data_3mpy_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 3mpy _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 ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.25 0 N-CA-C 111.783 0.29 . . . . 41.460000000000001 111.783 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -71.17 177.0 4.04 Favored 'General case' 0 C--O 1.21 -0.979 0 C-N-CA 119.035 -1.066 . . . . 29.52 108.977 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LEU . . . . . 0.86 ' O ' ' O ' ' A' ' 201' ' ' HOH . 0.1 OUTLIER -132.37 133.53 44.08 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 108.549 -0.908 . . . . 28.440000000000001 108.549 -178.05 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -124.4 153.27 17.59 Favored Glycine 0 C--O 1.189 -2.663 0 N-CA-C 105.093 -3.203 . . . . 28.07 105.093 176.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 39.7 mtp -151.84 148.22 27.57 Favored 'General case' 0 N--CA 1.42 -1.951 0 N-CA-C 108.503 -0.925 . . . . 43.719999999999999 108.503 -175.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ILE . . . . . 0.825 ' CG1' ' CE ' ' A' ' 22' ' ' MET . 0.7 OUTLIER -139.48 137.16 40.63 Favored 'Isoleucine or valine' 0 CA--C 1.475 -1.915 0 N-CA-C 102.471 -3.159 . . . . 32.799999999999997 102.471 -177.903 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -116.98 143.64 45.49 Favored 'General case' 0 N--CA 1.429 -1.507 0 N-CA-C 106.496 -1.668 . . . . 52.109999999999999 106.496 173.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' THR . . . . . 0.513 ' CG2' ' O ' ' A' ' 11' ' ' GLY . 1.0 OUTLIER -136.46 153.78 50.96 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 107.385 -1.339 . . . . 38.32 107.385 178.075 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ARG . . . . . 0.652 ' NH1' ' O ' ' A' ' 38' ' ' GLY . 57.5 ttm-85 -103.92 103.19 13.01 Favored 'General case' 0 C--O 1.257 1.467 0 N-CA-C 107.909 -1.145 . . . . 60.909999999999997 107.909 166.46 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLY . . . . . 0.513 ' O ' ' CG2' ' A' ' 9' ' ' THR . . . 115.57 137.16 6.15 Favored Glycine 0 C--O 1.215 -1.067 0 O-C-N 125.351 1.657 . . . . 37.979999999999997 110.386 -166.933 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 33.2 tp -83.48 -25.83 30.78 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 113.891 1.071 . . . . 34.460000000000001 113.891 -175.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.5 m -74.94 -35.65 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.629 0 C-N-CA 116.965 -1.894 . . . . 34.18 109.91 178.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.46 -41.7 63.55 Favored 'General case' 0 C--O 1.251 1.132 0 CA-C-N 120.8 1.637 . . . . 31.41 112.237 171.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.9 tp -73.91 -37.0 64.77 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 113.954 -1.476 . . . . 32.270000000000003 112.224 -171.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ILE . . . . . 0.866 ' CB ' ' O ' ' A' ' 204' ' ' HOH . 0.0 OUTLIER -68.62 -37.83 78.17 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.888 0 C-N-CA 119.621 -0.832 . . . . 34.770000000000003 111.227 175.633 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . 0.406 ' N ' ' CG2' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -70.5 -46.65 63.29 Favored 'General case' 0 C--O 1.207 -1.134 0 C-N-CA 123.984 0.914 . . . . 52.630000000000003 111.754 177.12 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.76 -49.14 66.09 Favored 'General case' 0 C--O 1.211 -0.94 0 C-N-CA 121.081 -0.248 . . . . 30.920000000000002 110.747 170.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 67.3 m -57.95 -31.75 67.16 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 116.373 1.99 . . . . 31.289999999999999 116.373 176.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASP . . . . . 0.501 ' O ' ' CG ' ' A' ' 24' ' ' LYS . 29.9 t70 -78.07 -30.13 49.53 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 105.549 -2.019 . . . . 35.619999999999997 105.549 -170.64 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.88 -44.33 73.47 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 126.379 2.3 . . . . 34.700000000000003 112.077 177.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' MET . . . . . 0.825 ' CE ' ' CG1' ' A' ' 7' ' ' ILE . 18.9 mtt -60.81 -56.18 24.31 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-O 122.995 1.378 . . . . 41.149999999999999 109.221 -177.455 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -62.7 -29.04 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.913 0 CA-C-N 112.264 -2.244 . . . . 37.93 115.433 -177.529 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . 0.501 ' CG ' ' O ' ' A' ' 20' ' ' ASP . 72.6 mttt -83.2 -16.0 48.27 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 121.298 -0.876 . . . . 36.560000000000002 111.642 176.208 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -103.2 -7.09 21.49 Favored 'General case' 0 C--O 1.272 2.26 0 C-N-CA 118.425 -1.31 . . . . 37.530000000000001 113.699 -167.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -162.79 164.76 26.05 Favored 'General case' 0 N--CA 1.44 -0.974 0 O-C-N 124.845 1.34 . . . . 36.490000000000002 111.389 -174.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -82.83 72.39 9.91 Favored 'General case' 0 C--O 1.198 -1.653 0 N-CA-C 105.592 -2.003 . . . . 61.68 105.592 178.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.6 m -122.39 158.27 26.54 Favored 'Isoleucine or valine' 0 CA--C 1.474 -1.973 0 N-CA-C 106.572 -1.64 . . . . 32.140000000000001 106.572 174.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -118.36 128.0 54.22 Favored 'General case' 0 C--O 1.196 -1.74 0 O-C-N 124.107 0.879 . . . . 37.719999999999999 111.268 -178.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 29.4 tp -75.13 120.3 20.46 Favored 'General case' 0 CA--C 1.471 -2.083 0 N-CA-C 108.79 -0.818 . . . . 31.379999999999999 108.79 174.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 16.2 m -113.27 -24.43 3.86 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.805 0 O-C-N 125.507 1.755 . . . . 32.130000000000003 113.57 -170.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 179.83 178.53 48.52 Favored Glycine 0 C--O 1.195 -2.287 0 C-N-CA 119.128 -1.51 . . . . 33.670000000000002 111.104 172.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' VAL . . . . . 0.426 ' O ' ' CG1' ' A' ' 33' ' ' VAL . 14.7 p -155.71 138.95 7.51 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.634 0 N-CA-C 106.807 -1.553 . . . . 38.609999999999999 106.807 -171.53 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -142.04 131.88 24.31 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-O 122.472 1.13 . . . . 48.909999999999997 111.048 -172.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -103.84 148.63 25.9 Favored 'General case' 0 N--CA 1.428 -1.568 0 C-N-CA 119.654 -0.818 . . . . 49.969999999999999 110.569 173.489 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ILE . . . . . 0.542 ' CG2' ' O ' ' A' ' 36' ' ' ILE . 22.2 mm -122.79 20.84 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 N-CA-C 115.615 1.709 . . . . 45.539999999999999 115.615 -179.012 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.01 173.62 45.95 Favored Glycine 0 N--CA 1.471 0.973 0 N-CA-C 108.527 -1.829 . . . . 43.210000000000001 108.527 -177.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . 0.652 ' O ' ' NH1' ' A' ' 10' ' ' ARG . . . 72.35 4.07 59.3 Favored Glycine 0 CA--C 1.478 -2.227 0 N-CA-C 108.56 -1.816 . . . . 