data_3ax5_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 3ax5 _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 ' 58' ' ' SER . . . . . . . . . . . . . 43.4 m . . . . . 0 N--CA 1.508 2.446 0 N-CA-C 113.286 0.847 . . . . 54.399999999999999 113.286 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 55.7 p30 -100.4 -169.71 1.76 Allowed 'General case' 0 CA--C 1.557 1.238 0 CA-C-N 113.703 -1.589 . . . . 54.539999999999999 109.414 162.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.3 tp -71.01 -35.43 72.05 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.09 0.956 . . . . 49.640000000000001 111.284 -175.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -59.26 -44.0 92.42 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.281 0.845 . . . . 62.170000000000002 113.281 173.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -61.97 -45.22 94.59 Favored 'General case' 0 C--O 1.217 -0.615 0 O-C-N 123.642 0.589 . . . . 45.049999999999997 112.144 -179.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.03 -37.34 64.35 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 107.849 -1.167 . . . . 32.149999999999999 107.849 -177.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -58.33 -45.76 87.48 Favored 'General case' 0 C--O 1.203 -1.393 0 C-N-CA 119.324 -0.95 . . . . 35.93 110.382 -179.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.93 -37.11 85.2 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 119.295 -0.962 . . . . 24.449999999999999 110.93 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 55.0 t -67.71 -45.42 84.69 Favored 'Isoleucine or valine' 0 C--O 1.247 0.945 0 O-C-N 121.356 -0.84 . . . . 23.960000000000001 112.111 177.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -57.03 -41.55 78.82 Favored 'General case' 0 C--O 1.247 0.967 0 CA-C-O 122.422 1.106 . . . . 35.950000000000003 111.756 176.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.0 tttp -68.28 -44.5 75.4 Favored 'General case' 0 C--O 1.263 1.801 0 CA-C-N 114.946 -1.025 . . . . 44.859999999999999 113.286 -177.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -59.86 -46.51 89.07 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-O 121.675 0.75 . . . . 21.469999999999999 109.941 174.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -54.61 -49.63 70.0 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 108.668 -0.864 . . . . 23.030000000000001 108.668 -179.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 46.7 mt -66.76 -42.48 86.07 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 115.999 -0.546 . . . . 31.210000000000001 112.433 -176.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -57.97 -39.57 78.48 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 112.039 0.385 . . . . 49.170000000000002 112.039 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -74.89 -36.12 62.25 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 119.594 -0.842 . . . . 27.0 108.97 -171.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.8 mm -64.73 -47.91 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 O-C-N 124.395 1.059 . . . . 26.25 111.241 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -52.79 -54.08 39.16 Favored 'General case' 0 CA--C 1.558 1.278 0 N-CA-C 114.183 1.179 . . . . 37.32 114.183 171.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.38 -40.71 83.07 Favored 'General case' 0 C--O 1.252 1.217 0 O-C-N 121.159 -0.963 . . . . 36.539999999999999 113.183 174.95 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.21 -50.92 59.18 Favored Glycine 0 C--O 1.25 1.152 0 N-CA-C 108.475 -1.85 . . . . 27.260000000000002 108.475 178.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -65.38 -48.33 73.28 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.028 0.531 . . . . 49.289999999999999 111.763 -175.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -57.23 -53.35 59.13 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.286 1.217 . . . . 45.420000000000002 114.286 174.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.8 mt -53.91 -36.61 62.92 Favored 'General case' 0 C--O 1.252 1.222 0 N-CA-C 114.564 1.32 . . . . 42.659999999999997 114.564 176.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 84.6 mt -75.42 -31.39 60.37 Favored 'General case' 0 C--O 1.243 0.726 0 C-N-CA 119.065 -1.054 . . . . 48.210000000000001 110.49 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.04 -47.61 79.52 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 104.986 -2.227 . . . . 50.909999999999997 104.986 179.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -67.21 3.15 1.28 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 115.469 1.655 . . . . 57.350000000000001 115.469 173.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 68.01 11.66 61.34 Favored Glycine 0 CA--C 1.54 1.6 0 N-CA-C 115.787 1.075 . . . . 50.850000000000001 115.787 -179.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 50.9 t0 -81.01 78.03 7.86 Favored 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 119.587 1.694 . . . . 53.18 107.783 165.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 12.1 m-30 -60.15 -28.69 68.12 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.107 -0.951 . . . . 55.539999999999999 112.945 -175.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -78.43 -49.47 13.42 Favored 'General case' 0 N--CA 1.433 -1.289 0 C-N-CA 119.281 -0.968 . . . . 57.920000000000002 109.986 -172.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 76.6 mttt -70.41 -33.43 71.35 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 113.671 0.989 . . . . 52.469999999999999 113.671 177.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.16 -44.8 97.01 Favored Glycine 0 CA--C 1.544 1.897 0 N-CA-C 110.346 -1.102 . . . . 29.93 110.346 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 54.2 t -64.66 -33.5 63.62 Favored 'Isoleucine or valine' 0 C--O 1.252 1.185 0 C-N-CA 124.67 1.188 . . . . 29.530000000000001 113.173 178.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -63.67 -48.87 75.44 Favored 'General case' 0 C--O 1.186 -2.282 0 O-C-N 123.928 0.767 . . . . 41.009999999999998 109.076 177.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -60.66 -51.08 70.9 Favored 'General case' 0 CA--C 1.572 1.811 0 C-N-CA 123.641 0.776 . . . . 34.469999999999999 112.5 176.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 94.5 mt -53.7 -39.93 65.59 Favored 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 119.11 -0.471 . . . . 22.149999999999999 111.312 173.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 21.9 m -63.02 -43.09 99.67 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-O 121.196 0.522 . . . . 25.02 111.997 179.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -57.04 -42.38 80.4 Favored 'General case' 0 C--O 1.204 -1.314 0 N-CA-C 113.084 0.772 . . . . 21.789999999999999 113.084 171.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.63 -40.09 84.63 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 119.189 0.904 . . . . 15.880000000000001 109.86 179.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 54.9 mt -65.52 -42.07 92.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 N-CA-C 108.317 -0.994 . . . . 20.140000000000001 108.317 179.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -57.36 -28.82 63.5 Favored 'General case' 0 C--O 1.283 2.867 0 N-CA-C 115.433 1.642 . . . . 21.530000000000001 115.433 -178.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . 0.281 27.5 m -90.66 1.55 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.076 0 N-CA-C 115.662 1.727 . . . . 20.469999999999999 115.662 -178.905 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 63.2 m -101.0 130.28 46.96 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 108.643 -0.873 . . . . 27.760000000000002 108.643 179.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -69.25 -27.41 73.72 Favored Glycine 0 N--CA 1.438 -1.17 0 C-N-CA 118.915 -1.612 . . . . 26.09 113.256 177.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -135.27 82.66 40.56 Favored Pre-proline 0 C--O 1.242 0.68 0 N-CA-C 108.4 -0.963 . . . . 48.380000000000003 108.4 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -80.04 8.95 3.79 Favored 'Trans proline' 0 CA--C 1.554 1.489 0 N-CA-C 114.915 1.083 . . . . 27.469999999999999 114.915 -173.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -58.75 -46.3 87.75 Favored 'General case' 0 N--CA 1.514 2.753 0 CA-C-N 119.527 1.058 . . . . 