data_1fw4_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 1fw4 _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 ' 81' ' ' SER . . . . . . . . . . . . . 32.6 t . . . . . 0 N--CA 1.5 2.037 0 N-CA-C 109.372 -0.603 . . . . 79.27 109.372 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -104.09 -34.22 8.49 Favored 'General case' 0 C--O 1.247 0.927 0 N-CA-C 109.104 -0.702 . . . . 79.77 109.104 179.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.06 -23.12 58.01 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-N 115.039 -0.982 . . . . 78.32 110.656 179.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -71.93 -41.96 67.21 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.481 -0.327 . . . . 79.0 110.499 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 39.8 mt -66.73 -33.52 63.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 N-CA-C 109.166 -0.679 . . . . 53.77 109.166 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -69.19 -37.53 78.19 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 111.537 0.199 . . . . 71.08 111.537 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -81.22 -27.77 35.13 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 124.611 1.194 . . . . 60.18 111.29 179.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.04 -50.84 69.08 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 108.81 -0.811 . . . . 41.33 108.81 -177.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -55.56 -48.02 75.43 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.856 0.836 . . . . 45.95 110.762 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -53.38 -40.43 64.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.553 -0.749 . . . . 47.78 110.387 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 1.6 t -72.42 -35.24 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 N-CA-C 115.132 1.53 . . . . 58.31 115.132 -179.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -80.22 -25.74 39.46 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 113.609 0.966 . . . . 56.37 113.609 -179.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -84.86 83.75 7.94 Favored 'General case' 0 C--O 1.252 1.236 0 N-CA-C 105.03 -2.211 . . . . 35.45 105.03 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 25.6 tptt -51.62 -52.11 50.25 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 113.905 -1.498 . . . . 59.66 114.34 -175.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.8 p30 -86.61 4.99 37.96 Favored 'General case' 0 C--O 1.215 -0.712 0 N-CA-C 115.928 1.825 . . . . 38.53 115.928 -179.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 65.03 16.22 61.65 Favored Glycine 0 N--CA 1.436 -1.315 0 CA-C-O 117.768 -1.573 . . . . 36.99 114.792 179.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -78.65 2.57 19.02 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 116.825 2.157 . . . . 36.19 116.825 -178.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 93.2 0.89 67.39 Favored Glycine 0 N--CA 1.473 1.152 0 C-N-CA 118.913 -1.613 . . . . 31.43 114.888 178.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -138.66 135.21 34.61 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.65 0.38 . . . . 52.65 111.045 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 93.6 mt -93.5 120.77 43.44 Favored 'Isoleucine or valine' 0 C--O 1.254 1.325 0 N-CA-C 104.277 -2.49 . . . . 34.71 104.277 174.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 87.5 p -95.05 169.87 9.81 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 109.179 -0.674 . . . . 37.36 109.179 -178.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.02 -41.5 92.33 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 122.038 0.923 . . . . 41.49 109.904 178.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.31 -43.51 92.63 Favored 'General case' 0 C--O 1.239 0.534 0 O-C-N 121.394 -0.816 . . . . 43.13 112.123 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -65.48 -44.93 85.58 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 112.223 0.453 . . . . 34.25 112.223 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 25.5 tp -61.94 -47.89 82.89 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 107.656 -1.239 . . . . 39.3 107.656 178.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -56.67 -44.17 81.14 Favored 'General case' 0 CA--C 1.555 1.141 0 CA-C-O 122.03 0.919 . . . . 67.47 109.29 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -57.15 -47.21 81.73 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 116.808 2.151 . . . . 58.81 116.808 -179.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 41.9 t -66.07 -43.55 92.33 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.07 0 N-CA-C 110.212 -0.292 . . . . 49.54 110.212 179.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 13.5 mmt -59.87 -46.93 87.75 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-O 121.277 0.56 . . . . 64.66 110.195 -179.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 53.3 m -61.69 -42.89 99.54 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.89 -0.595 . . . . 42.35 111.236 178.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -63.64 -29.17 70.44 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 119.182 0.901 . . . . 53.4 112.034 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 96.0 mt -78.8 -9.46 59.46 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 120.066 -0.654 . . . . 46.92 111.406 178.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 110.4 1.04 29.53 Favored Glycine 0 CA--C 1.507 -0.427 0 N-CA-C 117.654 1.821 . . . . 