42.049999999999997 108.56 176.469 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 77.37 17.47 79.26 Favored Glycine 0 C--O 1.214 -1.127 0 CA-C-N 114.392 -0.904 . . . . 41.039999999999999 114.991 -175.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 50.7 mt -90.39 136.46 33.04 Favored 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 107.649 -1.241 . . . . 42.409999999999997 107.649 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -147.42 147.93 30.76 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 122.949 1.357 . . . . 44.530000000000001 114.225 176.394 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' THR . . . . . 0.791 ' CG2' ' CE ' ' A' ' 44' ' ' MET . 65.6 m -135.96 136.47 40.42 Favored 'General case' 0 C--O 1.179 -2.63 0 CA-C-N 114.409 -1.268 . . . . 29.649999999999999 111.787 -163.961 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -114.01 144.99 42.19 Favored 'General case' 0 N--CA 1.386 -3.656 0 N-CA-C 107.062 -1.458 . . . . 27.98 107.062 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' MET . . . . . 0.791 ' CE ' ' CG2' ' A' ' 42' ' ' THR . 0.0 OUTLIER -122.03 138.69 54.34 Favored 'General case' 0 C--O 1.245 0.846 0 O-C-N 124.538 1.149 . . . . 42.539999999999999 111.969 175.179 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.3 m -128.81 153.55 38.52 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.866 0 CA-C-N 114.845 -1.07 . . . . 27.039999999999999 110.035 176.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.6 mmm-85 -127.63 147.65 50.36 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 108.953 -0.758 . . . . 38.920000000000002 108.953 175.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 171.04 -164.92 38.06 Favored Glycine 0 C--O 1.207 -1.585 0 N-CA-C 108.196 -1.961 . . . . 29.469999999999999 108.196 176.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . 0.506 ' N ' ' OD1' ' A' ' 48' ' ' ASP . 0.0 OUTLIER -69.19 155.05 41.05 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 106.615 -1.624 . . . . 43.020000000000003 106.615 -178.631 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.7 t -61.39 -33.51 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.688 0 CA-C-O 122.071 0.939 . . . . 33.32 111.803 -171.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.52 -45.13 73.07 Favored 'General case' 0 CA--C 1.503 -0.841 0 CA-C-N 113.08 -1.873 . . . . 31.039999999999999 108.248 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.54 -38.78 92.21 Favored 'General case' 0 CA--C 1.478 -1.799 0 CA-C-N 113.965 -1.471 . . . . 30.359999999999999 112.199 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 86.8 m -74.49 -17.47 60.76 Favored 'General case' 0 CA--C 1.472 -2.052 0 C-N-CA 117.026 -1.869 . . . . 30.649999999999999 106.835 -173.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.4 mmmt -82.74 -39.72 21.5 Favored 'General case' 0 C--O 1.176 -2.779 0 N-CA-C 107.784 -1.191 . . . . 43.009999999999998 107.784 179.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.49 -55.32 18.52 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 113.815 1.043 . . . . 31.93 113.815 174.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -37.07 -68.78 0.13 Allowed 'General case' 0 C--O 1.202 -1.413 0 CA-C-N 114.521 -1.218 . . . . 32.590000000000003 113.407 164.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 37.5 p -71.02 -19.46 62.51 Favored 'General case' 0 N--CA 1.418 -2.069 0 O-C-N 121.002 -1.061 . . . . 35.859999999999999 109.62 -166.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -81.82 -33.01 30.99 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 108.713 -0.847 . . . . 58.630000000000003 108.713 179.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.01 -43.85 73.97 Favored 'General case' 0 CA--C 1.497 -1.064 0 N-CA-C 108.654 -0.869 . . . . 36.630000000000003 108.654 174.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -68.31 -34.17 79.54 Favored Glycine 0 C--O 1.22 -0.737 0 N-CA-C 115.48 0.952 . . . . 34.32 115.48 -176.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.56 -50.25 65.87 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-O 122.309 1.052 . . . . 38.600000000000001 113.577 174.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -40.96 -59.12 1.53 Allowed 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.68 -0.638 . . . . 41.920000000000002 112.532 168.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.68 -41.6 87.85 Favored 'General case' 0 C--O 1.206 -1.229 0 N-CA-C 109.25 -0.648 . . . . 46.450000000000003 109.25 -172.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ALA . . . . . 0.832 ' CB ' ' CD2' ' A' ' 69' ' ' LEU . . . -54.68 -48.72 72.05 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 118.95 -1.1 . . . . 47.530000000000001 108.981 -177.901 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -68.05 -14.93 63.36 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 114.359 1.244 . . . . 54.490000000000002 114.359 -172.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ARG . . . . . 0.419 ' CB ' ' CD1' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -82.31 -26.43 33.07 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 108.207 -1.035 . . . . 68.659999999999997 108.207 -178.294 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ILE . . . . . 0.513 ' O ' ' CG2' ' A' ' 66' ' ' ILE . 3.9 mp -129.28 -1.47 2.94 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.098 0 N-CA-C 115.61 1.707 . . . . 66.040000000000006 115.61 -171.492 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -144.95 -119.55 1.29 Allowed Glycine 0 N--CA 1.469 0.847 0 N-CA-C 117.309 1.683 . . . . 61.68 117.309 -171.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -162.28 101.3 1.09 Allowed 'General case' 0 CA--C 1.474 -1.966 0 N-CA-C 105.409 -2.071 . . . . 59.869999999999997 105.409 172.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . 0.832 ' CD2' ' CB ' ' A' ' 63' ' ' ALA . 48.7 mt -63.25 129.17 39.16 Favored 'General case' 0 CA--C 1.493 -1.219 0 N-CA-C 113.366 0.876 . . . . 56.299999999999997 113.366 172.258 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 17.0 t -89.36 -47.68 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.727 0 N-CA-C 107.847 -1.168 . . . . 45.700000000000003 107.847 172.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.7 p -165.08 153.56 11.98 Favored 'General case' 0 C--O 1.202 -1.402 0 CA-C-N 120.872 1.669 . . . . 40.93 112.484 176.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 25.4 t -126.08 143.29 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-N 118.844 0.747 . . . . 37.240000000000002 111.426 173.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -171.29 146.08 2.27 Favored 'General case' 0 CA--C 1.465 -2.311 0 C-N-CA 116.738 -1.985 . . . . 39.130000000000003 111.034 -175.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.2 t -119.68 135.87 58.61 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.02 0 N-CA-C 103.882 -2.636 . . . . 29.550000000000001 103.882 -178.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . 0.583 ' CD1' ' O ' ' A' ' 201' ' ' HOH . 1.7 mp -116.08 114.88 41.05 Favored Pre-proline 0 C--O 1.189 -2.101 0 N-CA-C 103.307 -2.849 . . . . 33.920000000000002 103.307 168.992 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -64.59 -34.22 52.98 Favored 'Trans proline' 0 C--O 1.167 -3.045 0 N-CA-C 116.636 1.744 . . . . 31.170000000000002 116.636 -170.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -142.91 69.0 18.76 Favored Pre-proline 0 N--CA 1.496 1.83 0 C-N-CA 128.966 2.906 . . . . 53.539999999999999 114.958 -170.