CA--C 1.565 1.535 0 N-CA-C 104.694 -2.335 . . . . 39.159999999999997 104.694 174.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 92.8 m -64.84 -43.15 93.98 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 119.582 -0.847 . . . . 22.91 111.644 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.9 m -59.82 -30.26 68.81 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.019 0.528 . . . . 22.449999999999999 112.247 178.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -69.77 -47.78 61.72 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.464 1.106 . . . . 21.91 109.285 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -62.27 -49.36 76.0 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.208 0.818 . . . . 33.700000000000003 113.208 175.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 54.2 t -58.53 -45.93 90.05 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.309 0 CA-C-O 118.331 -0.842 . . . . 27.620000000000001 111.042 178.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -57.3 -41.13 92.85 Favored Glycine 0 CA--C 1.531 1.066 0 CA-C-N 119.357 0.98 . . . . 26.43 113.661 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 26.5 m -59.88 -46.89 87.89 Favored 'General case' 0 C--N 1.314 -0.943 0 O-C-N 120.94 -1.33 . . . . 38.609999999999999 109.694 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 44.9 t -62.23 -50.51 79.67 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.77 0 N-CA-C 114.346 1.239 . . . . 27.32 114.346 -179.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 33.2 m -70.7 -28.23 33.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 N-CA-C 114.27 1.211 . . . . 26.780000000000001 114.27 179.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -67.42 -41.46 84.83 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 106.903 -1.517 . . . . 45.450000000000003 106.903 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -63.46 -69.81 0.25 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.65 1.98 . . . . 62.840000000000003 109.77 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 56.1 t60 -50.83 -52.18 43.79 Favored 'General case' 0 C--O 1.254 1.315 0 N-CA-C 117.035 2.235 . . . . 33.219999999999999 117.035 -179.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -83.21 8.97 11.7 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 116.212 1.93 . . . . 33.479999999999997 116.212 -178.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 65.9 m80 59.4 44.22 15.41 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 119.762 3.245 . . . . 50.869999999999997 119.762 177.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -96.28 163.61 23.1 Favored Glycine 0 CA--C 1.528 0.848 0 N-CA-C 109.501 -1.44 . . . . 32.030000000000001 109.501 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -112.57 -0.93 15.02 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 121.652 0.739 . . . . 36.869999999999997 112.142 179.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.0 m -157.65 -176.69 6.08 Favored 'General case' 0 C--O 1.248 1.012 0 N-CA-C 103.988 -2.597 . . . . 30.039999999999999 103.988 -179.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 22.0 mt -151.56 145.7 25.33 Favored 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.86 0.725 . . . . 24.739999999999998 109.717 179.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 18.3 m -115.74 133.07 56.4 Favored 'General case' 0 CA--C 1.486 -1.486 0 N-CA-C 102.878 -3.008 . . . . 22.66 102.878 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -121.56 136.08 54.97 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 105.193 -2.151 . . . . 24.579999999999998 105.193 178.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -159.33 143.08 14.86 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 118.519 -1.273 . . . . 35.780000000000001 107.854 178.973 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' MSE . . . . . . . . . . . . . 24.6 ttp -126.48 112.95 16.19 Favored 'General case' 0 C--O 1.21 -1.011 0 C-N-CA 125.528 1.531 . . . . 36.75 107.217 -179.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -88.09 92.68 9.23 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 104.801 -2.296 . . . . 30.870000000000001 104.801 179.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -91.75 87.29 6.23 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 115.64 1.719 . . . . 30.98 115.64 -175.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 123.32 153.67 8.8 Favored Glycine 0 C--O 1.223 -0.532 0 C-N-CA 119.952 -1.118 . . . . 30.93 112.569 179.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -62.18 -27.06 78.23 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 N-CA-C 116.091 1.535 . . . . 37.130000000000003 116.091 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -84.98 -0.35 54.05 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.154 0.798 . . . . 46.159999999999997 113.154 179.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -105.94 0.49 25.84 Favored 'General case' 0 C--O 1.242 0.705 0 CA-C-N 114.664 -1.153 . . . . 36.439999999999998 108.042 177.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 94.38 5.0 62.2 Favored Glycine 0 CA--C 1.541 1.684 0 N-CA-C 118.776 2.271 . . . . 39.369999999999997 118.776 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -61.5 115.11 3.64 Favored 'General case' 0 C--O 1.251 1.141 0 O-C-N 121.164 -1.198 . . . . 46.369999999999997 111.23 -179.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 72.0 p -86.05 -45.08 11.76 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.153 -1.054 . . . . 48.159999999999997 108.153 176.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 58.4 t -97.73 130.39 46.51 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.734 0 CA-C-N 119.273 0.942 . . . . 45.469999999999999 108.542 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -82.27 66.62 7.95 Favored 'General case' 0 C--O 1.249 1.076 0 CA-C-N 114.93 -1.032 . . . . 65.0 112.724 -178.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -152.0 127.07 9.75 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 102.57 -3.122 . . . . 41.020000000000003 102.57 178.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 71.5 t -54.04 132.5 16.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 108.634 -0.876 . . . . 31.210000000000001 108.634 179.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 54.5 p-80 -161.9 145.67 12.34 Favored 'General case' 0 N--CA 1.427 -1.607 0 C-N-CA 117.058 -1.857 . . . . 30.82 110.701 176.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.7 t -101.45 134.31 42.15 Favored 'Isoleucine or valine' 0 C--O 1.245 0.852 0 CA-C-O 122.279 1.037 . . . . 23.68 110.904 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -92.93 128.42 38.79 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 103.53 -2.767 . . . . 26.280000000000001 103.53 177.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 61.4 t -118.85 112.65 38.76 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 O-C-N 124.564 1.165 . . . . 22.27 108.407 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 5.4 mp -123.55 119.56 27.15 Favored Pre-proline 0 N--CA 1.434 -1.249 0 N-CA-C 113.975 1.102 . . . . 32.270000000000003 113.975 -177.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -65.98 132.8 31.26 Favored 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 123.867 3.045 . . . . 28.890000000000001 106.899 178.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 49.1 mmm-85 -112.35 145.26 40.37 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-O 122.003 0.906 . . . . 38.960000000000001 113.129 179.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 13.3 ptmt -145.61 150.47 36.43 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 119.908 -0.717 . . . . 