37.2 117.654 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -75.67 146.09 40.48 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 117.558 0.679 . . . . 58.41 110.463 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -107.57 117.52 34.31 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 102.483 -3.154 . . . . 51.17 102.483 175.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -145.26 165.66 27.75 Favored 'General case' 0 CA--C 1.506 -0.733 0 C-N-CA 116.461 -2.095 . . . . 56.59 111.722 178.517 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.3 p -110.3 169.35 8.79 Favored 'General case' 0 CA--C 1.487 -1.469 0 N-CA-C 107.827 -1.175 . . . . 49.31 107.827 -179.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -65.66 -29.87 70.49 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 118.848 -1.141 . . . . 61.52 109.573 179.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -64.69 -37.51 87.84 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 123.622 0.576 . . . . 57.82 110.697 -178.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -68.8 -45.72 70.52 Favored 'General case' 0 C--O 1.254 1.331 0 N-CA-C 107.635 -1.246 . . . . 44.64 107.635 178.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 48.6 t -58.88 -40.91 81.38 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 C-N-CA 118.829 -1.148 . . . . 44.79 111.682 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -60.63 -38.44 84.78 Favored 'General case' 0 CA--C 1.496 -1.126 0 N-CA-C 113.925 1.083 . . . . 46.31 113.925 179.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -64.06 -42.88 96.87 Favored 'General case' 0 C--O 1.247 0.923 0 C-N-CA 118.673 -1.211 . . . . 41.8 109.983 -179.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 81.6 mtp -58.1 -50.03 74.9 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 115.746 -0.661 . . . . 45.93 109.771 176.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 2.9 mt -59.2 -39.01 77.67 Favored 'Isoleucine or valine' 0 C--O 1.246 0.903 0 C-N-CA 119.964 -0.695 . . . . 42.01 112.273 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 81.3 mtm-85 -59.21 -29.21 67.33 Favored 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 113.356 0.872 . . . . 44.4 113.356 -179.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -71.63 -18.79 62.18 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.259 1.024 . . . . 66.97 112.306 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -118.71 -22.23 7.53 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.429 0.529 . . . . 51.11 112.429 -177.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -74.55 82.23 2.0 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 118.739 2.866 . . . . 55.98 118.739 -177.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 49.3 mt -63.33 -56.17 18.79 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 N-CA-C 116.484 2.031 . . . . 63.86 116.484 179.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 55.7 p30 -79.4 5.48 12.56 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.311 0.577 . . . . 58.74 111.853 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 58.07 30.7 64.11 Favored Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 120.698 3.039 . . . . 65.67 120.698 178.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 40.0 p-10 -87.95 -3.84 58.88 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 119.299 1.549 . . . . 54.85 114.491 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.48 -1.78 72.98 Favored Glycine 0 C--O 1.242 0.651 0 C-N-CA 119.6 -1.286 . . . . 46.34 113.073 178.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -135.92 167.94 20.27 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.344 0.593 . . . . 58.26 111.97 179.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 57.5 t -107.66 117.84 54.14 Favored 'Isoleucine or valine' 0 C--O 1.247 0.932 0 N-CA-C 112.678 0.621 . . . . 36.7 112.678 -176.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 43.7 p30 -91.74 179.39 5.65 Favored 'General case' 0 C--O 1.256 1.41 0 C-N-CA 119.786 -0.766 . . . . 43.36 109.902 178.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -59.87 -45.52 92.21 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 115.509 1.67 . . . . 52.19 115.509 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -59.25 -43.39 92.44 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.824 0.85 . . . . 75.1 110.835 -179.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -69.07 -38.77 79.24 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 123.618 0.767 . . . . 51.19 110.714 -179.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -61.86 -51.21 69.12 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.665 -0.698 . . . . 50.27 110.978 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 34.7 m -57.54 -42.91 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 120.683 -0.407 . . . . 54.47 111.458 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -57.9 -44.12 86.57 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 108.785 -0.82 . . . . 76.88 108.785 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 3.9 ttm -59.79 -21.95 61.5 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 113.371 -1.74 . . . . 73.71 110.738 179.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 8.2 mtt . . . . . 0 C--O 1.254 1.333 0 N-CA-C 118.13 2.641 . . . . 78.85 118.13 179.773 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.6 t . . . . . 0 N--CA 1.5 2.037 0 N-CA-C 109.372 -0.603 . . . . 