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -65.01 143.93 80.61 Favored 'Trans proline' 0 N--CA 1.418 -2.924 1 C-N-CA 127.403 5.402 . . . . 32.609999999999999 106.409 -169.278 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' HIS . . . . . 0.569 ' ND1' ' CB ' ' A' ' 81' ' ' ASP . 53.5 t-80 -68.04 142.32 55.92 Favored 'General case' 0 N--CA 1.424 -1.774 0 O-C-N 124.887 1.367 . . . . 39.399999999999999 107.888 -176.998 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -58.85 -16.57 31.99 Favored Glycine 0 CA--C 1.509 -0.304 0 C-N-CA 119.287 -1.435 . . . . 36.109999999999999 114.819 177.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ASP . . . . . 0.569 ' CB ' ' ND1' ' A' ' 79' ' ' HIS . 4.7 t0 -67.91 -27.13 66.38 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-O 121.857 0.837 . . . . 46.210000000000001 111.399 -179.424 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.7 mp -64.12 -29.12 70.27 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 115.265 1.58 . . . . 41.229999999999997 115.265 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . 0.672 ' OE2' ' N ' ' A' ' 83' ' ' GLU . 8.5 mp0 -75.34 -26.19 58.39 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.032 -1.44 . . . . 51.25 112.455 -177.274 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -65.06 -45.32 85.85 Favored 'General case' 0 CA--C 1.498 -1.053 0 N-CA-C 115.14 1.533 . . . . 43.390000000000001 115.14 170.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.6 t -96.72 -32.49 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 N-CA-C 120.532 3.53 . . . . 43.109999999999999 120.532 -174.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -111.85 149.57 41.01 Favored Pre-proline 0 N--CA 1.489 1.506 0 N-CA-C 116.884 2.179 . . . . 41.439999999999998 116.884 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -66.64 47.84 0.26 Allowed 'Trans proline' 0 C--O 1.206 -1.096 1 C-N-CA 126.094 4.53 . . . . 44.240000000000002 114.288 177.067 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ILE . . . . . 0.41 ' CG2' ' O ' ' A' ' 88' ' ' ILE 0.55 9.0 mt -121.82 82.03 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.497 -1.06 0 CA-C-O 117.176 -1.392 . . . . 54.460000000000001 112.343 175.648 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -161.97 129.08 2.01 Favored Glycine 0 C--O 1.22 -0.754 0 N-CA-C 110.732 -0.947 . . . . 57.520000000000003 110.732 -164.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.23 -3.64 0.94 Allowed 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 114.026 1.121 . . . . 67.019999999999996 114.026 -171.786 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LYS . . . . . 0.953 ' O ' ' N ' ' A' ' 93' ' ' ASP . 31.4 mmtt -141.84 115.55 9.12 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 120.697 -1.252 . . . . 76.920000000000002 112.225 179.307 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . 0.644 ' C ' ' O ' ' A' ' 91' ' ' LYS . . . -26.63 75.35 0.0 OUTLIER Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 119.902 -1.142 . . . . 85.519999999999996 110.252 -177.422 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . 0.953 ' N ' ' O ' ' A' ' 91' ' ' LYS . 99.0 m-20 -99.96 -6.2 26.98 Favored 'General case' 0 CA--C 1.472 -2.041 0 N-CA-C 107.265 -1.383 . . . . 92.049999999999997 107.265 -177.151 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' SER . . . . . 0.92 ' OG ' ' N ' ' A' ' 95' ' ' SER . 11.2 t 179.29 -172.65 0.17 Allowed 'General case' 0 N--CA 1.428 -1.57 1 N-CA-C 125.429 5.344 . . . . 94.569999999999993 125.429 -166.832 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' SER . . . . . 0.92 ' N ' ' OG ' ' A' ' 94' ' ' SER . 11.4 p 63.26 62.9 0.95 Allowed 'General case' 0 N--CA 1.425 -1.684 0 CA-C-N 108.981 -3.736 . . . . 96.969999999999999 108.826 -171.007 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ASN . . . . . 0.792 ' OD1' ' O ' ' A' ' 95' ' ' SER . 0.4 OUTLIER -158.83 109.54 2.06 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 105.056 -2.201 . . . . 100.34999999999999 105.056 166.306 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 52.1 mt . . . . . 0 C--O 1.237 0.409 0 CA-C-N 115.717 -0.674 . . . . 98.930000000000007 110.275 178.82 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . 0.86 ' O ' ' O ' ' A' ' 4' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . 0.866 ' O ' ' CB ' ' A' ' 16' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLU . . . . . 0.645 ' HG2' ' N ' ' A' ' 47' ' ' GLY . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.25 0 N-CA-C 111.783 0.29 . . . . 41.460000000000001 111.783 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -71.17 177.0 4.04 Favored 'General case' 0 C--O 1.21 -0.979 0 C-N-CA 119.035 -1.066 . . . . 29.52 108.977 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LEU . . . . . 0.86 ' O ' ' O ' ' A' ' 201' ' ' HOH . 0.1 OUTLIER -132.37 133.53 44.08 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 108.549 -0.908 . . . . 28.440000000000001 108.549 -178.05 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -124.4 153.27 17.59 Favored Glycine 0 C--O 1.189 -2.663 0 N-CA-C 105.093 -3.203 . . . . 28.07 105.093 176.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 39.7 mtp -151.84 148.22 27.57 Favored 'General case' 0 N--CA 1.42 -1.951 0 N-CA-C 108.503 -0.925 . . . . 43.719999999999999 108.503 -175.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ILE . . . . . 0.926 HG13 ' HE1' ' A' ' 22' ' ' MET . 0.7 OUTLIER -139.48 137.16 40.63 Favored 'Isoleucine or valine' 0 CA--C 1.475 -1.915 0 N-CA-C 102.471 -3.159 . . . . 32.799999999999997 102.471 -177.903 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLU . . . . . 0.489 ' HB3' ' HB ' ' A' ' 70' ' ' VAL . 12.3 tt0 -116.98 143.64 45.49 Favored 'General case' 0 N--CA 1.429 -1.507 0 N-CA-C 106.496 -1.668 . . . . 52.109999999999999 106.496 173.989 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' THR . . . . . 0.985 HG21 ' HB3' ' A' ' 14' ' ' ALA . 1.0 OUTLIER -136.46 153.78 50.96 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 107.385 -1.339 . . . . 38.32 107.385 178.075 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ARG . . . . . 0.652 ' NH1' ' O ' ' A' ' 38' ' ' GLY . 57.5 ttm-85 -103.92 103.19 13.01 Favored 'General case' 0 C--O 1.257 1.467 0 N-CA-C 107.909 -1.145 . . . . 60.909999999999997 107.909 166.46 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLY . . . . . 0.729 ' O ' HG22 ' A' ' 9' ' ' THR . . . 115.57 137.16 6.15 Favored Glycine 0 C--O 1.215 -1.067 0 O-C-N 125.351 1.657 . . . . 37.979999999999997 110.386 -166.933 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 33.2 tp -83.48 -25.83 30.78 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 113.891 1.071 . . . . 34.460000000000001 113.891 -175.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' VAL . . . . . 0.484 ' O ' HG22 ' A' ' 16' ' ' ILE . 4.5 m -74.94 -35.65 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.629 0 C-N-CA 116.965 -1.894 . . . . 34.18 109.91 178.121 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . 0.985 ' HB3' HG21 ' A' ' 9' ' ' THR . . . -52.46 -41.7 63.55 Favored 'General case' 0 C--O 1.251 1.132 0 CA-C-N 120.8 1.637 . . . . 31.41 112.237 171.891 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . 0.519 HD22 ' HB2' ' A' ' 41' ' ' CYS . 14.9 tp -73.91 -37.0 64.77 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 113.954 -1.476 . . . . 32.270000000000003 112.224 -171.277 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ILE . . . . . 1.106 ' HB ' ' O ' ' A' ' 204' ' ' HOH . 