62.5 109.614 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -43.27 121.8 2.33 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 114.132 -1.394 . . . . 46.210000000000001 113.693 -178.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 63.17 76.56 0.26 Allowed Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 114.058 -1.428 . . . . 51.020000000000003 113.736 179.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 30.0 p-10 . . . . . 0 C--O 1.275 2.414 0 O-C-N 123.898 0.411 . . . . 53.780000000000001 111.014 177.972 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' TRP . . . . . 0.484 ' CZ2' ' NH1' ' A' ' 28' ' ' ARG . 70.9 t90 . . . . . 0 N--CA 1.498 1.941 0 CA-C-O 121.883 0.849 . . . . 64.280000000000001 112.662 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ARG . . . . . 0.659 ' O ' ' NH1' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -154.56 165.0 37.84 Favored 'General case' 0 C--O 1.206 -1.202 0 CA-C-N 115.909 -0.587 . . . . 54.210000000000001 110.095 -177.919 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 13.3 p -74.48 156.75 36.59 Favored 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 116.575 2.065 . . . . 44.100000000000001 116.575 179.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -54.24 -25.53 23.72 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 119.628 -0.829 . . . . 65.599999999999994 111.619 178.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -79.13 -37.78 37.74 Favored 'General case' 0 C--O 1.218 -0.574 0 N-CA-C 112.5 0.556 . . . . 41.450000000000003 112.5 -178.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -64.78 -37.32 87.19 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 104.924 -2.25 . . . . 71.629999999999995 104.924 174.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' MSE . . . . . . . . . . . . . 3.0 mtm -63.76 -47.37 81.27 Favored 'General case' 0 CA--C 1.504 -0.82 0 C-N-CA 124.039 0.936 . . . . 44.479999999999997 112.841 -179.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -73.87 -25.19 59.91 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 120.921 0.391 . . . . 22.829999999999998 111.232 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.74 -49.37 66.2 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 105.153 -2.165 . . . . 23.199999999999999 105.153 179.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -64.77 -36.86 85.67 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 113.365 0.876 . . . . 32.340000000000003 113.365 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.11 -30.04 69.1 Favored 'General case' 0 N--CA 1.441 -0.908 0 C-N-CA 118.749 -1.18 . . . . 24.989999999999998 110.971 178.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -66.77 -43.78 83.11 Favored 'General case' 0 CA--C 1.477 -1.848 0 C-N-CA 124.381 1.073 . . . . 24.359999999999999 108.976 -179.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.09 -52.18 66.44 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 114.28 -1.327 . . . . 23.280000000000001 109.464 179.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 71.6 mt -62.53 -33.36 74.77 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 114.287 1.217 . . . . 25.640000000000001 114.287 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ARG . . . . . 0.567 ' NH1' ' O ' ' A' ' 15' ' ' VAL . 25.2 mtm-85 -62.9 -20.31 65.04 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-O 121.999 0.904 . . . . 39.270000000000003 110.716 179.122 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 51.5 t -70.84 -35.42 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 O-C-N 121.515 -0.741 . . . . 27.370000000000001 111.994 -178.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -71.6 -5.5 33.91 Favored 'General case' 0 N--CA 1.424 -1.729 0 C-N-CA 119.667 -0.813 . . . . 34.310000000000002 112.511 -178.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 . . . . . 0 C--O 1.276 2.455 0 N-CA-C 109.359 -0.608 . . . . 43.460000000000001 109.359 179.71 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 500' ' ' FRU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 300' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 400' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 C2'--O2' 1.438 1.914 3 C4'-C3'-C2' 92.405 -10.295 . 0.0 '__' . 46.270000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' HOH . . . . . 0.555 ' O ' ' NH2' ' A' ' 143' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 573' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 586' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 588' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 589' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 590' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 594' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 597' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 598' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 599' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 600' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . 0.423 ' CA ' ' HD3' ' A' ' 12' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 118.8 -0.619 . . . . 65.540000000000006 110.36 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.93 9.02 32.8 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.959 1.096 . . . . 59.880000000000003 113.959 -178.775 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -118.85 132.6 56.12 Favored 'General case' 0 CA--C 1.458 -2.577 0 N-CA-C 110.177 -0.305 . . . . 48.32 110.177 -177.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ARG . . . . . 0.448 ' HD3' ' HG3' ' A' ' 43' ' ' PRO . 66.2 ttt180 -98.71 126.22 44.26 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.68 -0.691 . . . . 50.899999999999999 110.143 -178.039 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -134.01 83.88 2.08 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 108.398 -0.964 . . . . 34.649999999999999 108.398 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 81.74 -130.53 9.76 Favored Glycine 0 C--O 1.26 1.731 0 N-CA-C 105.333 -3.107 . . . . 38.409999999999997 105.333 -178.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -101.14 26.32 7.19 Favored 'General case' 0 C--O 1.249 1.049 0 N-CA-C 116.748 2.129 . . . . 58.25 116.748 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -140.59 148.25 40.66 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.445 -0.343 . . . . 56.979999999999997 110.917 176.115 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . 0.403 HD22 ' O ' ' A' ' 1' ' ' MET . 20.9 mt -89.03 137.13 32.59 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.941 -0.572 . . . . 48.880000000000003 110.455 -179.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.1 mm -102.57 125.81 56.82 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.562 0 CA-C-N 114.326 -1.306 . . . . 33.539999999999999 109.842 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LYS . . . . . 0.415 ' HA ' ' HD3' ' A' ' 12' ' ' PRO . 87.6 mttt -70.5 136.56 86.1 Favored Pre-proline 0 CA--C 1.494 -1.198 0 C-N-CA 119.682 -0.807 . . . . 66.299999999999997 109.539 -179.272 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' PRO . . . . . 0.423 ' HD3' ' CA ' ' A' ' 1' ' ' MET . 35.7 Cg_exo -52.72 -27.18 32.78 Favored 'Trans proline' 0 C--N 1.32 -0.95 1 C-N-CA 125.326 4.017 . . . . 33.890000000000001 112.169 -179.887 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.7 p -60.14 -25.84 65.81 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.52 -0.764 . . . . 33.289999999999999 111.584 -179.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' VAL . . . . . 0.655 HG11 ' HE3' ' A' ' 135' ' ' MSE . 