41.270000000000003 112.721 -171.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -66.8 -39.51 87.78 Favored 'General case' 0 C--O 1.253 1.282 0 N-CA-C 113.797 1.036 . . . . 50.729999999999997 113.797 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 24.6 tp -63.77 -38.89 92.79 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 107.447 -1.316 . . . . 26.050000000000001 107.447 178.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 48.6 mt -69.26 -41.09 77.36 Favored 'General case' 0 C--O 1.249 1.072 0 CA-C-O 121.822 0.82 . . . . 21.52 113.085 -178.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.99 -40.7 90.06 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.845 -0.616 . . . . 46.899999999999999 112.441 172.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 51.5 t -64.9 -49.69 78.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 122.408 1.099 . . . . 24.16 109.256 176.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 95.5 mt -57.15 -37.47 72.11 Favored 'General case' 0 C--N 1.312 -1.042 0 O-C-N 120.032 -1.667 . . . . 22.18 114.423 174.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 21.2 tm0? -62.97 -29.46 70.83 Favored 'General case' 0 CA--C 1.561 1.373 0 O-C-N 120.426 -1.421 . . . . 30.899999999999999 109.866 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 70.5 mm-40 -82.78 -11.32 58.37 Favored 'General case' 0 C--O 1.214 -0.789 0 CA-C-O 121.824 0.821 . . . . 29.149999999999999 112.254 -176.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' THR . . . . . 0.528 ' CG2' ' O ' ' A' ' 19' ' ' HOH . 0.9 OUTLIER -114.12 -23.58 9.43 Favored 'General case' 0 C--O 1.205 -1.246 0 C-N-CA 125.686 1.595 . . . . 33.68 110.266 -165.398 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 68.3 mt -108.02 154.78 40.95 Favored Pre-proline 0 CA--C 1.493 -1.25 0 O-C-N 120.885 -1.134 . . . . 24.77 110.783 -174.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -65.08 144.1 80.77 Favored 'Trans proline' 0 N--CA 1.502 2.02 0 C-N-CA 116.963 -1.558 . . . . 24.489999999999998 111.407 168.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -47.66 -47.66 17.71 Favored 'Trans proline' 0 CA--C 1.503 -1.073 0 N-CA-C 116.694 1.767 . . . . 26.280000000000001 116.694 -177.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -66.64 -30.08 42.78 Favored 'Trans proline' 0 N--CA 1.5 1.905 0 C-N-CA 115.509 -2.528 . . . . 28.969999999999999 110.644 -177.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 42.8 t -67.89 -40.63 83.84 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 N-CA-C 111.905 0.335 . . . . 25.690000000000001 111.905 177.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -65.17 -44.12 89.52 Favored 'General case' 0 N--CA 1.425 -1.701 0 N-CA-C 111.757 0.28 . . . . 25.399999999999999 111.757 175.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -58.89 -40.67 85.16 Favored 'General case' 0 CA--C 1.495 -1.172 0 CA-C-O 122.626 1.203 . . . . 34.649999999999999 112.497 171.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 2.9 ttm -59.08 -44.06 91.85 Favored 'General case' 0 N--CA 1.422 -1.852 0 CA-C-N 113.372 -1.74 . . . . 49.609999999999999 107.087 -175.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' LEU . . . . . 0.469 ' C ' ' CD2' ' A' ' 122' ' ' LEU . 5.2 tt -59.47 -40.39 86.79 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-O 118.742 -0.647 . . . . 27.890000000000001 110.081 -177.116 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 58.0 mt -60.91 -31.52 71.03 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 115.466 1.654 . . . . 25.52 115.466 174.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 46.8 p -72.01 -27.57 62.82 Favored 'General case' 0 CA--C 1.554 1.103 0 CA-C-N 118.602 0.637 . . . . 30.640000000000001 109.491 -176.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 45.7 mttm -85.98 1.8 48.77 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.995 -0.548 . . . . 46.700000000000003 111.723 -178.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.7 mp . . . . . 0 N--CA 1.511 2.612 0 N-CA-C 120.703 3.594 . . . . 46.619999999999997 120.703 -169.139 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.511 3.652 0 CA-C-O 119.651 -0.527 . . . . 43.530000000000001 113.016 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' DCY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ARG . . . . . 0.438 ' NH1' ' CG ' ' B' ' 14' ' ' ARG . 0.0 OUTLIER -55.65 -37.24 67.98 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.241 0.83 . . . . 59.710000000000001 113.241 -177.94 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.7 tp -58.31 -46.83 85.4 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 113.333 0.864 . . . . 35.869999999999997 113.333 172.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 62.9 m -57.27 -39.96 76.76 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.174 0.897 . . . . 42.780000000000001 113.385 176.43 -56.902 nan nan nan nan nan nan nan 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ARG . . . . . . . . . . . . . 1.6 tpp180 -67.36 -48.12 68.4 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 126.975 2.11 . . . . 59.369999999999997 106.264 -175.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 43.9 tp -59.68 -41.93 91.8 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 114.03 -1.441 . . . . 37.060000000000002 112.069 177.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 91.0 mt -63.06 -40.44 97.69 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 113.421 0.897 . . . . 33.829999999999998 113.421 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.7 m -62.36 -37.9 87.46 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 114.819 1.415 . . . . 39.219999999999999 114.819 178.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.34 108.56 0.72 Allowed 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 115.614 -0.721 . . . . 39.369999999999997 111.98 -174.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.277 2.517 0 N-CA-C 116.789 2.144 . . . . 46.799999999999997 116.789 -167.668 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' GLY . . . . . 0.464 ' O ' ' N ' ' C' ' 58' ' ' SER . . . . . . . . 0 C--O 1.197 -2.187 0 CA-C-O 118.012 -1.438 . . . . 31.93 113.769 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.48 -47.37 3.09 Favored 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 114.683 -3.078 . . . . 32.149999999999999 115.878 -158.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' LEU . . . . . . . . . . . . . 65.1 tp -68.58 -48.53 63.98 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 107.897 -1.149 . . . . 32.600000000000001 107.897 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' GLY . . . . . . . . . . . . . . . -54.49 -41.43 72.75 Favored Glycine 0 CA--C 1.552 2.397 0 C-N-CA 119.369 -1.396 . . . . 24.52 112.224 178.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' SER . . . . . 0.464 ' N ' ' O ' ' C' ' 54' ' ' GLY 0.286 0.3 OUTLIER -71.63 -28.5 63.82 Favored 'General case' 0 CA--C 1.502 -0.9 0 C-N-CA 116.352 -2.139 . . . . 29.940000000000001 112.435 179.527 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -72.21 -34.76 68.6 Favored 'General case' 0 CA--C 1.509 -0.609 0 C-N-CA 118.504 -1.278 . . . . 40.619999999999997 109.051 -176.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' LEU . . . . . . . . . . . . . 14.7 mt -69.76 -37.56 76.46 Favored 'General case' 0 C--O 1.191 -1.995 0 O-C-N 123.641 0.588 . . . . 29.120000000000001 112.128 177.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? -62.74 -43.67 98.19 Favored 'General case' 0 C--O 1.209 -1.031 0 N-CA-C 113.704 1.001 . . . . 54.549999999999997 113.704 173.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -51.53 -50.73 59.43 Favored 'General case' 0 C--O 1.185 -2.322 0 C-N-CA 123.485 0.714 . . . . 29.390000000000001 110.804 168.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.06 -37.2 78.38 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 108.177 -1.046 . . . . 22.059999999999999 108.177 -169.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' GLU . . . . . . . . . . . . . 66.4 tt0 -72.08 -41.04 67.81 Favored 'General case' 0 C--O 1.269 2.125 0 N-CA-C 113.185 0.809 . . . . 40.189999999999998 113.185 176.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.99 -42.38 76.27 Favored 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 119.419 -0.912 . . . . 