0.0 OUTLIER -68.62 -37.83 78.17 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.888 0 C-N-CA 119.621 -0.832 . . . . 34.770000000000003 111.227 175.633 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . 0.612 ' OE2' HD13 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -70.5 -46.65 63.29 Favored 'General case' 0 C--O 1.207 -1.134 0 C-N-CA 123.984 0.914 . . . . 52.630000000000003 111.754 177.12 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.76 -49.14 66.09 Favored 'General case' 0 C--O 1.211 -0.94 0 C-N-CA 121.081 -0.248 . . . . 30.920000000000002 110.747 170.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 67.3 m -57.95 -31.75 67.16 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 116.373 1.99 . . . . 31.289999999999999 116.373 176.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASP . . . . . 0.933 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 29.9 t70 -78.07 -30.13 49.53 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 105.549 -2.019 . . . . 35.619999999999997 105.549 -170.64 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.88 -44.33 73.47 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 126.379 2.3 . . . . 34.700000000000003 112.077 177.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' MET . . . . . 0.96 ' HE2' ' HA ' ' A' ' 56' ' ' THR . 18.9 mtt -60.81 -56.18 24.31 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-O 122.995 1.378 . . . . 41.149999999999999 109.221 -177.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -62.7 -29.04 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.913 0 CA-C-N 112.264 -2.244 . . . . 37.93 115.433 -177.529 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . 0.933 ' HG3' ' O ' ' A' ' 20' ' ' ASP . 72.6 mttt -83.2 -16.0 48.27 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 121.298 -0.876 . . . . 36.560000000000002 111.642 176.208 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -103.2 -7.09 21.49 Favored 'General case' 0 C--O 1.272 2.26 0 C-N-CA 118.425 -1.31 . . . . 37.530000000000001 113.699 -167.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -162.79 164.76 26.05 Favored 'General case' 0 N--CA 1.44 -0.974 0 O-C-N 124.845 1.34 . . . . 36.490000000000002 111.389 -174.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -82.83 72.39 9.91 Favored 'General case' 0 C--O 1.198 -1.653 0 N-CA-C 105.592 -2.003 . . . . 61.68 105.592 178.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.6 m -122.39 158.27 26.54 Favored 'Isoleucine or valine' 0 CA--C 1.474 -1.973 0 N-CA-C 106.572 -1.64 . . . . 32.140000000000001 106.572 174.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -118.36 128.0 54.22 Favored 'General case' 0 C--O 1.196 -1.74 0 O-C-N 124.107 0.879 . . . . 37.719999999999999 111.268 -178.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 29.4 tp -75.13 120.3 20.46 Favored 'General case' 0 CA--C 1.471 -2.083 0 N-CA-C 108.79 -0.818 . . . . 31.379999999999999 108.79 174.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 16.2 m -113.27 -24.43 3.86 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.805 0 O-C-N 125.507 1.755 . . . . 32.130000000000003 113.57 -170.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 179.83 178.53 48.52 Favored Glycine 0 C--O 1.195 -2.287 0 C-N-CA 119.128 -1.51 . . . . 33.670000000000002 111.104 172.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' VAL . . . . . 0.521 HG13 ' O ' ' A' ' 33' ' ' VAL . 14.7 p -155.71 138.95 7.51 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.634 0 N-CA-C 106.807 -1.553 . . . . 38.609999999999999 106.807 -171.53 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LYS . . . . . 0.412 ' HZ3' ' HG3' ' A' ' 34' ' ' LYS . 2.2 tptp -142.04 131.88 24.31 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-O 122.472 1.13 . . . . 48.909999999999997 111.048 -172.183 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLN . . . . . 0.449 ' O ' HD13 ' A' ' 36' ' ' ILE . 0.9 OUTLIER -103.84 148.63 25.9 Favored 'General case' 0 N--CA 1.428 -1.568 0 C-N-CA 119.654 -0.818 . . . . 49.969999999999999 110.569 173.489 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ILE . . . . . 0.804 ' O ' HG22 ' A' ' 36' ' ' ILE . 22.2 mm -122.79 20.84 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 N-CA-C 115.615 1.709 . . . . 45.539999999999999 115.615 -179.012 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.01 173.62 45.95 Favored Glycine 0 N--CA 1.471 0.973 0 N-CA-C 108.527 -1.829 . . . . 43.210000000000001 108.527 -177.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . 0.652 ' O ' ' NH1' ' A' ' 10' ' ' ARG . . . 72.35 4.07 59.3 Favored Glycine 0 CA--C 1.478 -2.227 0 N-CA-C 108.56 -1.816 . . . . 42.049999999999997 108.56 176.469 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 77.37 17.47 79.26 Favored Glycine 0 C--O 1.214 -1.127 0 CA-C-N 114.392 -0.904 . . . . 41.039999999999999 114.991 -175.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . 0.628 ' CD2' HG21 ' A' ' 70' ' ' VAL . 50.7 mt -90.39 136.46 33.04 Favored 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 107.649 -1.241 . . . . 42.409999999999997 107.649 179.335 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' CYS . . . . . 0.519 ' HB2' HD22 ' A' ' 15' ' ' LEU . 0.5 OUTLIER -147.42 147.93 30.76 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 122.949 1.357 . . . . 44.530000000000001 114.225 176.394 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 42' ' ' THR . . . . . 1.047 HG22 ' CE ' ' A' ' 44' ' ' MET . 65.6 m -135.96 136.47 40.42 Favored 'General case' 0 C--O 1.179 -2.63 0 CA-C-N 114.409 -1.268 . . . . 29.649999999999999 111.787 -163.961 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -114.01 144.99 42.19 Favored 'General case' 0 N--CA 1.386 -3.656 0 N-CA-C 107.062 -1.458 . . . . 27.98 107.062 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' MET . . . . . 1.047 ' CE ' HG22 ' A' ' 42' ' ' THR . 0.0 OUTLIER -122.03 138.69 54.34 Favored 'General case' 0 C--O 1.245 0.846 0 O-C-N 124.538 1.149 . . . . 42.539999999999999 111.969 175.179 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.3 m -128.81 153.55 38.52 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.866 0 CA-C-N 114.845 -1.07 . . . . 27.039999999999999 110.035 176.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ARG . . . . . 0.648 ' HD3' HG22 ' A' ' 88' ' ' ILE . 27.6 mmm-85 -127.63 147.65 50.36 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 108.953 -0.758 . . . . 38.920000000000002 108.953 175.44 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLY . . . . . 0.645 ' N ' ' HG2' ' A' ' 2' ' ' GLU . . . 171.04 -164.92 38.06 Favored Glycine 0 C--O 1.207 -1.585 0 N-CA-C 108.196 -1.961 . . . . 29.469999999999999 108.196 176.675 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . 0.4 ' OD1' ' N ' ' A' ' 48' ' ' ASP . 0.0 OUTLIER -69.19 155.05 41.05 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 106.615 -1.624 . . . . 43.020000000000003 106.615 -178.631 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 49' ' ' VAL . . . . . 0.622 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 44.7 t -61.39 -33.51 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.688 0 CA-C-O 122.071 0.939 . . . . 33.32 111.803 -171.509 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.52 -45.13 73.07 Favored 'General case' 0 CA--C 1.503 -0.841 0 CA-C-N 113.08 -1.873 . . . . 31.039999999999999 108.248 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.54 -38.78 92.21 Favored 'General case' 0 CA--C 1.478 -1.799 0 CA-C-N 113.965 -1.471 . . . . 