10.8 m -103.81 3.84 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.019 0 C-N-CA 118.881 -1.128 . . . . 30.879999999999999 112.285 179.763 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . 0.567 ' O ' ' NH1' ' A' ' 143' ' ' ARG . 56.8 t -99.16 127.42 51.87 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.874 0 N-CA-C 105.114 -2.18 . . . . 23.789999999999999 105.114 177.486 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -112.93 0.01 14.97 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 116.83 2.159 . . . . 24.140000000000001 116.83 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 33.8 tp -157.25 144.79 18.82 Favored 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 107.988 -1.116 . . . . 27.039999999999999 107.988 178.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -154.15 129.71 9.94 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 115.048 -0.978 . . . . 67.810000000000002 108.385 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 82.4 p -115.06 -167.51 1.24 Allowed 'General case' 0 N--CA 1.436 -1.152 0 CA-C-O 122.912 1.339 . . . . 32.530000000000001 110.506 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -62.33 -34.9 77.54 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 113.17 -1.832 . . . . 73.870000000000005 106.876 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 10.4 mt -129.16 -10.83 4.72 Favored 'General case' 0 CA--C 1.509 -0.63 0 N-CA-C 118.748 2.87 . . . . 31.370000000000001 118.748 -175.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.08 176.84 8.22 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 112.941 0.719 . . . . 27.02 112.941 -177.983 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 16.8 p90 -157.25 154.18 28.73 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.218 -0.901 . . . . 23.0 109.013 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -124.33 141.17 52.29 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 115.939 -0.573 . . . . 21.239999999999998 109.535 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -135.16 158.0 45.48 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 124.572 1.149 . . . . 25.809999999999999 111.207 -177.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.2 m -93.24 158.81 2.85 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.014 0 N-CA-C 105.285 -2.117 . . . . 26.52 105.285 177.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -93.66 156.96 16.41 Favored 'General case' 0 N--CA 1.517 2.882 0 N-CA-C 117.034 2.235 . . . . 42.840000000000003 117.034 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ARG . . . . . 0.805 ' HD2' ' NE1' ' A' ' 129' ' ' TRP . 14.7 tpp180 -75.29 -37.36 60.91 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 107.221 -1.4 . . . . 58.630000000000003 107.221 176.959 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -125.43 76.0 69.04 Favored Pre-proline 0 CA--C 1.546 0.814 0 CA-C-N 113.276 -1.784 . . . . 82.450000000000003 112.607 179.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.75 143.22 85.88 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 116.87 -1.62 . . . . 40.399999999999999 109.531 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.0 t -81.05 -28.12 10.97 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.288 0 CA-C-O 122.832 1.301 . . . . 32.509999999999998 109.475 -179.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -148.16 147.58 26.65 Favored Pre-proline 0 N--CA 1.436 -1.155 0 N-CA-C 102.047 -3.316 . . . . 28.489999999999998 102.047 -177.741 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -56.5 127.55 26.38 Favored 'Trans proline' 0 CA--C 1.496 -1.408 0 N-CA-C 110.737 -0.524 . . . . 28.309999999999999 110.737 -179.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 95.87 1.55 61.55 Favored Glycine 0 N--CA 1.435 -1.426 0 CA-C-O 118.868 -0.962 . . . . 25.489999999999998 112.177 177.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.8 t-160 -61.82 110.52 1.56 Allowed 'General case' 0 C--O 1.213 -0.821 0 N-CA-C 105.683 -1.969 . . . . 24.530000000000001 105.683 177.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 24.6 m -126.2 168.4 19.19 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.191 0 C-N-CA 123.265 0.626 . . . . 24.460000000000001 111.14 179.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 84.7 mt -125.27 139.06 54.05 Favored 'General case' 0 CA--C 1.483 -1.602 0 C-N-CA 120.322 -0.551 . . . . 25.359999999999999 110.389 -177.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.7 t -118.21 116.03 50.17 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.197 0 N-CA-C 104.692 -2.336 . . . . 21.670000000000002 104.692 177.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 1.7 m -122.76 155.32 63.45 Favored Pre-proline 0 C--O 1.257 1.477 0 N-CA-C 114.477 1.288 . . . . 32.909999999999997 114.477 -178.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PRO . . . . . 0.504 ' HD2' ' O ' ' A' ' 95' ' ' VAL . 60.9 Cg_endo -74.97 151.41 39.64 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 113.439 -3.908 . . . . 27.07 103.177 178.369 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.6 mt -62.98 -35.87 81.63 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 118.437 -1.305 . . . . 30.170000000000002 110.71 178.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 52.7 ttp85 -79.84 123.76 83.64 Favored Pre-proline 0 CA--C 1.478 -1.817 0 N-CA-C 105.89 -1.892 . . . . 42.619999999999997 105.89 -178.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PRO . . . . . 0.5 ' HB2' ' O ' ' A' ' 525' ' ' HOH . 8.1 Cg_endo -76.85 95.81 1.08 Allowed 'Trans proline' 0 C--N 1.306 -1.673 0 C-N-CA 120.824 1.016 . . . . 37.740000000000002 112.53 -179.025 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' VAL . . . . . 0.845 HG21 HD12 ' A' ' 50' ' ' LEU . 6.7 m -112.1 149.39 14.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 101.982 -3.34 . . . . 37.399999999999999 101.982 177.049 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . 0.54 ' HG3' ' HB3' ' A' ' 93' ' ' LYS . 40.6 tt0 -84.54 -38.29 20.19 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 119.076 2.991 . . . . 57.719999999999999 119.076 -178.3 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.7 mmm-85 -122.76 149.74 43.71 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.223 -1.029 . . . . 32.68 108.223 -179.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -59.38 -33.85 71.7 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 125.467 1.507 . . . . 22.41 113.553 -176.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -66.87 -19.41 65.73 Favored 'General case' 0 CA--C 1.49 -1.346 0 CA-C-O 118.912 -0.566 . . . . 43.5 111.268 -178.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -74.43 -14.12 60.8 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 117.09 2.256 . . . . 38.280000000000001 117.09 178.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . 0.845 HD12 HG21 ' A' ' 44' ' ' VAL . 9.9 mp -79.75 141.45 36.31 Favored 'General case' 0 CA--C 1.486 -1.506 0 CA-C-O 121.283 0.563 . . . . 32.450000000000003 112.244 179.769 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ARG . . . . . 0.449 ' O ' HG23 ' A' ' 55' ' ' VAL . 6.4 mtm-85 -74.95 157.03 85.94 Favored Pre-proline 0 N--CA 1.429 -1.517 0 N-CA-C 104.975 -2.231 . . . . 57.43 104.975 175.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -52.79 -34.61 65.98 Favored 'Trans proline' 0 C--N 1.313 -1.342 0 C-N-CA 122.817 2.344 . . . . 33.789999999999999 114.198 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -72.34 -35.5 68.56 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 118.366 -1.333 . . . . 51.259999999999998 111.367 -178.