20.91 112.607 171.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' VAL . . . . . . . . . . . . . 23.0 t -69.34 -45.68 78.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 O-C-N 121.113 -0.992 . . . . 22.27 110.548 -176.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 67' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -58.26 -42.06 85.63 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 115.208 1.559 . . . . 31.77 115.208 174.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 68' ' ' LYS . . . . . . . . . . . . . 18.9 tttt -68.53 -43.68 76.19 Favored 'General case' 0 N--CA 1.41 -2.467 0 CA-C-N 114.471 -1.24 . . . . 36.18 108.978 -179.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 69' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -62.55 -49.86 73.61 Favored 'General case' 0 CA--C 1.503 -0.839 0 N-CA-C 108.467 -0.938 . . . . 21.449999999999999 108.467 177.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 70' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -54.09 -51.83 62.9 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 118.846 -1.141 . . . . 29.649999999999999 112.327 178.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.67 -40.43 92.41 Favored 'General case' 0 C--N 1.316 -0.89 0 O-C-N 120.336 -1.477 . . . . 26.25 111.781 -177.277 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 72' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -64.24 -38.5 91.29 Favored 'General case' 0 C--O 1.18 -2.597 0 C-N-CA 119.267 -0.973 . . . . 34.25 112.64 175.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 73' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -65.34 -34.27 77.94 Favored 'General case' 0 CA--C 1.556 1.183 0 CA-C-N 119.886 1.221 . . . . 36.600000000000001 111.433 -179.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 74' ' ' ILE . . . . . . . . . . . . . 4.7 mt -70.51 -49.62 51.46 Favored 'Isoleucine or valine' 0 C--O 1.251 1.156 0 N-CA-C 107.958 -1.127 . . . . 27.23 107.958 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 75' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -57.07 -51.79 67.87 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 123.882 0.739 . . . . 38.299999999999997 112.78 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 76' ' ' LEU . . . . . . . . . . . . . 9.8 tp -65.23 -39.21 92.44 Favored 'General case' 0 CA--C 1.57 1.73 0 N-CA-C 112.809 0.67 . . . . 32.520000000000003 112.809 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.91 -46.96 92.85 Favored Glycine 0 N--CA 1.476 1.361 0 N-CA-C 109.243 -1.543 . . . . 31.109999999999999 109.243 173.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 78' ' ' GLU . . . . . . . . . . . . 0.317 22.2 pt-20 -67.29 -34.95 78.46 Favored 'General case' 0 C--O 1.217 -0.628 0 N-CA-C 114.658 1.355 . . . . 51.729999999999997 114.658 177.534 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 79' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -62.22 -40.87 97.55 Favored 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 119.483 1.038 . . . . 33.890000000000001 111.946 172.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 80' ' ' LEU . . . . . . . . . . . . . 45.9 mt -70.29 -41.88 72.8 Favored 'General case' 0 N--CA 1.44 -0.944 0 O-C-N 123.207 0.317 . . . . 37.969999999999999 110.707 -177.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 81' ' ' LEU . . . . . . . . . . . . . 78.1 mt -56.36 -52.49 64.38 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-O 118.137 -0.935 . . . . 42.759999999999998 112.893 173.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -52.83 -14.96 0.63 Allowed 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.472 1.286 . . . . 46.549999999999997 114.472 177.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 83' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -120.66 11.25 11.21 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 113.684 0.994 . . . . 51.539999999999999 113.684 -179.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.55 -12.96 61.42 Favored Glycine 0 C--O 1.243 0.667 0 N-CA-C 120.88 3.112 . . . . 54.810000000000002 120.88 172.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 85' ' ' ASP . . . . . 0.498 ' N ' ' OD1' ' C' ' 85' ' ' ASP . 0.0 OUTLIER -87.1 79.53 8.63 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 120.334 2.067 . . . . 65.489999999999995 107.896 -177.645 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 86' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -55.15 -36.23 65.58 Favored 'General case' 0 N--CA 1.426 -1.637 0 O-C-N 124.497 1.123 . . . . 73.489999999999995 112.292 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 87' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -56.99 -66.07 0.51 Allowed 'General case' 0 C--O 1.246 0.909 0 C-N-CA 124.82 1.248 . . . . 71.049999999999997 110.544 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 88' ' ' LYS . . . . . . . . . . . . . 2.9 mtpt -65.53 -39.64 92.0 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-N 115.048 -0.978 . . . . 62.979999999999997 113.151 -176.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 89' ' ' GLY . . . . . . . . . . . . . . . -59.47 -43.88 97.14 Favored Glycine 0 C--N 1.333 0.41 0 N-CA-C 115.179 0.832 . . . . 43.259999999999998 115.179 178.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 90' ' ' VAL . . . . . . . . . . . . . 50.1 t -69.76 -38.54 76.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.23 -0.656 . . . . 38.530000000000001 109.23 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 91' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -47.55 -54.83 10.59 Favored 'General case' 0 C--O 1.212 -0.885 0 CA-C-O 121.619 0.723 . . . . 49.310000000000002 111.475 170.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 92' ' ' HIS . . . . . . . . . . . . . 86.3 m-70 -58.29 -46.36 86.24 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.062 0.764 . . . . 35.140000000000001 113.062 178.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 93' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.82 -39.37 94.08 Favored 'General case' 0 C--O 1.204 -1.341 0 O-C-N 123.501 0.501 . . . . 35.509999999999998 112.039 179.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 94' ' ' THR . . . . . . . . . . . . . 1.8 m -53.08 -42.19 65.64 Favored 'General case' 0 C--O 1.258 1.504 0 C-N-CA 124.716 1.207 . . . . 39.0 112.262 169.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 95' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -64.44 -38.09 89.81 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.288 -0.883 . . . . 26.140000000000001 110.991 174.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.46 -43.67 76.52 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 118.831 -1.148 . . . . 25.93 109.573 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 97' ' ' ILE . . . . . . . . . . . . . 3.4 mt -64.48 -38.82 83.58 Favored 'Isoleucine or valine' 0 C--O 1.24 0.554 0 C-N-CA 117.268 -1.773 . . . . 29.670000000000002 110.176 179.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.01 -23.53 66.49 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 114.455 1.28 . . . . 31.23 114.455 -178.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 99' ' ' VAL . . . . . . . . . . . . 0.289 33.6 m -87.87 -3.09 9.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 115.653 1.723 . . . . 28.850000000000001 115.653 172.239 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 100' ' ' CYS . . . . . . . . . . . . . 22.7 t -89.07 138.13 31.69 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 118.447 -1.301 . . . . 42.729999999999997 113.233 -176.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' GLY . . . . . . . . . . . . . . . -66.56 -38.84 93.67 Favored Glycine 0 C--O 1.271 2.46 0 N-CA-C 115.748 1.059 . . . . 42.740000000000002 115.748 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -117.84 80.07 13.97 Favored Pre-proline 0 C--O 1.212 -0.884 0 N-CA-C 108.183 -1.043 . . . . 60.799999999999997 108.183 -179.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -71.36 -22.45 25.16 Favored 'Trans proline' 0 C--O 1.251 1.137 0 C-N-CA 122.842 2.361 . . . . 49.75 116.813 -172.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' GLN . . . . . . . . . . . . . 21.0 mm100 -72.65 -46.79 52.17 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 124.292 0.995 . . . . 