79.27 109.372 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -104.09 -34.22 8.49 Favored 'General case' 0 C--O 1.247 0.927 0 N-CA-C 109.104 -0.702 . . . . 79.77 109.104 179.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.06 -23.12 58.01 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-N 115.039 -0.982 . . . . 78.32 110.656 179.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -71.93 -41.96 67.21 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.481 -0.327 . . . . 79.0 110.499 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ILE . . . . . 0.816 HG21 HG12 ' A' ' 142' ' ' VAL . 39.8 mt -66.73 -33.52 63.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 N-CA-C 109.166 -0.679 . . . . 53.77 109.166 179.077 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -69.19 -37.53 78.19 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 111.537 0.199 . . . . 71.08 111.537 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -81.22 -27.77 35.13 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 124.611 1.194 . . . . 60.18 111.29 179.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.04 -50.84 69.08 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 108.81 -0.811 . . . . 41.33 108.81 -177.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -55.56 -48.02 75.43 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.856 0.836 . . . . 45.95 110.762 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -53.38 -40.43 64.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.553 -0.749 . . . . 47.78 110.387 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 1.6 t -72.42 -35.24 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 N-CA-C 115.132 1.53 . . . . 58.31 115.132 -179.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -80.22 -25.74 39.46 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 113.609 0.966 . . . . 56.37 113.609 -179.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -84.86 83.75 7.94 Favored 'General case' 0 C--O 1.252 1.236 0 N-CA-C 105.03 -2.211 . . . . 35.45 105.03 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 25.6 tptt -51.62 -52.11 50.25 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 113.905 -1.498 . . . . 59.66 114.34 -175.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.8 p30 -86.61 4.99 37.96 Favored 'General case' 0 C--O 1.215 -0.712 0 N-CA-C 115.928 1.825 . . . . 38.53 115.928 -179.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 65.03 16.22 61.65 Favored Glycine 0 N--CA 1.436 -1.315 0 CA-C-O 117.768 -1.573 . . . . 36.99 114.792 179.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -78.65 2.57 19.02 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 116.825 2.157 . . . . 36.19 116.825 -178.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 93.2 0.89 67.39 Favored Glycine 0 N--CA 1.473 1.152 0 C-N-CA 118.913 -1.613 . . . . 31.43 114.888 178.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -138.66 135.21 34.61 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.65 0.38 . . . . 52.65 111.045 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 93.6 mt -93.5 120.77 43.44 Favored 'Isoleucine or valine' 0 C--O 1.254 1.325 0 N-CA-C 104.277 -2.49 . . . . 34.71 104.277 174.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 87.5 p -95.05 169.87 9.81 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 109.179 -0.674 . . . . 37.36 109.179 -178.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.02 -41.5 92.33 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 122.038 0.923 . . . . 41.49 109.904 178.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.31 -43.51 92.63 Favored 'General case' 0 C--O 1.239 0.534 0 O-C-N 121.394 -0.816 . . . . 43.13 112.123 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -65.48 -44.93 85.58 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 112.223 0.453 . . . . 34.25 112.223 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 25.5 tp -61.94 -47.89 82.89 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 107.656 -1.239 . . . . 39.3 107.656 178.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -56.67 -44.17 81.14 Favored 'General case' 0 CA--C 1.555 1.141 0 CA-C-O 122.03 0.919 . . . . 67.47 109.29 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -57.15 -47.21 81.73 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 116.808 2.151 . . . . 58.81 116.808 -179.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 41.9 t -66.07 -43.55 92.33 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.07 0 N-CA-C 110.212 -0.292 . . . . 49.54 110.212 179.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 13.5 mmt -59.87 -46.93 87.75 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-O 121.277 0.56 . . . . 64.66 110.195 -179.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 53.3 m -61.69 -42.89 99.54 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.89 -0.595 . . . . 42.35 111.236 178.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -63.64 -29.17 70.44 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 119.182 0.901 . . . . 53.4 112.034 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 96.0 mt -78.8 -9.46 59.46 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 120.066 -0.654 . . . . 46.92 111.406 178.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 110.4 1.04 29.53 Favored Glycine 0 CA--C 1.507 -0.427 0 N-CA-C 117.654 1.821 . . . . 37.2 117.654 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -75.67 146.09 40.48 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 117.558 0.679 . . . . 58.41 110.463 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -107.57 117.52 34.31 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 102.483 -3.154 . . . . 