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -66.64 -33.74 76.32 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 108.058 -1.09 . . . . 37.090000000000003 108.058 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 51' ' ' ARG . 96.1 t -67.83 -48.91 73.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-N 115.317 -0.856 . . . . 28.73 111.17 178.543 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.16 -45.58 90.64 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 119.779 -0.768 . . . . 25.93 110.593 178.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -66.6 -44.66 81.54 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.926 -0.579 . . . . 33.159999999999997 111.031 -179.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 20.9 tp -50.98 -47.72 61.37 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 121.299 0.571 . . . . 24.030000000000001 110.238 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . 0.334 96.8 m-85 -85.75 -27.72 25.05 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 118.116 2.636 . . . . 21.149999999999999 118.116 -177.228 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 -67.64 -37.13 82.0 Favored 'General case' 0 CA--C 1.565 1.535 0 N-CA-C 104.694 -2.335 . . . . 39.159999999999997 104.694 174.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 92.8 m -64.84 -43.15 93.98 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 119.582 -0.847 . . . . 22.91 111.644 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.9 m -59.82 -30.26 68.81 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.019 0.528 . . . . 22.449999999999999 112.247 178.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -69.77 -47.78 61.72 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.464 1.106 . . . . 21.91 109.285 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -62.27 -49.36 76.0 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.208 0.818 . . . . 33.700000000000003 113.208 175.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 54.2 t -58.53 -45.93 90.05 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.309 0 CA-C-O 118.331 -0.842 . . . . 27.620000000000001 111.042 178.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -57.3 -41.13 92.85 Favored Glycine 0 CA--C 1.531 1.066 0 CA-C-N 119.357 0.98 . . . . 26.43 113.661 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 26.5 m -59.88 -46.89 87.89 Favored 'General case' 0 C--N 1.314 -0.943 0 O-C-N 120.94 -1.33 . . . . 38.609999999999999 109.694 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 44.9 t -62.23 -50.51 79.67 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.77 0 N-CA-C 114.346 1.239 . . . . 27.32 114.346 -179.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 33.2 m -70.7 -28.23 33.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 N-CA-C 114.27 1.211 . . . . 26.780000000000001 114.27 179.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -67.42 -41.46 84.83 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 106.903 -1.517 . . . . 45.450000000000003 106.903 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -63.46 -69.81 0.25 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.65 1.98 . . . . 62.840000000000003 109.77 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 56.1 t60 -50.83 -52.18 43.79 Favored 'General case' 0 C--O 1.254 1.315 0 N-CA-C 117.035 2.235 . . . . 33.219999999999999 117.035 -179.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -83.21 8.97 11.7 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 116.212 1.93 . . . . 33.479999999999997 116.212 -178.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 59.4 44.22 15.41 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 119.762 3.245 . . . . 50.869999999999997 119.762 177.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -96.28 163.61 23.1 Favored Glycine 0 CA--C 1.528 0.848 0 N-CA-C 109.501 -1.44 . . . . 32.030000000000001 109.501 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -112.57 -0.93 15.02 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 121.652 0.739 . . . . 36.869999999999997 112.142 179.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.0 m -157.65 -176.69 6.08 Favored 'General case' 0 C--O 1.248 1.012 0 N-CA-C 103.988 -2.597 . . . . 30.039999999999999 103.988 -179.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 22.0 mt -151.56 145.7 25.33 Favored 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.86 0.725 . . . . 24.739999999999998 109.717 179.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 18.3 m -115.74 133.07 56.4 Favored 'General case' 0 CA--C 1.486 -1.486 0 N-CA-C 102.878 -3.008 . . . . 22.66 102.878 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -121.56 136.08 54.97 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 105.193 -2.151 . . . . 24.579999999999998 105.193 178.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -159.33 143.08 14.86 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 118.519 -1.273 . . . . 35.780000000000001 107.854 178.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' MSE . . . . . . . . . . . . . 24.6 ttp -126.48 112.95 16.19 Favored 'General case' 0 C--O 1.21 -1.011 0 C-N-CA 125.528 1.531 . . . . 36.75 107.217 -179.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 90' ' ' GLN . 21.0 mt-30 -88.09 92.68 9.23 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 104.801 -2.296 . . . . 30.870000000000001 104.801 179.344 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -91.75 87.29 6.23 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 115.64 1.719 . . . . 30.98 115.64 -175.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 123.32 153.67 8.8 Favored Glycine 0 C--O 1.223 -0.532 0 C-N-CA 119.952 -1.118 . . . . 30.93 112.569 179.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -62.18 -27.06 78.23 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 N-CA-C 116.091 1.535 . . . . 37.130000000000003 116.091 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -84.98 -0.35 54.05 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.154 0.798 . . . . 46.159999999999997 113.154 179.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -105.94 0.49 25.84 Favored 'General case' 0 C--O 1.242 0.705 0 CA-C-N 114.664 -1.153 . . . . 36.439999999999998 108.042 177.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 94.38 5.0 62.2 Favored Glycine 0 CA--C 1.541 1.684 0 N-CA-C 118.776 2.271 . . . . 39.369999999999997 118.776 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLN . . . . . 0.509 ' HG3' ' O ' ' A' ' 524' ' ' HOH . 54.4 tt0 -61.5 115.11 3.64 Favored 'General case' 0 C--O 1.251 1.141 0 O-C-N 121.164 -1.198 . . . . 46.369999999999997 111.23 -179.295 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 72.0 p -86.05 -45.08 11.76 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.153 -1.054 . . . . 48.159999999999997 108.153 176.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 58.4 t -97.73 130.39 46.51 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.734 0 CA-C-N 119.273 0.942 . . . . 45.469999999999999 108.542 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LYS . . . . . 0.54 ' HB3' ' HG3' ' A' ' 45' ' ' GLU . 93.5 mttt -82.27 66.62 7.95 Favored 'General case' 0 C--O 1.249 1.076 0 CA-C-N 114.93 -1.032 . . . . 65.0 112.724 -178.486 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' HIS . . . . . 0.489 ' CE1' ' HA ' ' A' ' 43' ' ' PRO . 3.7 t-160 -152.0 127.07 9.75 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 102.57 -3.122 . . . . 41.020000000000003 102.57 178.681 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' VAL . . . . . 0.504 ' O ' ' HD2' ' A' ' 40' ' ' PRO . 71.5 t -54.04 132.5 16.