64.719999999999999 110.474 173.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 105' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -54.99 -27.44 44.14 Favored 'General case' 0 CA--C 1.559 1.321 0 N-CA-C 112.564 0.579 . . . . 66.879999999999995 112.564 174.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 106' ' ' LEU . . . . . . . . . . . . . 7.3 tp -92.43 -38.03 12.22 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.644 1.178 . . . . 60.399999999999999 111.78 -177.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 107' ' ' LEU . . . . . . . . . . . . . 36.7 mt -61.81 -14.82 36.51 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-O 120.84 0.352 . . . . 65.079999999999998 111.707 172.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.45 -49.17 76.49 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 126.515 1.926 . . . . 71.620000000000005 110.901 175.748 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 109' ' ' VAL . . . . . . . . . . . . . 58.3 t -72.39 -36.16 54.09 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 O-C-N 124.672 1.232 . . . . 68.969999999999999 110.012 -178.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 110' ' ' LEU . . . . . . . . . . . . . 12.6 mt -78.88 -27.36 44.0 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.167 1.173 . . . . 70.810000000000002 114.167 -178.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 111' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -61.8 -43.74 98.25 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 121.672 0.748 . . . . 72.159999999999997 109.418 170.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 112' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -92.99 47.48 1.28 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.361 1.464 . . . . 75.060000000000002 107.807 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 113' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -163.95 -30.5 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 114.832 1.419 . . . . 69.079999999999998 114.832 175.997 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 114' ' ' LEU . . . . . . . . . . . . . 61.7 mt -97.95 157.98 33.64 Favored Pre-proline 0 CA--C 1.511 -0.545 0 O-C-N 121.499 -0.751 . . . . 66.680000000000007 111.661 -174.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 115' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -58.8 147.3 89.2 Favored 'Trans proline' 0 C--N 1.355 0.887 0 N-CA-C 107.807 -1.651 . . . . 65.890000000000001 107.807 165.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 116' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_exo -54.7 -43.19 61.43 Favored 'Trans proline' 0 CA--C 1.557 1.651 0 C-N-CA 117.301 -1.333 . . . . 66.439999999999998 115.46 173.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 117' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.43 -43.81 55.28 Favored 'Trans proline' 0 C--N 1.365 1.442 0 N-CA-C 115.149 1.173 . . . . 64.090000000000003 115.149 -176.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 118' ' ' VAL . . . . . . . . . . . . . 5.0 m -82.41 -37.53 14.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 O-C-N 123.905 0.753 . . . . 61.579999999999998 111.403 -177.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 119' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -54.66 -33.43 60.72 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.245 0.545 . . . . 61.280000000000001 109.873 171.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 120' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -75.17 -39.08 60.59 Favored 'General case' 0 C--O 1.249 1.04 0 CA-C-N 114.303 -1.317 . . . . 61.399999999999999 110.617 175.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 121' ' ' MET . . . . . . . . . . . . . 5.5 ttm -58.46 -50.0 75.31 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.307 0.575 . . . . 75.890000000000001 110.162 172.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 122' ' ' LEU . . . . . . . . . . . . . 56.0 tp -51.65 -42.94 62.45 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.924 1.453 . . . . 63.549999999999997 114.924 172.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 123' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.52 -27.39 69.23 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 113.735 1.013 . . . . 66.349999999999994 113.735 -178.731 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 124' ' ' THR . . . . . . . . . . . . . 82.6 m -56.42 -30.46 62.83 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 115.253 1.575 . . . . 69.700000000000003 115.253 172.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 125' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.473 0.678 0 N-CA-C 113.801 1.037 . . . . 75.079999999999998 113.801 -169.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' GLY . . . . . 0.704 ' O ' ' CB ' ' D' ' 13' ' ' DCY . . . . . . . . 0 N--CA 1.508 3.446 0 N-CA-C 114.163 0.425 . . . . 65.230000000000004 114.163 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' DCY . . . . . 0.704 ' CB ' ' O ' ' D' ' 12' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -70.58 -36.91 73.84 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 119.239 0.927 . . . . 59.200000000000003 111.248 176.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' LEU . . . . . . . . . . . . . 87.7 mt -74.16 -19.87 60.41 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 123.382 0.426 . . . . 53.939999999999998 112.078 -176.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' CYS . . . . . . . . . . . . . 95.0 m -67.18 -54.84 17.46 Favored 'General case' 0 C--O 1.25 1.125 0 N-CA-C 115.321 1.601 . . . . 63.57 115.321 167.645 -65.154 nan nan nan nan nan nan nan 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' ARG . . . . . . . . . . . . . 3.6 mtt85 -53.73 -49.57 67.85 Favored 'General case' 0 C--O 1.27 2.175 0 CA-C-O 122.645 1.212 . . . . 64.310000000000002 108.866 175.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' LEU . . . . . . . . . . . . . 15.0 tp -52.2 -47.37 65.63 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-N 113.963 -1.471 . . . . 51.920000000000002 111.762 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' LEU . . . . . . . . . . . . . 26.8 tp -61.75 -38.12 86.79 Favored 'General case' 0 CA--C 1.558 1.254 0 N-CA-C 113.743 1.016 . . . . 52.060000000000002 113.743 -177.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' SER . . . . . . . . . . . . . 53.7 p -69.37 -43.6 73.24 Favored 'General case' 0 C--O 1.242 0.708 0 N-CA-C 108.599 -0.889 . . . . 57.119999999999997 108.599 178.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -53.11 -40.93 64.51 Favored 'General case' 0 C--O 1.246 0.9 0 C-N-CA 120.257 -0.577 . . . . 56.920000000000002 110.761 176.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.522 0 N-CA-C 114.582 1.327 . . . . 58.990000000000002 114.582 -171.196 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' HOH . . . . . 0.528 ' O ' ' CG2' ' A' ' 113' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 43.4 m . . . . . 0 N--CA 1.508 2.446 0 N-CA-C 113.286 0.847 . . . . 54.4 113.286 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 55.7 p30 -100.4 -169.71 1.76 Allowed 'General case' 0 CA--C 1.557 1.238 0 CA-C-N 113.703 -1.589 . . . . 54.54 109.414 162.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.3 tp -71.01 -35.43 72.05 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.09 0.956 . . . . 49.64 111.284 -175.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -59.26 -44.0 92.42 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.281 0.845 . . . . 62.17 113.281 173.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -61.97 -45.22 94.59 Favored 'General case' 0 C--O 1.217 -0.615 0 O-C-N 123.642 0.589 . . . . 45.05 112.144 -179.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.03 -37.34 64.35 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 107.849 -1.167 . . . . 32.15 107.849 -177.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -58.33 -45.76 87.48 Favored 'General case' 0 C--O 1.203 -1.393 0 C-N-CA 119.324 -0.95 . . . . 35.93 110.382 -179.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.93 -37.11 85.2 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 119.295 -0.962 . . . . 