30.359999999999999 112.199 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 86.8 m -74.49 -17.47 60.76 Favored 'General case' 0 CA--C 1.472 -2.052 0 C-N-CA 117.026 -1.869 . . . . 30.649999999999999 106.835 -173.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . 0.622 ' HG2' ' O ' ' A' ' 49' ' ' VAL . 8.4 mmmt -82.74 -39.72 21.5 Favored 'General case' 0 C--O 1.176 -2.779 0 N-CA-C 107.784 -1.191 . . . . 43.009999999999998 107.784 179.719 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.49 -55.32 18.52 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 113.815 1.043 . . . . 31.93 113.815 174.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . 0.42 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -37.07 -68.78 0.13 Allowed 'General case' 0 C--O 1.202 -1.413 0 CA-C-N 114.521 -1.218 . . . . 32.590000000000003 113.407 164.326 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' THR . . . . . 0.96 ' HA ' ' HE2' ' A' ' 22' ' ' MET . 37.5 p -71.02 -19.46 62.51 Favored 'General case' 0 N--CA 1.418 -2.069 0 O-C-N 121.002 -1.061 . . . . 35.859999999999999 109.62 -166.146 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -81.82 -33.01 30.99 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 108.713 -0.847 . . . . 58.630000000000003 108.713 179.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.01 -43.85 73.97 Favored 'General case' 0 CA--C 1.497 -1.064 0 N-CA-C 108.654 -0.869 . . . . 36.630000000000003 108.654 174.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -68.31 -34.17 79.54 Favored Glycine 0 C--O 1.22 -0.737 0 N-CA-C 115.48 0.952 . . . . 34.32 115.48 -176.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . 0.783 ' HB2' HG21 ' A' ' 72' ' ' VAL . . . -65.56 -50.25 65.87 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-O 122.309 1.052 . . . . 38.600000000000001 113.577 174.449 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -40.96 -59.12 1.53 Allowed 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.68 -0.638 . . . . 41.920000000000002 112.532 168.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.68 -41.6 87.85 Favored 'General case' 0 C--O 1.206 -1.229 0 N-CA-C 109.25 -0.648 . . . . 46.450000000000003 109.25 -172.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ALA . . . . . 1.15 ' HB3' HD21 ' A' ' 69' ' ' LEU . . . -54.68 -48.72 72.05 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 118.95 -1.1 . . . . 47.530000000000001 108.981 -177.901 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLN . . . . . 0.448 ' HG3' ' CD1' ' A' ' 69' ' ' LEU . 84.9 mt-30 -68.05 -14.93 63.36 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 114.359 1.244 . . . . 54.490000000000002 114.359 -172.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ARG . . . . . 0.987 ' HB3' HD12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -82.31 -26.43 33.07 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 108.207 -1.035 . . . . 68.659999999999997 108.207 -178.294 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ILE . . . . . 0.987 HD12 ' HB3' ' A' ' 65' ' ' ARG . 3.9 mp -129.28 -1.47 2.94 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.098 0 N-CA-C 115.61 1.707 . . . . 66.040000000000006 115.61 -171.492 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . 0.529 ' HA3' ' HB2' ' A' ' 14' ' ' ALA . . . -144.95 -119.55 1.29 Allowed Glycine 0 N--CA 1.469 0.847 0 N-CA-C 117.309 1.683 . . . . 61.68 117.309 -171.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -162.28 101.3 1.09 Allowed 'General case' 0 CA--C 1.474 -1.966 0 N-CA-C 105.409 -2.071 . . . . 59.869999999999997 105.409 172.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . 1.15 HD21 ' HB3' ' A' ' 63' ' ' ALA . 48.7 mt -63.25 129.17 39.16 Favored 'General case' 0 CA--C 1.493 -1.219 0 N-CA-C 113.366 0.876 . . . . 56.299999999999997 113.366 172.258 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . 0.628 HG21 ' CD2' ' A' ' 40' ' ' LEU . 17.0 t -89.36 -47.68 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.727 0 N-CA-C 107.847 -1.168 . . . . 45.700000000000003 107.847 172.48 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.7 p -165.08 153.56 11.98 Favored 'General case' 0 C--O 1.202 -1.402 0 CA-C-N 120.872 1.669 . . . . 40.93 112.484 176.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' VAL . . . . . 0.783 HG21 ' HB2' ' A' ' 60' ' ' ALA . 25.4 t -126.08 143.29 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-N 118.844 0.747 . . . . 37.240000000000002 111.426 173.39 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -171.29 146.08 2.27 Favored 'General case' 0 CA--C 1.465 -2.311 0 C-N-CA 116.738 -1.985 . . . . 39.130000000000003 111.034 -175.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.2 t -119.68 135.87 58.61 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.02 0 N-CA-C 103.882 -2.636 . . . . 29.550000000000001 103.882 -178.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . 0.742 ' N ' HD12 ' A' ' 75' ' ' ILE . 1.7 mp -116.08 114.88 41.05 Favored Pre-proline 0 C--O 1.189 -2.101 0 N-CA-C 103.307 -2.849 . . . . 33.920000000000002 103.307 168.992 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -64.59 -34.22 52.98 Favored 'Trans proline' 0 C--O 1.167 -3.045 0 N-CA-C 116.636 1.744 . . . . 31.170000000000002 116.636 -170.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -142.91 69.0 18.76 Favored Pre-proline 0 N--CA 1.496 1.83 0 C-N-CA 128.966 2.906 . . . . 53.539999999999999 114.958 -170.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -65.01 143.93 80.61 Favored 'Trans proline' 0 N--CA 1.418 -2.924 1 C-N-CA 127.403 5.402 . . . . 32.609999999999999 106.409 -169.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' HIS . . . . . 0.955 ' ND1' ' HB2' ' A' ' 81' ' ' ASP . 53.5 t-80 -68.04 142.32 55.92 Favored 'General case' 0 N--CA 1.424 -1.774 0 O-C-N 124.887 1.367 . . . . 39.399999999999999 107.888 -176.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -58.85 -16.57 31.99 Favored Glycine 0 CA--C 1.509 -0.304 0 C-N-CA 119.287 -1.435 . . . . 36.109999999999999 114.819 177.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ASP . . . . . 0.955 ' HB2' ' ND1' ' A' ' 79' ' ' HIS . 4.7 t0 -67.91 -27.13 66.38 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-O 121.857 0.837 . . . . 46.210000000000001 111.399 -179.424 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.7 mp -64.12 -29.12 70.27 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 115.265 1.58 . . . . 41.229999999999997 115.265 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . 0.672 ' OE2' ' N ' ' A' ' 83' ' ' GLU . 8.5 mp0 -75.34 -26.19 58.39 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.032 -1.44 . . . . 51.25 112.455 -177.274 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -65.06 -45.32 85.85 Favored 'General case' 0 CA--C 1.498 -1.053 0 N-CA-C 115.14 1.533 . . . . 43.390000000000001 115.14 170.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.6 t -96.72 -32.49 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 N-CA-C 120.532 3.53 . . . . 43.109999999999999 120.532 -174.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -111.85 149.57 41.01 Favored Pre-proline 0 N--CA 1.489 1.506 0 N-CA-C 116.884 2.179 . . . . 41.439999999999998 116.884 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PRO . . . . . 0.872 ' HG3' ' HB3' ' A' ' 95' ' ' SER . 5.8 Cg_exo -66.64 47.84 0.26 Allowed 'Trans proline' 0 C--O 1.206 -1.096 1 C-N-CA 126.094 4.53 . . . . 44.240000000000002 114.288 177.067 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ILE . . . . . 