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 108.634 -0.876 . . . . 31.210000000000001 108.634 179.712 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 54.5 p-80 -161.9 145.67 12.34 Favored 'General case' 0 N--CA 1.427 -1.607 0 C-N-CA 117.058 -1.857 . . . . 30.82 110.701 176.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.7 t -101.45 134.31 42.15 Favored 'Isoleucine or valine' 0 C--O 1.245 0.852 0 CA-C-O 122.279 1.037 . . . . 23.68 110.904 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -92.93 128.42 38.79 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 103.53 -2.767 . . . . 26.280000000000001 103.53 177.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 61.4 t -118.85 112.65 38.76 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 O-C-N 124.564 1.165 . . . . 22.27 108.407 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 5.4 mp -123.55 119.56 27.15 Favored Pre-proline 0 N--CA 1.434 -1.249 0 N-CA-C 113.975 1.102 . . . . 32.270000000000003 113.975 -177.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -65.98 132.8 31.26 Favored 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 123.867 3.045 . . . . 28.890000000000001 106.899 178.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 49.1 mmm-85 -112.35 145.26 40.37 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-O 122.003 0.906 . . . . 38.960000000000001 113.129 179.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 13.3 ptmt -145.61 150.47 36.43 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 119.908 -0.717 . . . . 62.5 109.614 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -43.27 121.8 2.33 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 114.132 -1.394 . . . . 46.210000000000001 113.693 -178.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 63.17 76.56 0.26 Allowed Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 114.058 -1.428 . . . . 51.020000000000003 113.736 179.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 30.0 p-10 . . . . . 0 C--O 1.275 2.414 0 O-C-N 123.898 0.411 . . . . 53.780000000000001 111.014 177.972 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' TRP . . . . . 0.805 ' NE1' ' HD2' ' A' ' 28' ' ' ARG . 70.9 t90 . . . . . 0 N--CA 1.498 1.941 0 CA-C-O 121.883 0.849 . . . . 64.280000000000001 112.662 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ARG . . . . . 0.659 ' O ' ' NH1' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -154.56 165.0 37.84 Favored 'General case' 0 C--O 1.206 -1.202 0 CA-C-N 115.909 -0.587 . . . . 54.210000000000001 110.095 -177.919 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 131' ' ' SER . . . . . 0.4 ' HA ' HH12 ' A' ' 28' ' ' ARG . 13.3 p -74.48 156.75 36.59 Favored 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 116.575 2.065 . . . . 44.100000000000001 116.575 179.766 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' GLU . . . . . 0.524 ' HB3' ' O ' ' A' ' 599' ' ' HOH . 48.2 mt-10 -54.24 -25.53 23.72 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 119.628 -0.829 . . . . 65.599999999999994 111.619 178.432 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -79.13 -37.78 37.74 Favored 'General case' 0 C--O 1.218 -0.574 0 N-CA-C 112.5 0.556 . . . . 41.450000000000003 112.5 -178.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -64.78 -37.32 87.19 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 104.924 -2.25 . . . . 71.629999999999995 104.924 174.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' MSE . . . . . 0.655 ' HE3' HG11 ' A' ' 14' ' ' VAL . 3.0 mtm -63.76 -47.37 81.27 Favored 'General case' 0 CA--C 1.504 -0.82 0 C-N-CA 124.039 0.936 . . . . 44.479999999999997 112.841 -179.804 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -73.87 -25.19 59.91 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 120.921 0.391 . . . . 22.829999999999998 111.232 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.74 -49.37 66.2 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 105.153 -2.165 . . . . 23.199999999999999 105.153 179.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -64.77 -36.86 85.67 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 113.365 0.876 . . . . 32.340000000000003 113.365 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ALA . . . . . 0.463 ' O ' ' HG3' ' A' ' 143' ' ' ARG . . . -68.11 -30.04 69.1 Favored 'General case' 0 N--CA 1.441 -0.908 0 C-N-CA 118.749 -1.18 . . . . 24.989999999999998 110.971 178.33 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -66.77 -43.78 83.11 Favored 'General case' 0 CA--C 1.477 -1.848 0 C-N-CA 124.381 1.073 . . . . 24.359999999999999 108.976 -179.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.09 -52.18 66.44 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 114.28 -1.327 . . . . 23.280000000000001 109.464 179.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 71.6 mt -62.53 -33.36 74.77 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 114.287 1.217 . . . . 25.640000000000001 114.287 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ARG . . . . . 0.567 ' NH1' ' O ' ' A' ' 15' ' ' VAL . 25.2 mtm-85 -62.9 -20.31 65.04 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-O 121.999 0.904 . . . . 39.270000000000003 110.716 179.122 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 51.5 t -70.84 -35.42 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 O-C-N 121.515 -0.741 . . . . 27.370000000000001 111.994 -178.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -71.6 -5.5 33.91 Favored 'General case' 0 N--CA 1.424 -1.729 0 C-N-CA 119.667 -0.813 . . . . 34.310000000000002 112.511 -178.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 . . . . . 0 C--O 1.276 2.455 0 N-CA-C 109.359 -0.608 . . . . 43.460000000000001 109.359 179.71 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 500' ' ' FRU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 300' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 400' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 C2'--O2' 1.438 1.914 3 C4'-C3'-C2' 92.405 -10.295 . 0.0 '__' . 46.270000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 512' ' ' HOH . . . . . 0.555 ' O ' ' NH2' ' A' ' 143' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 524' ' ' HOH . . . . . 0.509 ' O ' ' HG3' ' A' ' 90' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 525' ' ' HOH . . . . . 0.5 ' O ' ' HB2' ' A' ' 43' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 573' ' ' HOH . . . . . 0.448 ' O ' ' HG2' ' A' ' 132' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 586' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 588' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 589' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 590' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 594' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 597' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 598' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 599' ' ' HOH . . . . . 0.524 ' O ' ' HB3' ' A' ' 132' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 600' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . 0.423 ' CA ' ' HD3' ' A' ' 12' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 118.8 -0.619 . . . . 65.54 110.36 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.93 9.02 32.8 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.959 1.096 . . . . 59.88 113.959 -178.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -118.85 132.6 56.12 Favored 'General case' 0 CA--C 1.458 -2.577 0 N-CA-C 110.177 -0.305 . . . . 48.32 110.177 -177.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.448 ' HD3' ' HG3' ' A' ' 43' ' ' PRO . 66.2 ttt180 -98.71 126.22 44.26 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.68 -0.691 . . . . 