51.17 102.483 175.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -145.26 165.66 27.75 Favored 'General case' 0 CA--C 1.506 -0.733 0 C-N-CA 116.461 -2.095 . . . . 56.59 111.722 178.517 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.3 p -110.3 169.35 8.79 Favored 'General case' 0 CA--C 1.487 -1.469 0 N-CA-C 107.827 -1.175 . . . . 49.31 107.827 -179.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -65.66 -29.87 70.49 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 118.848 -1.141 . . . . 61.52 109.573 179.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -64.69 -37.51 87.84 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 123.622 0.576 . . . . 57.82 110.697 -178.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -68.8 -45.72 70.52 Favored 'General case' 0 C--O 1.254 1.331 0 N-CA-C 107.635 -1.246 . . . . 44.64 107.635 178.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 48.6 t -58.88 -40.91 81.38 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 C-N-CA 118.829 -1.148 . . . . 44.79 111.682 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -60.63 -38.44 84.78 Favored 'General case' 0 CA--C 1.496 -1.126 0 N-CA-C 113.925 1.083 . . . . 46.31 113.925 179.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -64.06 -42.88 96.87 Favored 'General case' 0 C--O 1.247 0.923 0 C-N-CA 118.673 -1.211 . . . . 41.8 109.983 -179.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 81.6 mtp -58.1 -50.03 74.9 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 115.746 -0.661 . . . . 45.93 109.771 176.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 2.9 mt -59.2 -39.01 77.67 Favored 'Isoleucine or valine' 0 C--O 1.246 0.903 0 C-N-CA 119.964 -0.695 . . . . 42.01 112.273 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 81.3 mtm-85 -59.21 -29.21 67.33 Favored 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 113.356 0.872 . . . . 44.4 113.356 -179.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -71.63 -18.79 62.18 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.259 1.024 . . . . 66.97 112.306 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -118.71 -22.23 7.53 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.429 0.529 . . . . 51.11 112.429 -177.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -74.55 82.23 2.0 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 118.739 2.866 . . . . 55.98 118.739 -177.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 49.3 mt -63.33 -56.17 18.79 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 N-CA-C 116.484 2.031 . . . . 63.86 116.484 179.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 55.7 p30 -79.4 5.48 12.56 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.311 0.577 . . . . 58.74 111.853 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 58.07 30.7 64.11 Favored Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 120.698 3.039 . . . . 65.67 120.698 178.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 40.0 p-10 -87.95 -3.84 58.88 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 119.299 1.549 . . . . 54.85 114.491 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.48 -1.78 72.98 Favored Glycine 0 C--O 1.242 0.651 0 C-N-CA 119.6 -1.286 . . . . 46.34 113.073 178.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -135.92 167.94 20.27 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.344 0.593 . . . . 58.26 111.97 179.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 57.5 t -107.66 117.84 54.14 Favored 'Isoleucine or valine' 0 C--O 1.247 0.932 0 N-CA-C 112.678 0.621 . . . . 36.7 112.678 -176.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 43.7 p30 -91.74 179.39 5.65 Favored 'General case' 0 C--O 1.256 1.41 0 C-N-CA 119.786 -0.766 . . . . 43.36 109.902 178.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -59.87 -45.52 92.21 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 115.509 1.67 . . . . 52.19 115.509 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' GLU . . . . . 0.569 ' HG2' ' O ' ' A' ' 325' ' ' HOH . 3.3 mm-40 -59.25 -43.39 92.44 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.824 0.85 . . . . 75.1 110.835 -179.053 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -69.07 -38.77 79.24 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 123.618 0.767 . . . . 51.19 110.714 -179.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -61.86 -51.21 69.12 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.665 -0.698 . . . . 50.27 110.978 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' VAL . . . . . 0.816 HG12 HG21 ' A' ' 85' ' ' ILE . 34.7 m -57.54 -42.91 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 120.683 -0.407 . . . . 54.47 111.458 179.785 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 143' ' ' GLN . . . . . 0.604 ' HA ' ' OE1' ' A' ' 143' ' ' GLN . 7.8 mm-40 -57.9 -44.12 86.57 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 108.785 -0.82 . . . . 76.88 108.785 178.819 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' MET . . . . . 0.414 ' HB2' ' HE2' ' A' ' 144' ' ' MET . 3.9 ttm -59.79 -21.95 61.5 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 113.371 -1.74 . . . . 73.71 110.738 179.1 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 8.2 mtt . . . . . 0 C--O 1.254 1.333 0 N-CA-C 118.13 2.641 . . . . 78.85 118.13 179.773 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . 0.569 ' O ' ' HG2' ' A' ' 139' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.6 t . . . . . 