24.45 110.93 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 55.0 t -67.71 -45.42 84.69 Favored 'Isoleucine or valine' 0 C--O 1.247 0.945 0 O-C-N 121.356 -0.84 . . . . 23.96 112.111 177.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 -57.03 -41.55 78.82 Favored 'General case' 0 C--O 1.247 0.967 0 CA-C-O 122.422 1.106 . . . . 35.95 111.756 176.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.0 tttp -68.28 -44.5 75.4 Favored 'General case' 0 C--O 1.263 1.801 0 CA-C-N 114.946 -1.025 . . . . 44.86 113.286 -177.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -59.86 -46.51 89.07 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-O 121.675 0.75 . . . . 21.47 109.941 174.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -54.61 -49.63 70.0 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 108.668 -0.864 . . . . 23.03 108.668 -179.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 46.7 mt -66.76 -42.48 86.07 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 115.999 -0.546 . . . . 31.21 112.433 -176.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -57.97 -39.57 78.48 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 112.039 0.385 . . . . 49.17 112.039 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -74.89 -36.12 62.25 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 119.594 -0.842 . . . . 27.0 108.97 -171.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.8 mm -64.73 -47.91 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 O-C-N 124.395 1.059 . . . . 26.25 111.241 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLN . . . . . 0.478 ' HG3' ' HB3' ' B' ' 13' ' ' DCY . 5.1 tt0 -52.79 -54.08 39.16 Favored 'General case' 0 CA--C 1.558 1.278 0 N-CA-C 114.183 1.179 . . . . 37.32 114.183 171.633 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.38 -40.71 83.07 Favored 'General case' 0 C--O 1.252 1.217 0 O-C-N 121.159 -0.963 . . . . 36.54 113.183 174.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.21 -50.92 59.18 Favored Glycine 0 C--O 1.25 1.152 0 N-CA-C 108.475 -1.85 . . . . 27.26 108.475 178.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLU . . . . . 0.425 ' OE2' ' HD3' ' B' ' 14' ' ' ARG . 45.2 tt0 -65.38 -48.33 73.28 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.028 0.531 . . . . 49.29 111.763 -175.277 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -57.23 -53.35 59.13 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.286 1.217 . . . . 45.42 114.286 174.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.8 mt -53.91 -36.61 62.92 Favored 'General case' 0 C--O 1.252 1.222 0 N-CA-C 114.564 1.32 . . . . 42.66 114.564 176.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 84.6 mt -75.42 -31.39 60.37 Favored 'General case' 0 C--O 1.243 0.726 0 C-N-CA 119.065 -1.054 . . . . 48.21 110.49 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.04 -47.61 79.52 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 104.986 -2.227 . . . . 50.91 104.986 179.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -67.21 3.15 1.28 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 115.469 1.655 . . . . 57.35 115.469 173.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 68.01 11.66 61.34 Favored Glycine 0 CA--C 1.54 1.6 0 N-CA-C 115.787 1.075 . . . . 50.85 115.787 -179.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASP . . . . . 0.477 ' OD1' ' HD2' ' A' ' 88' ' ' LYS . 50.9 t0 -81.01 78.03 7.86 Favored 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 119.587 1.694 . . . . 53.18 107.783 165.577 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 12.1 m-30 -60.15 -28.69 68.12 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.107 -0.951 . . . . 55.54 112.945 -175.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -78.43 -49.47 13.42 Favored 'General case' 0 N--CA 1.433 -1.289 0 C-N-CA 119.281 -0.968 . . . . 57.92 109.986 -172.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LYS . . . . . 0.477 ' HD2' ' OD1' ' A' ' 85' ' ' ASP . 76.6 mttt -70.41 -33.43 71.35 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 113.671 0.989 . . . . 52.47 113.671 177.005 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.16 -44.8 97.01 Favored Glycine 0 CA--C 1.544 1.897 0 N-CA-C 110.346 -1.102 . . . . 29.93 110.346 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 54.2 t -64.66 -33.5 63.62 Favored 'Isoleucine or valine' 0 C--O 1.252 1.185 0 C-N-CA 124.67 1.188 . . . . 29.53 113.173 178.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -63.67 -48.87 75.44 Favored 'General case' 0 C--O 1.186 -2.282 0 O-C-N 123.928 0.767 . . . . 41.01 109.076 177.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -60.66 -51.08 70.9 Favored 'General case' 0 CA--C 1.572 1.811 0 C-N-CA 123.641 0.776 . . . . 34.47 112.5 176.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 94.5 mt -53.7 -39.93 65.59 Favored 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 119.11 -0.471 . . . . 22.15 111.312 173.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 21.9 m -63.02 -43.09 99.67 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-O 121.196 0.522 . . . . 25.02 111.997 179.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -57.04 -42.38 80.4 Favored 'General case' 0 C--O 1.204 -1.314 0 N-CA-C 113.084 0.772 . . . . 21.79 113.084 171.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.63 -40.09 84.63 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 119.189 0.904 . . . . 15.88 109.86 179.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 54.9 mt -65.52 -42.07 92.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 N-CA-C 108.317 -0.994 . . . . 20.14 108.317 179.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -57.36 -28.82 63.5 Favored 'General case' 0 C--O 1.283 2.867 0 N-CA-C 115.433 1.642 . . . . 21.53 115.433 -178.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . 0.281 27.5 m -90.66 1.55 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.076 0 N-CA-C 115.662 1.727 . . . . 20.47 115.662 -178.905 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 63.2 m -101.0 130.28 46.96 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 108.643 -0.873 . . . . 27.76 108.643 179.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -69.25 -27.41 73.72 Favored Glycine 0 N--CA 1.438 -1.17 0 C-N-CA 118.915 -1.612 . . . . 26.09 113.256 177.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLN . . . . . 0.411 ' OE1' ' HB3' ' C' ' 58' ' ' SER . 79.9 mt-30 -135.27 82.66 40.56 Favored Pre-proline 0 C--O 1.242 0.68 0 N-CA-C 108.4 -0.963 . . . . 48.38 108.4 -178.608 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -80.04 8.95 3.79 Favored 'Trans proline' 0 CA--C 1.554 1.489 0 N-CA-C 114.915 1.083 . . . . 27.47 114.915 -173.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -58.75 -46.3 87.75 Favored 'General case' 0 N--CA 1.514 2.753 0 CA-C-N 119.527 1.058 . . . . 41.27 112.721 -171.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -66.8 -39.51 87.78 Favored 'General case' 0 C--O 1.253 1.282 0 N-CA-C 113.797 1.036 . . . . 50.73 113.797 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 24.6 tp -63.77 -38.89 92.79 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 107.447 -1.316 . . . . 26.05 107.447 178.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 48.6 mt -69.26 -41.09 77.36 Favored 'General case' 0 C--O 1.249 1.072 0 CA-C-O 121.822 0.82 . . . . 21.52 113.085 -178.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.99 -40.7 90.06 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.845 -0.616 . . . . 46.9 112.441 172.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 51.5 t -64.9 -49.69 78.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 122.408 1.099 . . . . 24.16 109.256 176.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 95.5 mt -57.15 -37.47 72.11 Favored 'General case' 0 C--N 1.312 -1.042 0 O-C-N 120.032 -1.667 . . . . 22.18 114.423 174.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 21.2 tm0? -62.97 -29.46 70.83 Favored 'General case' 0 CA--C 1.561 1.373 0 O-C-N 120.426 -1.421 . . . . 30.9 109.866 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 70.5 mm-40 -82.78 -11.32 58.37 Favored 'General case' 0 C--O 1.214 -0.789 0 CA-C-O 121.824 0.821 . . . . 29.15 112.254 -176.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' THR . . . . . 0.528 ' CG2' ' O ' ' A' ' 19' ' ' HOH . 0.9 OUTLIER -114.12 -23.58 9.43 Favored 'General case' 0 C--O 1.205 -1.246 0 C-N-CA 125.686 1.595 . . . . 