50.9 110.143 -178.039 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -134.01 83.88 2.08 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 108.398 -0.964 . . . . 34.65 108.398 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 81.74 -130.53 9.76 Favored Glycine 0 C--O 1.26 1.731 0 N-CA-C 105.333 -3.107 . . . . 38.41 105.333 -178.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -101.14 26.32 7.19 Favored 'General case' 0 C--O 1.249 1.049 0 N-CA-C 116.748 2.129 . . . . 58.25 116.748 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -140.59 148.25 40.66 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.445 -0.343 . . . . 56.98 110.917 176.115 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.403 HD22 ' O ' ' A' ' 1' ' ' MET . 20.9 mt -89.03 137.13 32.59 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.941 -0.572 . . . . 48.88 110.455 -179.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.1 mm -102.57 125.81 56.82 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.562 0 CA-C-N 114.326 -1.306 . . . . 33.54 109.842 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.415 ' HA ' ' HD3' ' A' ' 12' ' ' PRO . 87.6 mttt -70.5 136.56 86.1 Favored Pre-proline 0 CA--C 1.494 -1.198 0 C-N-CA 119.682 -0.807 . . . . 66.3 109.539 -179.272 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.423 ' HD3' ' CA ' ' A' ' 1' ' ' MET . 35.7 Cg_exo -52.72 -27.18 32.78 Favored 'Trans proline' 0 C--N 1.32 -0.95 1 C-N-CA 125.326 4.017 . . . . 33.89 112.169 -179.887 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.7 p -60.14 -25.84 65.81 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.52 -0.764 . . . . 33.29 111.584 -179.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.655 HG11 ' HE3' ' A' ' 135' ' ' MSE . 10.8 m -103.81 3.84 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.019 0 C-N-CA 118.881 -1.128 . . . . 30.88 112.285 179.763 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.567 ' O ' ' NH1' ' A' ' 143' ' ' ARG . 56.8 t -99.16 127.42 51.87 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.874 0 N-CA-C 105.114 -2.18 . . . . 23.79 105.114 177.486 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -112.93 0.01 14.97 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 116.83 2.159 . . . . 24.14 116.83 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 33.8 tp -157.25 144.79 18.82 Favored 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 107.988 -1.116 . . . . 27.04 107.988 178.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -154.15 129.71 9.94 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 115.048 -0.978 . . . . 67.81 108.385 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 82.4 p -115.06 -167.51 1.24 Allowed 'General case' 0 N--CA 1.436 -1.152 0 CA-C-O 122.912 1.339 . . . . 32.53 110.506 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -62.33 -34.9 77.54 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 113.17 -1.832 . . . . 73.87 106.876 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 10.4 mt -129.16 -10.83 4.72 Favored 'General case' 0 CA--C 1.509 -0.63 0 N-CA-C 118.748 2.87 . . . . 31.37 118.748 -175.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.08 176.84 8.22 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 112.941 0.719 . . . . 27.02 112.941 -177.983 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 16.8 p90 -157.25 154.18 28.73 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.218 -0.901 . . . . 23.0 109.013 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -124.33 141.17 52.29 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 115.939 -0.573 . . . . 21.24 109.535 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -135.16 158.0 45.48 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 124.572 1.149 . . . . 25.81 111.207 -177.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.2 m -93.24 158.81 2.85 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.014 0 N-CA-C 105.285 -2.117 . . . . 26.52 105.285 177.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.585 HD21 ' HG ' ' A' ' 37' ' ' LEU . 6.9 m120 -93.66 156.96 16.41 Favored 'General case' 0 N--CA 1.517 2.882 0 N-CA-C 117.034 2.235 . . . . 42.84 117.034 179.324 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.805 ' HD2' ' NE1' ' A' ' 129' ' ' TRP . 14.7 tpp180 -75.29 -37.36 60.91 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 107.221 -1.4 . . . . 58.63 107.221 176.959 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -125.43 76.0 69.04 Favored Pre-proline 0 CA--C 1.546 0.814 0 CA-C-N 113.276 -1.784 . . . . 82.45 112.607 179.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.75 143.22 85.88 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 116.87 -1.62 . . . . 40.4 109.531 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.0 t -81.05 -28.12 10.97 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.288 0 CA-C-O 122.832 1.301 . . . . 32.51 109.475 -179.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -148.16 147.58 26.65 Favored Pre-proline 0 N--CA 1.436 -1.155 0 N-CA-C 102.047 -3.316 . . . . 28.49 102.047 -177.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -56.5 127.55 26.38 Favored 'Trans proline' 0 CA--C 1.496 -1.408 0 N-CA-C 110.737 -0.524 . . . . 28.31 110.737 -179.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 95.87 1.55 61.55 Favored Glycine 0 N--CA 1.435 -1.426 0 CA-C-O 118.868 -0.962 . . . . 25.49 112.177 177.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.8 t-160 -61.82 110.52 1.56 Allowed 'General case' 0 C--O 1.213 -0.821 0 N-CA-C 105.683 -1.969 . . . . 24.53 105.683 177.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 24.6 m -126.2 168.4 19.19 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.191 0 C-N-CA 123.265 0.626 . . . . 24.46 111.14 179.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.585 ' HG ' HD21 ' A' ' 27' ' ' ASN . 84.7 mt -125.27 139.06 54.05 Favored 'General case' 0 CA--C 1.483 -1.602 0 C-N-CA 120.322 -0.551 . . . . 25.36 110.389 -177.512 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.7 t -118.21 116.03 50.17 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.197 0 N-CA-C 104.692 -2.336 . . . . 21.67 104.692 177.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 1.7 m -122.76 155.32 63.45 Favored Pre-proline 0 C--O 1.257 1.477 0 N-CA-C 114.477 1.288 . . . . 32.91 114.477 -178.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.504 ' HD2' ' O ' ' A' ' 95' ' ' VAL . 60.9 Cg_endo -74.97 151.41 39.64 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 113.439 -3.908 . . . . 27.07 103.177 178.369 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.6 mt -62.98 -35.87 81.63 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 118.437 -1.305 . . . . 30.17 110.71 178.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 52.7 ttp85 -79.84 123.76 83.64 Favored Pre-proline 0 CA--C 1.478 -1.817 0 N-CA-C 105.89 -1.892 . . . . 42.62 105.89 -178.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.5 ' HB2' ' O ' ' A' ' 525' ' ' HOH . 8.1 Cg_endo -76.85 95.81 1.08 Allowed 'Trans proline' 0 C--N 1.306 -1.673 0 C-N-CA 120.824 1.016 . . . . 37.74 112.53 -179.025 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.845 HG21 HD12 ' A' ' 50' ' ' LEU . 6.7 m -112.1 149.39 14.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 101.982 -3.34 . . . . 37.4 101.982 177.049 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.54 ' HG3' ' HB3' ' A' ' 93' ' ' LYS . 40.6 tt0 -84.54 -38.29 20.19 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 119.076 2.991 . . . . 