0 N--CA 1.5 2.037 0 N-CA-C 109.372 -0.603 . . . . 79.27 109.372 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -104.09 -34.22 8.49 Favored 'General case' 0 C--O 1.247 0.927 0 N-CA-C 109.104 -0.702 . . . . 79.77 109.104 179.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.06 -23.12 58.01 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-N 115.039 -0.982 . . . . 78.32 110.656 179.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -71.93 -41.96 67.21 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.481 -0.327 . . . . 79.0 110.499 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.816 HG21 HG12 ' A' ' 142' ' ' VAL . 39.8 mt -66.73 -33.52 63.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 N-CA-C 109.166 -0.679 . . . . 53.77 109.166 179.077 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -69.19 -37.53 78.19 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 111.537 0.199 . . . . 71.08 111.537 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -81.22 -27.77 35.13 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 124.611 1.194 . . . . 60.18 111.29 179.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.04 -50.84 69.08 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 108.81 -0.811 . . . . 41.33 108.81 -177.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -55.56 -48.02 75.43 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.856 0.836 . . . . 45.95 110.762 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -53.38 -40.43 64.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.553 -0.749 . . . . 47.78 110.387 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 1.6 t -72.42 -35.24 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 N-CA-C 115.132 1.53 . . . . 58.31 115.132 -179.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -80.22 -25.74 39.46 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 113.609 0.966 . . . . 56.37 113.609 -179.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -84.86 83.75 7.94 Favored 'General case' 0 C--O 1.252 1.236 0 N-CA-C 105.03 -2.211 . . . . 35.45 105.03 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 25.6 tptt -51.62 -52.11 50.25 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 113.905 -1.498 . . . . 59.66 114.34 -175.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.8 p30 -86.61 4.99 37.96 Favored 'General case' 0 C--O 1.215 -0.712 0 N-CA-C 115.928 1.825 . . . . 38.53 115.928 -179.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 65.03 16.22 61.65 Favored Glycine 0 N--CA 1.436 -1.315 0 CA-C-O 117.768 -1.573 . . . . 36.99 114.792 179.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -78.65 2.57 19.02 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 116.825 2.157 . . . . 36.19 116.825 -178.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 93.2 0.89 67.39 Favored Glycine 0 N--CA 1.473 1.152 0 C-N-CA 118.913 -1.613 . . . . 31.43 114.888 178.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -138.66 135.21 34.61 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.65 0.38 . . . . 52.65 111.045 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 93.6 mt -93.5 120.77 43.44 Favored 'Isoleucine or valine' 0 C--O 1.254 1.325 0 N-CA-C 104.277 -2.49 . . . . 34.71 104.277 174.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 87.5 p -95.05 169.87 9.81 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 109.179 -0.674 . . . . 37.36 109.179 -178.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.02 -41.5 92.33 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 122.038 0.923 . . . . 41.49 109.904 178.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.31 -43.51 92.63 Favored 'General case' 0 C--O 1.239 0.534 0 O-C-N 121.394 -0.816 . . . . 43.13 112.123 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -65.48 -44.93 85.58 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 112.223 0.453 . . . . 34.25 112.223 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 25.5 tp -61.94 -47.89 82.89 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 107.656 -1.239 . . . . 39.3 107.656 178.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -56.67 -44.17 81.14 Favored 'General case' 0 CA--C 1.555 1.141 0 CA-C-O 122.03 0.919 . . . . 67.47 109.29 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -57.15 -47.21 81.73 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 116.808 2.151 . . . . 58.81 116.808 -179.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 41.9 t -66.07 -43.55 92.33 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.07 0 N-CA-C 110.212 -0.292 . . . . 49.54 110.212 179.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 13.5 mmt -59.87 -46.93 87.75 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-O 121.277 0.56 . . . . 64.66 110.195 -179.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 53.3 m -61.69 -42.89 99.54 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.89 -0.595 . . . . 42.35 111.236 178.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -63.64 -29.17 70.44 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 119.182 0.901 . . . . 53.4 112.034 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 96.0 mt -78.8 -9.46 59.46 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 120.066 -0.654 . . . . 46.92 111.406 178.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 110.4 1.04 29.53 Favored Glycine 0 CA--C 1.507 -0.427 0 N-CA-C 117.654 1.821 . . . . 37.2 117.654 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -75.67 146.09 40.48 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 117.558 0.679 . . . . 