33.68 110.266 -165.398 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 68.3 mt -108.02 154.78 40.95 Favored Pre-proline 0 CA--C 1.493 -1.25 0 O-C-N 120.885 -1.134 . . . . 24.77 110.783 -174.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -65.08 144.1 80.77 Favored 'Trans proline' 0 N--CA 1.502 2.02 0 C-N-CA 116.963 -1.558 . . . . 24.49 111.407 168.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -47.66 -47.66 17.71 Favored 'Trans proline' 0 CA--C 1.503 -1.073 0 N-CA-C 116.694 1.767 . . . . 26.28 116.694 -177.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -66.64 -30.08 42.78 Favored 'Trans proline' 0 N--CA 1.5 1.905 0 C-N-CA 115.509 -2.528 . . . . 28.97 110.644 -177.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 42.8 t -67.89 -40.63 83.84 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 N-CA-C 111.905 0.335 . . . . 25.69 111.905 177.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -65.17 -44.12 89.52 Favored 'General case' 0 N--CA 1.425 -1.701 0 N-CA-C 111.757 0.28 . . . . 25.4 111.757 175.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -58.89 -40.67 85.16 Favored 'General case' 0 CA--C 1.495 -1.172 0 CA-C-O 122.626 1.203 . . . . 34.65 112.497 171.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 2.9 ttm -59.08 -44.06 91.85 Favored 'General case' 0 N--CA 1.422 -1.852 0 CA-C-N 113.372 -1.74 . . . . 49.61 107.087 -175.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' LEU . . . . . 0.749 ' C ' HD23 ' A' ' 122' ' ' LEU . 5.2 tt -59.47 -40.39 86.79 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-O 118.742 -0.647 . . . . 27.89 110.081 -177.116 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 58.0 mt -60.91 -31.52 71.03 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 115.466 1.654 . . . . 25.52 115.466 174.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 46.8 p -72.01 -27.57 62.82 Favored 'General case' 0 CA--C 1.554 1.103 0 CA-C-N 118.602 0.637 . . . . 30.64 109.491 -176.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LYS . . . . . 0.623 ' O ' ' HB2' ' A' ' 126' ' ' LEU . 45.7 mttm -85.98 1.8 48.77 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.995 -0.548 . . . . 46.7 111.723 -178.993 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' LEU . . . . . 0.623 ' HB2' ' O ' ' A' ' 125' ' ' LYS . 2.7 mp . . . . . 0 N--CA 1.511 2.612 0 N-CA-C 120.703 3.594 . . . . 46.62 120.703 -169.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.511 3.652 0 CA-C-O 119.651 -0.527 . . . . 43.53 113.016 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 13' ' ' DCY . . . . . 0.478 ' HB3' ' HG3' ' A' ' 75' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ARG . . . . . 0.786 HH11 ' HG3' ' B' ' 14' ' ' ARG . 0.0 OUTLIER -55.65 -37.24 67.98 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.241 0.83 . . . . 59.71 113.241 -177.94 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.7 tp -58.31 -46.83 85.4 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 113.333 0.864 . . . . 35.87 113.333 172.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 62.9 m -57.27 -39.96 76.76 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.174 0.897 . . . . 42.78 113.385 176.43 -56.902 nan nan nan nan nan nan nan 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ARG . . . . . . . . . . . . . 1.6 tpp180 -67.36 -48.12 68.4 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 126.975 2.11 . . . . 59.37 106.264 -175.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 43.9 tp -59.68 -41.93 91.8 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 114.03 -1.441 . . . . 37.06 112.069 177.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 91.0 mt -63.06 -40.44 97.69 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 113.421 0.897 . . . . 33.83 113.421 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.7 m -62.36 -37.9 87.46 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 114.819 1.415 . . . . 39.22 114.819 178.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.34 108.56 0.72 Allowed 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 115.614 -0.721 . . . . 39.37 111.98 -174.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.277 2.517 0 N-CA-C 116.789 2.144 . . . . 46.8 116.789 -167.668 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.197 -2.187 0 CA-C-O 118.012 -1.438 . . . . 31.93 113.769 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 55' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.48 -47.37 3.09 Favored 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 114.683 -3.078 . . . . 32.15 115.878 -158.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 56' ' ' LEU . . . . . . . . . . . . . 65.1 tp -68.58 -48.53 63.98 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 107.897 -1.149 . . . . 32.6 107.897 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 57' ' ' GLY . . . . . . . . . . . . . . . -54.49 -41.43 72.75 Favored Glycine 0 CA--C 1.552 2.397 0 C-N-CA 119.369 -1.396 . . . . 24.52 112.224 178.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 58' ' ' SER . . . . . 1.009 ' HA ' ' HZ2' ' C' ' 61' ' ' LYS 0.286 0.3 OUTLIER -71.63 -28.5 63.82 Favored 'General case' 0 CA--C 1.502 -0.9 0 C-N-CA 116.352 -2.139 . . . . 29.94 112.435 179.527 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' C' C ' 59' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -72.21 -34.76 68.6 Favored 'General case' 0 CA--C 1.509 -0.609 0 C-N-CA 118.504 -1.278 . . . . 40.62 109.051 -176.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 60' ' ' LEU . . . . . . . . . . . . . 14.7 mt -69.76 -37.56 76.46 Favored 'General case' 0 C--O 1.191 -1.995 0 O-C-N 123.641 0.588 . . . . 29.12 112.128 177.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 61' ' ' LYS . . . . . 1.009 ' HZ2' ' HA ' ' C' ' 58' ' ' SER . 9.6 mtmp? -62.74 -43.67 98.19 Favored 'General case' 0 C--O 1.209 -1.031 0 N-CA-C 113.704 1.001 . . . . 54.55 113.704 173.238 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -51.53 -50.73 59.43 Favored 'General case' 0 C--O 1.185 -2.322 0 C-N-CA 123.485 0.714 . . . . 29.39 110.804 168.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.06 -37.2 78.38 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 108.177 -1.046 . . . . 22.06 108.177 -169.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 64' ' ' GLU . . . . . . . . . . . . . 66.4 tt0 -72.08 -41.04 67.81 Favored 'General case' 0 C--O 1.269 2.125 0 N-CA-C 113.185 0.809 . . . . 40.19 113.185 176.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.99 -42.38 76.27 Favored 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 119.419 -0.912 . . . . 20.91 112.607 171.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 66' ' ' VAL . . . . . . . . . . . . . 23.0 t -69.34 -45.68 78.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 O-C-N 121.113 -0.992 . . . . 22.27 110.548 -176.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 67' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -58.26 -42.06 85.63 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 115.208 1.559 . . . . 31.77 115.208 174.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 68' ' ' LYS . . . . . 0.657 ' O ' ' HG3' ' C' ' 72' ' ' GLU . 18.9 tttt -68.53 -43.68 76.19 Favored 'General case' 0 N--CA 1.41 -2.467 0 CA-C-N 114.471 -1.24 . . . . 36.18 108.978 -179.027 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 69' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -62.55 -49.86 73.61 Favored 'General case' 0 CA--C 1.503 -0.839 0 N-CA-C 108.467 -0.938 . . . . 21.45 108.467 177.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 70' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -54.09 -51.83 62.9 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 118.846 -1.141 . . . . 29.65 112.327 178.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.67 -40.43 92.41 Favored 'General case' 0 C--N 1.316 -0.89 0 O-C-N 120.336 -1.477 . . . . 26.25 111.781 -177.277 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 72' ' ' GLU . . . . . 0.657 ' HG3' ' O ' ' C' ' 68' ' ' LYS . 47.9 mt-10 -64.24 -38.5 91.29 Favored 'General case' 0 C--O 1.18 -2.597 0 C-N-CA 119.267 -0.973 . . . . 34.25 112.64 175.056 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 73' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -65.34 -34.27 77.94 Favored 'General case' 0 CA--C 1.556 1.183 0 CA-C-N 119.886 1.221 . . . . 