0.648 HG22 ' HD3' ' A' ' 46' ' ' ARG 0.55 9.0 mt -121.82 82.03 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.497 -1.06 0 CA-C-O 117.176 -1.392 . . . . 54.460000000000001 112.343 175.648 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -161.97 129.08 2.01 Favored Glycine 0 C--O 1.22 -0.754 0 N-CA-C 110.732 -0.947 . . . . 57.520000000000003 110.732 -164.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -61.23 -3.64 0.94 Allowed 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 114.026 1.121 . . . . 67.019999999999996 114.026 -171.786 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LYS . . . . . 0.953 ' O ' ' N ' ' A' ' 93' ' ' ASP . 31.4 mmtt -141.84 115.55 9.12 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 120.697 -1.252 . . . . 76.920000000000002 112.225 179.307 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . 0.644 ' C ' ' O ' ' A' ' 91' ' ' LYS . . . -26.63 75.35 0.0 OUTLIER Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 119.902 -1.142 . . . . 85.519999999999996 110.252 -177.422 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . 0.953 ' N ' ' O ' ' A' ' 91' ' ' LYS . 99.0 m-20 -99.96 -6.2 26.98 Favored 'General case' 0 CA--C 1.472 -2.041 0 N-CA-C 107.265 -1.383 . . . . 92.049999999999997 107.265 -177.151 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' SER . . . . . 0.92 ' OG ' ' N ' ' A' ' 95' ' ' SER . 11.2 t 179.29 -172.65 0.17 Allowed 'General case' 0 N--CA 1.428 -1.57 1 N-CA-C 125.429 5.344 . . . . 94.569999999999993 125.429 -166.832 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 95' ' ' SER . . . . . 0.92 ' N ' ' OG ' ' A' ' 94' ' ' SER . 11.4 p 63.26 62.9 0.95 Allowed 'General case' 0 N--CA 1.425 -1.684 0 CA-C-N 108.981 -3.736 . . . . 96.969999999999999 108.826 -171.007 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ASN . . . . . 0.792 ' OD1' ' O ' ' A' ' 95' ' ' SER . 0.4 OUTLIER -158.83 109.54 2.06 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 105.056 -2.201 . . . . 100.34999999999999 105.056 166.306 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . 0.51 HD23 ' O ' ' A' ' 96' ' ' ASN . 52.1 mt . . . . . 0 C--O 1.237 0.409 0 CA-C-N 115.717 -0.674 . . . . 98.930000000000007 110.275 178.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 200' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . 0.86 ' O ' ' O ' ' A' ' 4' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . 1.106 ' O ' ' HB ' ' A' ' 16' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.645 ' HG2' ' N ' ' A' ' 47' ' ' GLY . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.25 0 N-CA-C 111.783 0.29 . . . . 41.460000000000001 111.783 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -71.17 177.0 4.04 Favored 'General case' 0 C--O 1.21 -0.979 0 C-N-CA 119.035 -1.066 . . . . 29.52 108.977 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.86 ' O ' ' O ' ' A' ' 201' ' ' HOH . 0.1 OUTLIER -132.37 133.53 44.08 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 108.549 -0.908 . . . . 28.440000000000001 108.549 -178.05 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -124.4 153.27 17.59 Favored Glycine 0 C--O 1.189 -2.663 0 N-CA-C 105.093 -3.203 . . . . 28.07 105.093 176.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 39.7 mtp -151.84 148.22 27.57 Favored 'General case' 0 N--CA 1.42 -1.951 0 N-CA-C 108.503 -0.925 . . . . 43.719999999999999 108.503 -175.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.926 HG13 ' HE1' ' A' ' 22' ' ' MET . 0.7 OUTLIER -139.48 137.16 40.63 Favored 'Isoleucine or valine' 0 CA--C 1.475 -1.915 0 N-CA-C 102.471 -3.159 . . . . 32.799999999999997 102.471 -177.903 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.489 ' HB3' ' HB ' ' A' ' 70' ' ' VAL . 12.3 tt0 -116.98 143.64 45.49 Favored 'General case' 0 N--CA 1.429 -1.507 0 N-CA-C 106.496 -1.668 . . . . 52.109999999999999 106.496 173.989 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' THR . . . . . 0.985 HG21 ' HB3' ' A' ' 14' ' ' ALA . 1.0 OUTLIER -136.46 153.78 50.96 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 107.385 -1.339 . . . . 38.32 107.385 178.075 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.652 ' NH1' ' O ' ' A' ' 38' ' ' GLY . 57.5 ttm-85 -103.92 103.19 13.01 Favored 'General case' 0 C--O 1.257 1.467 0 N-CA-C 107.909 -1.145 . . . . 60.909999999999997 107.909 166.46 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.729 ' O ' HG22 ' A' ' 9' ' ' THR . . . 115.57 137.16 6.15 Favored Glycine 0 C--O 1.215 -1.067 0 O-C-N 125.351 1.657 . . . . 37.979999999999997 110.386 -166.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 33.2 tp -83.48 -25.83 30.78 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 113.891 1.071 . . . . 34.460000000000001 113.891 -175.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.484 ' O ' HG22 ' A' ' 16' ' ' ILE . 4.5 m -74.94 -35.65 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.629 0 C-N-CA 116.965 -1.894 . . . . 34.18 109.91 178.121 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.985 ' HB3' HG21 ' A' ' 9' ' ' THR . . . -52.46 -41.7 63.55 Favored 'General case' 0 C--O 1.251 1.132 0 CA-C-N 120.8 1.637 . . . . 31.41 112.237 171.891 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.519 HD22 ' HB2' ' A' ' 41' ' ' CYS . 14.9 tp -73.91 -37.0 64.77 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 113.954 -1.476 . . . . 32.270000000000003 112.224 -171.277 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ILE . . . . . 1.106 ' HB ' ' O ' ' A' ' 204' ' ' HOH . 0.0 OUTLIER -68.62 -37.83 78.17 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.888 0 C-N-CA 119.621 -0.832 . . . . 34.770000000000003 111.227 175.633 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.612 ' OE2' HD13 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -70.5 -46.65 63.29 Favored 'General case' 0 C--O 1.207 -1.134 0 C-N-CA 123.984 0.914 . . . . 52.630000000000003 111.754 177.12 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.76 -49.14 66.09 Favored 'General case' 0 C--O 1.211 -0.94 0 C-N-CA 121.081 -0.248 . . . . 30.920000000000002 110.747 170.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 67.3 m -57.95 -31.75 67.16 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 116.373 1.99 . . . . 31.289999999999999 116.373 176.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.933 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 29.9 t70 -78.07 -30.13 49.53 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 105.549 -2.019 . . . . 35.619999999999997 105.549 -170.64 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.88 -44.33 73.47 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 126.379 2.3 . . . . 34.700000000000003 112.077 177.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' MET . . . . . 0.96 ' HE2' ' HA ' ' A' ' 56' ' ' THR . 18.9 mtt -60.81 -56.18 24.31 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-O 122.995 1.378 . . . . 41.149999999999999 109.221 -177.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -62.7 -29.04 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.913 0 CA-C-N 112.264 -2.244 . . . . 37.93 115.433 -177.529 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.933 ' HG3' ' O ' ' A' ' 20' ' ' ASP . 72.6 mttt -83.2 -16.0 48.27 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 121.298 -0.876 . . . . 36.560000000000002 111.642 176.208 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -103.2 -7.09 21.49 Favored 'General case' 0 C--O 1.272 2.26 0 C-N-CA 118.425 -1.31 . . . . 37.530000000000001 113.699 -167.