57.72 119.076 -178.3 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.7 mmm-85 -122.76 149.74 43.71 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.223 -1.029 . . . . 32.68 108.223 -179.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -59.38 -33.85 71.7 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 125.467 1.507 . . . . 22.41 113.553 -176.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -66.87 -19.41 65.73 Favored 'General case' 0 CA--C 1.49 -1.346 0 CA-C-O 118.912 -0.566 . . . . 43.5 111.268 -178.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -74.43 -14.12 60.8 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 117.09 2.256 . . . . 38.28 117.09 178.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.845 HD12 HG21 ' A' ' 44' ' ' VAL . 9.9 mp -79.75 141.45 36.31 Favored 'General case' 0 CA--C 1.486 -1.506 0 CA-C-O 121.283 0.563 . . . . 32.45 112.244 179.769 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.449 ' O ' HG23 ' A' ' 55' ' ' VAL . 6.4 mtm-85 -74.95 157.03 85.94 Favored Pre-proline 0 N--CA 1.429 -1.517 0 N-CA-C 104.975 -2.231 . . . . 57.43 104.975 175.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -52.79 -34.61 65.98 Favored 'Trans proline' 0 C--N 1.313 -1.342 0 C-N-CA 122.817 2.344 . . . . 33.79 114.198 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -72.34 -35.5 68.56 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 118.366 -1.333 . . . . 51.26 111.367 -178.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -66.64 -33.74 76.32 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 108.058 -1.09 . . . . 37.09 108.058 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 51' ' ' ARG . 96.1 t -67.83 -48.91 73.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-N 115.317 -0.856 . . . . 28.73 111.17 178.543 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.16 -45.58 90.64 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 119.779 -0.768 . . . . 25.93 110.593 178.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -66.6 -44.66 81.54 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.926 -0.579 . . . . 33.16 111.031 -179.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 20.9 tp -50.98 -47.72 61.37 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 121.299 0.571 . . . . 24.03 110.238 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . 0.334 96.8 m-85 -85.75 -27.72 25.05 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 118.116 2.636 . . . . 21.15 118.116 -177.228 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -67.64 -37.13 82.0 Favored 'General case' 0 CA--C 1.565 1.535 0 N-CA-C 104.694 -2.335 . . . . 39.16 104.694 174.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 92.8 m -64.84 -43.15 93.98 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 119.582 -0.847 . . . . 22.91 111.644 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.9 m -59.82 -30.26 68.81 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.019 0.528 . . . . 22.45 112.247 178.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -69.77 -47.78 61.72 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.464 1.106 . . . . 21.91 109.285 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -62.27 -49.36 76.0 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.208 0.818 . . . . 33.7 113.208 175.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 54.2 t -58.53 -45.93 90.05 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.309 0 CA-C-O 118.331 -0.842 . . . . 27.62 111.042 178.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -57.3 -41.13 92.85 Favored Glycine 0 CA--C 1.531 1.066 0 CA-C-N 119.357 0.98 . . . . 26.43 113.661 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 26.5 m -59.88 -46.89 87.89 Favored 'General case' 0 C--N 1.314 -0.943 0 O-C-N 120.94 -1.33 . . . . 38.61 109.694 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 44.9 t -62.23 -50.51 79.67 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.77 0 N-CA-C 114.346 1.239 . . . . 27.32 114.346 -179.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 33.2 m -70.7 -28.23 33.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 N-CA-C 114.27 1.211 . . . . 26.78 114.27 179.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -67.42 -41.46 84.83 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 106.903 -1.517 . . . . 45.45 106.903 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -63.46 -69.81 0.25 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.65 1.98 . . . . 62.84 109.77 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 56.1 t60 -50.83 -52.18 43.79 Favored 'General case' 0 C--O 1.254 1.315 0 N-CA-C 117.035 2.235 . . . . 33.22 117.035 -179.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -83.21 8.97 11.7 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 116.212 1.93 . . . . 33.48 116.212 -178.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.411 ' CE1' ' H4 ' ' A' ' 500' ' ' FRU . 65.9 m80 59.4 44.22 15.41 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 119.762 3.245 . . . . 50.87 119.762 177.497 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -96.28 163.61 23.1 Favored Glycine 0 CA--C 1.528 0.848 0 N-CA-C 109.501 -1.44 . . . . 32.03 109.501 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 p -112.57 -0.93 15.02 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 121.652 0.739 . . . . 36.87 112.142 179.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.0 m -157.65 -176.69 6.08 Favored 'General case' 0 C--O 1.248 1.012 0 N-CA-C 103.988 -2.597 . . . . 30.04 103.988 -179.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 22.0 mt -151.56 145.7 25.33 Favored 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.86 0.725 . . . . 24.74 109.717 179.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 18.3 m -115.74 133.07 56.4 Favored 'General case' 0 CA--C 1.486 -1.486 0 N-CA-C 102.878 -3.008 . . . . 22.66 102.878 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -121.56 136.08 54.97 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 105.193 -2.151 . . . . 24.58 105.193 178.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -159.33 143.08 14.86 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 118.519 -1.273 . . . . 35.78 107.854 178.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' MSE . . . . . . . . . . . . . 24.6 ttp -126.48 112.95 16.19 Favored 'General case' 0 C--O 1.21 -1.011 0 C-N-CA 125.528 1.531 . . . . 36.75 107.217 -179.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 90' ' ' GLN . 21.0 mt-30 -88.09 92.68 9.23 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 104.801 -2.296 . . . . 30.87 104.801 179.344 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -91.75 87.29 6.23 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 115.64 1.719 . . . . 30.98 115.64 -175.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 123.32 153.67 8.8 Favored Glycine 0 C--O 1.223 -0.532 0 C-N-CA 119.952 -1.118 . . . . 30.93 112.569 179.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -62.18 -27.06 78.23 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 N-CA-C 116.091 1.535 . . . . 37.13 116.091 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -84.98 -0.35 54.05 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.154 0.798 . . . . 46.16 113.154 179.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -105.94 0.49 25.84 Favored 'General case' 0 C--O 1.242 0.705 0 CA-C-N 114.664 -1.153 . . . . 36.44 108.042 177.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 94.38 5.0 62.2 Favored Glycine 0 CA--C 1.541 1.684 0 N-CA-C 118.776 2.271 . . . . 39.37 118.776 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.509 ' HG3' ' O ' ' A' ' 524' ' ' HOH . 54.4 tt0 -61.5 115.11 3.64 Favored 'General case' 0 C--O 1.251 1.141 0 O-C-N 121.164 -1.198 . . . . 