36.6 111.433 -179.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 74' ' ' ILE . . . . . 0.423 HD13 HD13 ' D' ' 19' ' ' LEU . 4.7 mt -70.51 -49.62 51.46 Favored 'Isoleucine or valine' 0 C--O 1.251 1.156 0 N-CA-C 107.958 -1.127 . . . . 27.23 107.958 -179.799 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 75' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -57.07 -51.79 67.87 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 123.882 0.739 . . . . 38.3 112.78 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 76' ' ' LEU . . . . . . . . . . . . . 9.8 tp -65.23 -39.21 92.44 Favored 'General case' 0 CA--C 1.57 1.73 0 N-CA-C 112.809 0.67 . . . . 32.52 112.809 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.91 -46.96 92.85 Favored Glycine 0 N--CA 1.476 1.361 0 N-CA-C 109.243 -1.543 . . . . 31.11 109.243 173.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 78' ' ' GLU . . . . . . . . . . . . 0.317 22.2 pt-20 -67.29 -34.95 78.46 Favored 'General case' 0 C--O 1.217 -0.628 0 N-CA-C 114.658 1.355 . . . . 51.73 114.658 177.534 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 79' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -62.22 -40.87 97.55 Favored 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 119.483 1.038 . . . . 33.89 111.946 172.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 80' ' ' LEU . . . . . . . . . . . . . 45.9 mt -70.29 -41.88 72.8 Favored 'General case' 0 N--CA 1.44 -0.944 0 O-C-N 123.207 0.317 . . . . 37.97 110.707 -177.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 81' ' ' LEU . . . . . . . . . . . . . 78.1 mt -56.36 -52.49 64.38 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-O 118.137 -0.935 . . . . 42.76 112.893 173.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -52.83 -14.96 0.63 Allowed 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.472 1.286 . . . . 46.55 114.472 177.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 83' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -120.66 11.25 11.21 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 113.684 0.994 . . . . 51.54 113.684 -179.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.55 -12.96 61.42 Favored Glycine 0 C--O 1.243 0.667 0 N-CA-C 120.88 3.112 . . . . 54.81 120.88 172.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 85' ' ' ASP . . . . . 0.498 ' N ' ' OD1' ' C' ' 85' ' ' ASP . 0.0 OUTLIER -87.1 79.53 8.63 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 120.334 2.067 . . . . 65.49 107.896 -177.645 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 86' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -55.15 -36.23 65.58 Favored 'General case' 0 N--CA 1.426 -1.637 0 O-C-N 124.497 1.123 . . . . 73.49 112.292 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 87' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -56.99 -66.07 0.51 Allowed 'General case' 0 C--O 1.246 0.909 0 C-N-CA 124.82 1.248 . . . . 71.05 110.544 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 88' ' ' LYS . . . . . 0.573 ' O ' ' HB2' ' C' ' 91' ' ' ASP . 2.9 mtpt -65.53 -39.64 92.0 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-N 115.048 -0.978 . . . . 62.98 113.151 -176.317 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 89' ' ' GLY . . . . . . . . . . . . . . . -59.47 -43.88 97.14 Favored Glycine 0 C--N 1.333 0.41 0 N-CA-C 115.179 0.832 . . . . 43.26 115.179 178.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 90' ' ' VAL . . . . . . . . . . . . . 50.1 t -69.76 -38.54 76.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.23 -0.656 . . . . 38.53 109.23 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 91' ' ' ASP . . . . . 0.573 ' HB2' ' O ' ' C' ' 88' ' ' LYS . 57.3 m-20 -47.55 -54.83 10.59 Favored 'General case' 0 C--O 1.212 -0.885 0 CA-C-O 121.619 0.723 . . . . 49.31 111.475 170.627 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 92' ' ' HIS . . . . . . . . . . . . . 86.3 m-70 -58.29 -46.36 86.24 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.062 0.764 . . . . 35.14 113.062 178.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 93' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.82 -39.37 94.08 Favored 'General case' 0 C--O 1.204 -1.341 0 O-C-N 123.501 0.501 . . . . 35.51 112.039 179.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 94' ' ' THR . . . . . . . . . . . . . 1.8 m -53.08 -42.19 65.64 Favored 'General case' 0 C--O 1.258 1.504 0 C-N-CA 124.716 1.207 . . . . 39.0 112.262 169.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 95' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -64.44 -38.09 89.81 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.288 -0.883 . . . . 26.14 110.991 174.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.46 -43.67 76.52 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 118.831 -1.148 . . . . 25.93 109.573 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 97' ' ' ILE . . . . . . . . . . . . . 3.4 mt -64.48 -38.82 83.58 Favored 'Isoleucine or valine' 0 C--O 1.24 0.554 0 C-N-CA 117.268 -1.773 . . . . 29.67 110.176 179.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.01 -23.53 66.49 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 114.455 1.28 . . . . 31.23 114.455 -178.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 99' ' ' VAL . . . . . . . . . . . . 0.289 33.6 m -87.87 -3.09 9.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 115.653 1.723 . . . . 28.85 115.653 172.239 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 100' ' ' CYS . . . . . . . . . . . . . 22.7 t -89.07 138.13 31.69 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 118.447 -1.301 . . . . 42.73 113.233 -176.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 101' ' ' GLY . . . . . . . . . . . . . . . -66.56 -38.84 93.67 Favored Glycine 0 C--O 1.271 2.46 0 N-CA-C 115.748 1.059 . . . . 42.74 115.748 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 102' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -117.84 80.07 13.97 Favored Pre-proline 0 C--O 1.212 -0.884 0 N-CA-C 108.183 -1.043 . . . . 60.8 108.183 -179.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 103' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -71.36 -22.45 25.16 Favored 'Trans proline' 0 C--O 1.251 1.137 0 C-N-CA 122.842 2.361 . . . . 49.75 116.813 -172.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 104' ' ' GLN . . . . . . . . . . . . . 21.0 mm100 -72.65 -46.79 52.17 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 124.292 0.995 . . . . 64.72 110.474 173.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 105' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -54.99 -27.44 44.14 Favored 'General case' 0 CA--C 1.559 1.321 0 N-CA-C 112.564 0.579 . . . . 66.88 112.564 174.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 106' ' ' LEU . . . . . . . . . . . . . 7.3 tp -92.43 -38.03 12.22 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.644 1.178 . . . . 60.4 111.78 -177.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 107' ' ' LEU . . . . . . . . . . . . . 36.7 mt -61.81 -14.82 36.51 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-O 120.84 0.352 . . . . 65.08 111.707 172.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -62.45 -49.17 76.49 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 126.515 1.926 . . . . 71.62 110.901 175.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 109' ' ' VAL . . . . . . . . . . . . . 58.3 t -72.39 -36.16 54.09 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 O-C-N 124.672 1.232 . . . . 68.97 110.012 -178.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 110' ' ' LEU . . . . . 0.431 ' HA ' HG22 ' C' ' 113' ' ' THR . 12.6 mt -78.88 -27.36 44.0 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.167 1.173 . . . . 70.81 114.167 -178.452 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 111' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -61.8 -43.74 98.25 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 121.672 0.748 . . . . 72.16 109.418 170.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 112' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -92.99 47.48 1.28 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.361 1.464 . . . . 75.06 107.807 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 113' ' ' THR . . . . . 0.431 HG22 ' HA ' ' C' ' 110' ' ' LEU . 