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -162.79 164.76 26.05 Favored 'General case' 0 N--CA 1.44 -0.974 0 O-C-N 124.845 1.34 . . . . 36.490000000000002 111.389 -174.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -82.83 72.39 9.91 Favored 'General case' 0 C--O 1.198 -1.653 0 N-CA-C 105.592 -2.003 . . . . 61.68 105.592 178.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.6 m -122.39 158.27 26.54 Favored 'Isoleucine or valine' 0 CA--C 1.474 -1.973 0 N-CA-C 106.572 -1.64 . . . . 32.140000000000001 106.572 174.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -118.36 128.0 54.22 Favored 'General case' 0 C--O 1.196 -1.74 0 O-C-N 124.107 0.879 . . . . 37.719999999999999 111.268 -178.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 29.4 tp -75.13 120.3 20.46 Favored 'General case' 0 CA--C 1.471 -2.083 0 N-CA-C 108.79 -0.818 . . . . 31.379999999999999 108.79 174.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 16.2 m -113.27 -24.43 3.86 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.805 0 O-C-N 125.507 1.755 . . . . 32.130000000000003 113.57 -170.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 179.83 178.53 48.52 Favored Glycine 0 C--O 1.195 -2.287 0 C-N-CA 119.128 -1.51 . . . . 33.670000000000002 111.104 172.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.521 HG13 ' O ' ' A' ' 33' ' ' VAL . 14.7 p -155.71 138.95 7.51 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.634 0 N-CA-C 106.807 -1.553 . . . . 38.609999999999999 106.807 -171.53 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.412 ' HZ3' ' HG3' ' A' ' 34' ' ' LYS . 2.2 tptp -142.04 131.88 24.31 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-O 122.472 1.13 . . . . 48.909999999999997 111.048 -172.183 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.449 ' O ' HD13 ' A' ' 36' ' ' ILE . 0.4 OUTLIER -103.84 148.63 25.9 Favored 'General case' 0 N--CA 1.428 -1.568 0 C-N-CA 119.654 -0.818 . . . . 49.969999999999999 110.569 173.489 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.804 ' O ' HG22 ' A' ' 36' ' ' ILE . 22.2 mm -122.79 20.84 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 N-CA-C 115.615 1.709 . . . . 45.539999999999999 115.615 -179.012 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.01 173.62 45.95 Favored Glycine 0 N--CA 1.471 0.973 0 N-CA-C 108.527 -1.829 . . . . 43.210000000000001 108.527 -177.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.652 ' O ' ' NH1' ' A' ' 10' ' ' ARG . . . 72.35 4.07 59.3 Favored Glycine 0 CA--C 1.478 -2.227 0 N-CA-C 108.56 -1.816 . . . . 42.049999999999997 108.56 176.469 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 77.37 17.47 79.26 Favored Glycine 0 C--O 1.214 -1.127 0 CA-C-N 114.392 -0.904 . . . . 41.039999999999999 114.991 -175.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.628 ' CD2' HG21 ' A' ' 70' ' ' VAL . 50.7 mt -90.39 136.46 33.04 Favored 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 107.649 -1.241 . . . . 42.409999999999997 107.649 179.335 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.519 ' HB2' HD22 ' A' ' 15' ' ' LEU . 0.5 OUTLIER -147.42 147.93 30.76 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 122.949 1.357 . . . . 44.530000000000001 114.225 176.394 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' THR . . . . . 1.047 HG22 ' CE ' ' A' ' 44' ' ' MET . 65.6 m -135.96 136.47 40.42 Favored 'General case' 0 C--O 1.179 -2.63 0 CA-C-N 114.409 -1.268 . . . . 29.649999999999999 111.787 -163.961 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -114.01 144.99 42.19 Favored 'General case' 0 N--CA 1.386 -3.656 0 N-CA-C 107.062 -1.458 . . . . 27.98 107.062 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' MET . . . . . 1.047 ' CE ' HG22 ' A' ' 42' ' ' THR . 0.0 OUTLIER -122.03 138.69 54.34 Favored 'General case' 0 C--O 1.245 0.846 0 O-C-N 124.538 1.149 . . . . 42.539999999999999 111.969 175.179 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.3 m -128.81 153.55 38.52 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.866 0 CA-C-N 114.845 -1.07 . . . . 27.039999999999999 110.035 176.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.648 ' HD3' HG22 ' A' ' 88' ' ' ILE . 27.6 mmm-85 -127.63 147.65 50.36 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 108.953 -0.758 . . . . 38.920000000000002 108.953 175.44 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.645 ' N ' ' HG2' ' A' ' 2' ' ' GLU . . . 171.04 -164.92 38.06 Favored Glycine 0 C--O 1.207 -1.585 0 N-CA-C 108.196 -1.961 . . . . 29.469999999999999 108.196 176.675 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.4 ' OD1' ' N ' ' A' ' 48' ' ' ASP . 0.0 OUTLIER -69.19 155.05 41.05 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 106.615 -1.624 . . . . 43.020000000000003 106.615 -178.631 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.622 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 44.7 t -61.39 -33.51 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.688 0 CA-C-O 122.071 0.939 . . . . 33.32 111.803 -171.509 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.52 -45.13 73.07 Favored 'General case' 0 CA--C 1.503 -0.841 0 CA-C-N 113.08 -1.873 . . . . 31.039999999999999 108.248 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.54 -38.78 92.21 Favored 'General case' 0 CA--C 1.478 -1.799 0 CA-C-N 113.965 -1.471 . . . . 30.359999999999999 112.199 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 86.8 m -74.49 -17.47 60.76 Favored 'General case' 0 CA--C 1.472 -2.052 0 C-N-CA 117.026 -1.869 . . . . 30.649999999999999 106.835 -173.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.622 ' HG2' ' O ' ' A' ' 49' ' ' VAL . 8.4 mmmt -82.74 -39.72 21.5 Favored 'General case' 0 C--O 1.176 -2.779 0 N-CA-C 107.784 -1.191 . . . . 43.009999999999998 107.784 179.719 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.49 -55.32 18.52 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 113.815 1.043 . . . . 31.93 113.815 174.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.42 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -37.07 -68.78 0.13 Allowed 'General case' 0 C--O 1.202 -1.413 0 CA-C-N 114.521 -1.218 . . . . 32.590000000000003 113.407 164.326 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' THR . . . . . 0.96 ' HA ' ' HE2' ' A' ' 22' ' ' MET . 37.5 p -71.02 -19.46 62.51 Favored 'General case' 0 N--CA 1.418 -2.069 0 O-C-N 121.002 -1.061 . . . . 35.859999999999999 109.62 -166.146 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -81.82 -33.01 30.99 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 108.713 -0.847 . . . . 58.630000000000003 108.713 179.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.01 -43.85 73.97 Favored 'General case' 0 CA--C 1.497 -1.064 0 N-CA-C 108.654 -0.869 . . . . 36.630000000000003 108.654 174.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -68.31 -34.17 79.54 Favored Glycine 0 C--O 1.22 -0.737 0 N-CA-C 115.48 0.952 . . . . 34.32 115.48 -176.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.783 ' HB2' HG21 ' A' ' 72' ' ' VAL . . . -65.56 -50.25 65.87 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-O 122.309 1.052 . . . . 38.600000000000001 113.577 174.449 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -40.96 -59.12 1.53 Allowed 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.68 -0.638 . . . . 41.920000000000002 112.532 168.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.68 -41.6 87.85 Favored 'General case' 0 C--O 1.206 -1.229 0 N-CA-C 109.25 -0.648 . . . . 46.450000000000003 109.25 -172.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ALA . . . . . 