46.37 111.23 -179.295 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 72.0 p -86.05 -45.08 11.76 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.153 -1.054 . . . . 48.16 108.153 176.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 58.4 t -97.73 130.39 46.51 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.734 0 CA-C-N 119.273 0.942 . . . . 45.47 108.542 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.54 ' HB3' ' HG3' ' A' ' 45' ' ' GLU . 93.5 mttt -82.27 66.62 7.95 Favored 'General case' 0 C--O 1.249 1.076 0 CA-C-N 114.93 -1.032 . . . . 65.0 112.724 -178.486 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.489 ' CE1' ' HA ' ' A' ' 43' ' ' PRO . 3.7 t-160 -152.0 127.07 9.75 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 102.57 -3.122 . . . . 41.02 102.57 178.681 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.504 ' O ' ' HD2' ' A' ' 40' ' ' PRO . 71.5 t -54.04 132.5 16.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 108.634 -0.876 . . . . 31.21 108.634 179.712 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 54.5 p-80 -161.9 145.67 12.34 Favored 'General case' 0 N--CA 1.427 -1.607 0 C-N-CA 117.058 -1.857 . . . . 30.82 110.701 176.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.7 t -101.45 134.31 42.15 Favored 'Isoleucine or valine' 0 C--O 1.245 0.852 0 CA-C-O 122.279 1.037 . . . . 23.68 110.904 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -92.93 128.42 38.79 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 103.53 -2.767 . . . . 26.28 103.53 177.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 61.4 t -118.85 112.65 38.76 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 O-C-N 124.564 1.165 . . . . 22.27 108.407 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 5.4 mp -123.55 119.56 27.15 Favored Pre-proline 0 N--CA 1.434 -1.249 0 N-CA-C 113.975 1.102 . . . . 32.27 113.975 -177.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -65.98 132.8 31.26 Favored 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 123.867 3.045 . . . . 28.89 106.899 178.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 49.1 mmm-85 -112.35 145.26 40.37 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-O 122.003 0.906 . . . . 38.96 113.129 179.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 13.3 ptmt -145.61 150.47 36.43 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 119.908 -0.717 . . . . 62.5 109.614 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -43.27 121.8 2.33 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 114.132 -1.394 . . . . 46.21 113.693 -178.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 63.17 76.56 0.26 Allowed Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 114.058 -1.428 . . . . 51.02 113.736 179.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 30.0 p-10 . . . . . 0 C--O 1.275 2.414 0 O-C-N 123.898 0.411 . . . . 53.78 111.014 177.972 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.805 ' NE1' ' HD2' ' A' ' 28' ' ' ARG . 70.9 t90 . . . . . 0 N--CA 1.498 1.941 0 CA-C-O 121.883 0.849 . . . . 64.28 112.662 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.659 ' O ' ' NH1' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -154.56 165.0 37.84 Favored 'General case' 0 C--O 1.206 -1.202 0 CA-C-N 115.909 -0.587 . . . . 54.21 110.095 -177.919 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' SER . . . . . 0.4 ' HA ' HH12 ' A' ' 28' ' ' ARG . 13.3 p -74.48 156.75 36.59 Favored 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 116.575 2.065 . . . . 44.1 116.575 179.766 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.524 ' HB3' ' O ' ' A' ' 599' ' ' HOH . 48.2 mt-10 -54.24 -25.53 23.72 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 119.628 -0.829 . . . . 65.6 111.619 178.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -79.13 -37.78 37.74 Favored 'General case' 0 C--O 1.218 -0.574 0 N-CA-C 112.5 0.556 . . . . 41.45 112.5 -178.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -64.78 -37.32 87.19 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 104.924 -2.25 . . . . 71.63 104.924 174.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' MSE . . . . . 0.655 ' HE3' HG11 ' A' ' 14' ' ' VAL . 3.0 mtm -63.76 -47.37 81.27 Favored 'General case' 0 CA--C 1.504 -0.82 0 C-N-CA 124.039 0.936 . . . . 44.48 112.841 -179.804 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -73.87 -25.19 59.91 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 120.921 0.391 . . . . 22.83 111.232 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.74 -49.37 66.2 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 105.153 -2.165 . . . . 23.2 105.153 179.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -64.77 -36.86 85.67 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 113.365 0.876 . . . . 32.34 113.365 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.463 ' O ' ' HG3' ' A' ' 143' ' ' ARG . . . -68.11 -30.04 69.1 Favored 'General case' 0 N--CA 1.441 -0.908 0 C-N-CA 118.749 -1.18 . . . . 24.99 110.971 178.33 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -66.77 -43.78 83.11 Favored 'General case' 0 CA--C 1.477 -1.848 0 C-N-CA 124.381 1.073 . . . . 24.36 108.976 -179.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.09 -52.18 66.44 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 114.28 -1.327 . . . . 23.28 109.464 179.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 71.6 mt -62.53 -33.36 74.77 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 114.287 1.217 . . . . 25.64 114.287 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ARG . . . . . 0.567 ' NH1' ' O ' ' A' ' 15' ' ' VAL . 25.2 mtm-85 -62.9 -20.31 65.04 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-O 121.999 0.904 . . . . 39.27 110.716 179.122 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 51.5 t -70.84 -35.42 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 O-C-N 121.515 -0.741 . . . . 27.37 111.994 -178.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -71.6 -5.5 33.91 Favored 'General case' 0 N--CA 1.424 -1.729 0 C-N-CA 119.667 -0.813 . . . . 34.31 112.511 -178.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 . . . . . 0 C--O 1.276 2.455 0 N-CA-C 109.359 -0.608 . . . . 43.46 109.359 179.71 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 500' ' ' FRU . . . . . 0.411 ' H4 ' ' CE1' ' A' ' 74' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 300' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 400' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 C2'--O2' 1.438 1.914 3 C4'-C3'-C2' 92.405 -10.295 . 0.0 '__' . 46.27 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' HOH . . . . . 0.555 ' O ' ' NH2' ' A' ' 143' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 524' ' ' HOH . . . . . 0.509 ' O ' ' HG3' ' A' ' 90' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 525' ' ' HOH . . . . . 0.5 ' O ' ' HB2' ' A' ' 43' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 573' ' ' HOH . . . . . 0.448 ' O ' ' HG2' ' A' ' 132' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 586' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 588' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 589' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 590' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 594' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 597' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 598' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 599' ' ' HOH . . . . . 0.524 ' O ' ' HB3' ' A' ' 132' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 600' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_