58.41 110.463 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -107.57 117.52 34.31 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 102.483 -3.154 . . . . 51.17 102.483 175.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -145.26 165.66 27.75 Favored 'General case' 0 CA--C 1.506 -0.733 0 C-N-CA 116.461 -2.095 . . . . 56.59 111.722 178.517 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.3 p -110.3 169.35 8.79 Favored 'General case' 0 CA--C 1.487 -1.469 0 N-CA-C 107.827 -1.175 . . . . 49.31 107.827 -179.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -65.66 -29.87 70.49 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 118.848 -1.141 . . . . 61.52 109.573 179.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -64.69 -37.51 87.84 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 123.622 0.576 . . . . 57.82 110.697 -178.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -68.8 -45.72 70.52 Favored 'General case' 0 C--O 1.254 1.331 0 N-CA-C 107.635 -1.246 . . . . 44.64 107.635 178.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 48.6 t -58.88 -40.91 81.38 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 C-N-CA 118.829 -1.148 . . . . 44.79 111.682 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -60.63 -38.44 84.78 Favored 'General case' 0 CA--C 1.496 -1.126 0 N-CA-C 113.925 1.083 . . . . 46.31 113.925 179.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -64.06 -42.88 96.87 Favored 'General case' 0 C--O 1.247 0.923 0 C-N-CA 118.673 -1.211 . . . . 41.8 109.983 -179.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 81.6 mtp -58.1 -50.03 74.9 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 115.746 -0.661 . . . . 45.93 109.771 176.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 2.9 mt -59.2 -39.01 77.67 Favored 'Isoleucine or valine' 0 C--O 1.246 0.903 0 C-N-CA 119.964 -0.695 . . . . 42.01 112.273 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 81.3 mtm-85 -59.21 -29.21 67.33 Favored 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 113.356 0.872 . . . . 44.4 113.356 -179.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -71.63 -18.79 62.18 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.259 1.024 . . . . 66.97 112.306 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -118.71 -22.23 7.53 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.429 0.529 . . . . 51.11 112.429 -177.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -74.55 82.23 2.0 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 118.739 2.866 . . . . 55.98 118.739 -177.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 49.3 mt -63.33 -56.17 18.79 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 N-CA-C 116.484 2.031 . . . . 63.86 116.484 179.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 55.7 p30 -79.4 5.48 12.56 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.311 0.577 . . . . 58.74 111.853 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 58.07 30.7 64.11 Favored Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 120.698 3.039 . . . . 65.67 120.698 178.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 40.0 p-10 -87.95 -3.84 58.88 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 119.299 1.549 . . . . 54.85 114.491 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.48 -1.78 72.98 Favored Glycine 0 C--O 1.242 0.651 0 C-N-CA 119.6 -1.286 . . . . 46.34 113.073 178.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -135.92 167.94 20.27 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.344 0.593 . . . . 58.26 111.97 179.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 57.5 t -107.66 117.84 54.14 Favored 'Isoleucine or valine' 0 C--O 1.247 0.932 0 N-CA-C 112.678 0.621 . . . . 36.7 112.678 -176.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 43.7 p30 -91.74 179.39 5.65 Favored 'General case' 0 C--O 1.256 1.41 0 C-N-CA 119.786 -0.766 . . . . 43.36 109.902 178.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -59.87 -45.52 92.21 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 115.509 1.67 . . . . 52.19 115.509 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.569 ' HG2' ' O ' ' A' ' 325' ' ' HOH . 3.3 mm-40 -59.25 -43.39 92.44 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.824 0.85 . . . . 75.1 110.835 -179.053 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -69.07 -38.77 79.24 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 123.618 0.767 . . . . 51.19 110.714 -179.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -61.86 -51.21 69.12 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.665 -0.698 . . . . 50.27 110.978 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.816 HG12 HG21 ' A' ' 85' ' ' ILE . 34.7 m -57.54 -42.91 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 120.683 -0.407 . . . . 54.47 111.458 179.785 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.604 ' HA ' ' OE1' ' A' ' 143' ' ' GLN . 7.8 mm-40 -57.9 -44.12 86.57 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 108.785 -0.82 . . . . 76.88 108.785 178.819 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' MET . . . . . 0.414 ' HB2' ' HE2' ' A' ' 144' ' ' MET . 3.9 ttm -59.79 -21.95 61.5 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 113.371 -1.74 . . . . 73.71 110.738 179.1 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 8.2 mtt . . . . . 0 C--O 1.254 1.333 0 N-CA-C 118.13 2.641 . . . . 78.85 118.13 179.773 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . 0.569 ' O ' ' HG2' ' A' ' 139' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_