1.15 ' HB3' HD21 ' A' ' 69' ' ' LEU . . . -54.68 -48.72 72.05 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 118.95 -1.1 . . . . 47.530000000000001 108.981 -177.901 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.448 ' HG3' ' CD1' ' A' ' 69' ' ' LEU . 84.9 mt-30 -68.05 -14.93 63.36 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 114.359 1.244 . . . . 54.490000000000002 114.359 -172.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.987 ' HB3' HD12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -82.31 -26.43 33.07 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 108.207 -1.035 . . . . 68.659999999999997 108.207 -178.294 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.987 HD12 ' HB3' ' A' ' 65' ' ' ARG . 3.9 mp -129.28 -1.47 2.94 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.098 0 N-CA-C 115.61 1.707 . . . . 66.040000000000006 115.61 -171.492 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.529 ' HA3' ' HB2' ' A' ' 14' ' ' ALA . . . -144.95 -119.55 1.29 Allowed Glycine 0 N--CA 1.469 0.847 0 N-CA-C 117.309 1.683 . . . . 61.68 117.309 -171.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -162.28 101.3 1.09 Allowed 'General case' 0 CA--C 1.474 -1.966 0 N-CA-C 105.409 -2.071 . . . . 59.869999999999997 105.409 172.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . 1.15 HD21 ' HB3' ' A' ' 63' ' ' ALA . 48.7 mt -63.25 129.17 39.16 Favored 'General case' 0 CA--C 1.493 -1.219 0 N-CA-C 113.366 0.876 . . . . 56.299999999999997 113.366 172.258 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.628 HG21 ' CD2' ' A' ' 40' ' ' LEU . 17.0 t -89.36 -47.68 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.727 0 N-CA-C 107.847 -1.168 . . . . 45.700000000000003 107.847 172.48 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.7 p -165.08 153.56 11.98 Favored 'General case' 0 C--O 1.202 -1.402 0 CA-C-N 120.872 1.669 . . . . 40.93 112.484 176.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.783 HG21 ' HB2' ' A' ' 60' ' ' ALA . 25.4 t -126.08 143.29 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-N 118.844 0.747 . . . . 37.240000000000002 111.426 173.39 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -171.29 146.08 2.27 Favored 'General case' 0 CA--C 1.465 -2.311 0 C-N-CA 116.738 -1.985 . . . . 39.130000000000003 111.034 -175.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.2 t -119.68 135.87 58.61 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.02 0 N-CA-C 103.882 -2.636 . . . . 29.550000000000001 103.882 -178.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.742 ' N ' HD12 ' A' ' 75' ' ' ILE . 1.7 mp -116.08 114.88 41.05 Favored Pre-proline 0 C--O 1.189 -2.101 0 N-CA-C 103.307 -2.849 . . . . 33.920000000000002 103.307 168.992 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -64.59 -34.22 52.98 Favored 'Trans proline' 0 C--O 1.167 -3.045 0 N-CA-C 116.636 1.744 . . . . 31.170000000000002 116.636 -170.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -142.91 69.0 18.76 Favored Pre-proline 0 N--CA 1.496 1.83 0 C-N-CA 128.966 2.906 . . . . 53.539999999999999 114.958 -170.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -65.01 143.93 80.61 Favored 'Trans proline' 0 N--CA 1.418 -2.924 1 C-N-CA 127.403 5.402 . . . . 32.609999999999999 106.409 -169.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.955 ' ND1' ' HB2' ' A' ' 81' ' ' ASP . 53.5 t-80 -68.04 142.32 55.92 Favored 'General case' 0 N--CA 1.424 -1.774 0 O-C-N 124.887 1.367 . . . . 39.399999999999999 107.888 -176.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -58.85 -16.57 31.99 Favored Glycine 0 CA--C 1.509 -0.304 0 C-N-CA 119.287 -1.435 . . . . 36.109999999999999 114.819 177.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.955 ' HB2' ' ND1' ' A' ' 79' ' ' HIS . 4.7 t0 -67.91 -27.13 66.38 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-O 121.857 0.837 . . . . 46.210000000000001 111.399 -179.424 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.7 mp -64.12 -29.12 70.27 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 115.265 1.58 . . . . 41.229999999999997 115.265 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.672 ' OE2' ' N ' ' A' ' 83' ' ' GLU . 8.5 mp0 -75.34 -26.19 58.39 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.032 -1.44 . . . . 51.25 112.455 -177.274 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -65.06 -45.32 85.85 Favored 'General case' 0 CA--C 1.498 -1.053 0 N-CA-C 115.14 1.533 . . . . 43.390000000000001 115.14 170.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.6 t -96.72 -32.49 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 N-CA-C 120.532 3.53 . . . . 43.109999999999999 120.532 -174.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -111.85 149.57 41.01 Favored Pre-proline 0 N--CA 1.489 1.506 0 N-CA-C 116.884 2.179 . . . . 41.439999999999998 116.884 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.872 ' HG3' ' HB3' ' A' ' 95' ' ' SER . 5.8 Cg_exo -66.64 47.84 0.26 Allowed 'Trans proline' 0 C--O 1.206 -1.096 1 C-N-CA 126.094 4.53 . . . . 44.240000000000002 114.288 177.067 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.648 HG22 ' HD3' ' A' ' 46' ' ' ARG 0.55 9.0 mt -121.82 82.03 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.497 -1.06 0 CA-C-O 117.176 -1.392 . . . . 54.460000000000001 112.343 175.648 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -161.97 129.08 2.01 Favored Glycine 0 C--O 1.22 -0.754 0 N-CA-C 110.732 -0.947 . . . . 57.520000000000003 110.732 -164.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -61.23 -3.64 0.94 Allowed 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 114.026 1.121 . . . . 67.019999999999996 114.026 -171.786 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.953 ' O ' ' N ' ' A' ' 93' ' ' ASP . 31.4 mmtt -141.84 115.55 9.12 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 120.697 -1.252 . . . . 76.920000000000002 112.225 179.307 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.644 ' C ' ' O ' ' A' ' 91' ' ' LYS . . . -26.63 75.35 0.0 OUTLIER Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 119.902 -1.142 . . . . 85.519999999999996 110.252 -177.422 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.953 ' N ' ' O ' ' A' ' 91' ' ' LYS . 99.0 m-20 -99.96 -6.2 26.98 Favored 'General case' 0 CA--C 1.472 -2.041 0 N-CA-C 107.265 -1.383 . . . . 92.049999999999997 107.265 -177.151 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' SER . . . . . 0.92 ' OG ' ' N ' ' A' ' 95' ' ' SER . 11.2 t 179.29 -172.65 0.17 Allowed 'General case' 0 N--CA 1.428 -1.57 1 N-CA-C 125.429 5.344 . . . . 94.569999999999993 125.429 -166.832 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' SER . . . . . 0.92 ' N ' ' OG ' ' A' ' 94' ' ' SER . 11.4 p 63.26 62.9 0.95 Allowed 'General case' 0 N--CA 1.425 -1.684 0 CA-C-N 108.981 -3.736 . . . . 96.969999999999999 108.826 -171.007 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.792 ' OD1' ' O ' ' A' ' 95' ' ' SER . 0.4 OUTLIER -158.83 109.54 2.06 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 105.056 -2.201 . . . . 100.34999999999999 105.056 166.306 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.51 HD23 ' O ' ' A' ' 96' ' ' ASN . 52.1 mt . . . . . 0 C--O 1.237 0.409 0 CA-C-N 115.717 -0.674 . . . . 98.930000000000007 110.275 178.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . 0.86 ' O ' ' O ' ' A' ' 4' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . 1.106 ' O ' ' HB ' ' A' ' 16' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_