0.5 OUTLIER -163.95 -30.5 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 114.832 1.419 . . . . 69.08 114.832 175.997 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 114' ' ' LEU . . . . . . . . . . . . . 61.7 mt -97.95 157.98 33.64 Favored Pre-proline 0 CA--C 1.511 -0.545 0 O-C-N 121.499 -0.751 . . . . 66.68 111.661 -174.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 115' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -58.8 147.3 89.2 Favored 'Trans proline' 0 C--N 1.355 0.887 0 N-CA-C 107.807 -1.651 . . . . 65.89 107.807 165.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 116' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_exo -54.7 -43.19 61.43 Favored 'Trans proline' 0 CA--C 1.557 1.651 0 C-N-CA 117.301 -1.333 . . . . 66.44 115.46 173.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 117' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.43 -43.81 55.28 Favored 'Trans proline' 0 C--N 1.365 1.442 0 N-CA-C 115.149 1.173 . . . . 64.09 115.149 -176.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 118' ' ' VAL . . . . . . . . . . . . . 5.0 m -82.41 -37.53 14.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 O-C-N 123.905 0.753 . . . . 61.58 111.403 -177.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 119' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -54.66 -33.43 60.72 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.245 0.545 . . . . 61.28 109.873 171.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 120' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -75.17 -39.08 60.59 Favored 'General case' 0 C--O 1.249 1.04 0 CA-C-N 114.303 -1.317 . . . . 61.4 110.617 175.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 121' ' ' MET . . . . . . . . . . . . . 5.5 ttm -58.46 -50.0 75.31 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.307 0.575 . . . . 75.89 110.162 172.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 122' ' ' LEU . . . . . . . . . . . . . 56.0 tp -51.65 -42.94 62.45 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.924 1.453 . . . . 63.55 114.924 172.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 123' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.52 -27.39 69.23 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 113.735 1.013 . . . . 66.35 113.735 -178.731 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 124' ' ' THR . . . . . . . . . . . . . 82.6 m -56.42 -30.46 62.83 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 115.253 1.575 . . . . 69.7 115.253 172.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 125' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.473 0.678 0 N-CA-C 113.801 1.037 . . . . 75.08 113.801 -169.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 12' ' ' GLY . . . . . 0.942 ' O ' ' HB2' ' D' ' 13' ' ' DCY . . . . . . . . 0 N--CA 1.508 3.446 0 N-CA-C 114.163 0.425 . . . . 65.23 114.163 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' DCY . . . . . 0.942 ' HB2' ' O ' ' D' ' 12' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -70.58 -36.91 73.84 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 119.239 0.927 . . . . 59.2 111.248 176.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 15' ' ' LEU . . . . . . . . . . . . . 87.7 mt -74.16 -19.87 60.41 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 123.382 0.426 . . . . 53.94 112.078 -176.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 16' ' ' CYS . . . . . . . . . . . . . 95.0 m -67.18 -54.84 17.46 Favored 'General case' 0 C--O 1.25 1.125 0 N-CA-C 115.321 1.601 . . . . 63.57 115.321 167.645 -65.154 nan nan nan nan nan nan nan 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' ARG . . . . . . . . . . . . . 3.6 mtt85 -53.73 -49.57 67.85 Favored 'General case' 0 C--O 1.27 2.175 0 CA-C-O 122.645 1.212 . . . . 64.31 108.866 175.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' LEU . . . . . . . . . . . . . 15.0 tp -52.2 -47.37 65.63 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-N 113.963 -1.471 . . . . 51.92 111.762 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 19' ' ' LEU . . . . . 0.423 HD13 HD13 ' C' ' 74' ' ' ILE . 26.8 tp -61.75 -38.12 86.79 Favored 'General case' 0 CA--C 1.558 1.254 0 N-CA-C 113.743 1.016 . . . . 52.06 113.743 -177.744 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 20' ' ' SER . . . . . . . . . . . . . 53.7 p -69.37 -43.6 73.24 Favored 'General case' 0 C--O 1.242 0.708 0 N-CA-C 108.599 -0.889 . . . . 57.12 108.599 178.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 21' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -53.11 -40.93 64.51 Favored 'General case' 0 C--O 1.246 0.9 0 C-N-CA 120.257 -0.577 . . . . 56.92 110.761 176.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 22' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.522 0 N-CA-C 114.582 1.327 . . . . 58.99 114.582 -171.196 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' HOH . . . . . 0.618 ' O ' ' HE3' ' A' ' 125' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' HOH . . . . . 0.528 ' O ' ' CG2' ' A' ' 113' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 43.4 m . . . . . 0 N--CA 1.508 2.446 0 N-CA-C 113.286 0.847 . . . . 54.4 113.286 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 55.7 p30 -100.4 -169.71 1.76 Allowed 'General case' 0 CA--C 1.557 1.238 0 CA-C-N 113.703 -1.589 . . . . 54.54 109.414 162.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.3 tp -71.01 -35.43 72.05 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.09 0.956 . . . . 49.64 111.284 -175.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -59.26 -44.0 92.42 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.281 0.845 . . . . 62.17 113.281 173.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -61.97 -45.22 94.59 Favored 'General case' 0 C--O 1.217 -0.615 0 O-C-N 123.642 0.589 . . . . 45.05 112.144 -179.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.03 -37.34 64.35 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 107.849 -1.167 . . . . 32.15 107.849 -177.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -58.33 -45.76 87.48 Favored 'General case' 0 C--O 1.203 -1.393 0 C-N-CA 119.324 -0.95 . . . . 35.93 110.382 -179.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.93 -37.11 85.2 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 119.295 -0.962 . . . . 24.45 110.93 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 55.0 t -67.71 -45.42 84.69 Favored 'Isoleucine or valine' 0 C--O 1.247 0.945 0 O-C-N 121.356 -0.84 . . . . 23.96 112.111 177.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -57.03 -41.55 78.82 Favored 'General case' 0 C--O 1.247 0.967 0 CA-C-O 122.422 1.106 . . . . 35.95 111.756 176.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.0 tttp -68.28 -44.5 75.4 Favored 'General case' 0 C--O 1.263 1.801 0 CA-C-N 114.946 -1.025 . . . . 44.86 113.286 -177.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -59.86 -46.51 89.07 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-O 121.675 0.75 . . . . 21.47 109.941 174.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -54.61 -49.63 70.0 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 108.668 -0.864 . . . . 23.03 108.668 -179.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 46.7 mt -66.76 -42.48 86.07 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 115.999 -0.546 . . . . 31.21 112.433 -176.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -57.97 -39.57 78.48 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 112.039 0.385 . . . . 49.17 112.039 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -74.89 -36.12 62.25 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 119.594 -0.842 . . . . 27.0 108.97 -171.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 7.8 mm -64.73 -47.91 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 O-C-N 124.395 1.059 . . . . 26.25 111.241 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.478 ' HG3' ' HB3' ' B' ' 13' ' ' DCY . 5.1 tt0 -52.79 -54.08 39.16 Favored 'General case' 0 CA--C 1.558 1.278 0 N-CA-C 114.183 1.179 . . . . 37.32 114.183 171.633 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.38 -40.71 83.07 Favored 'General case' 0 C--O 1.252 1.217 0 O-C-N 121.159 -0.963 . . . . 36.54 113.183 174.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.21 -50.92 59.18 Favored Glycine 0 C--O 1.25 1.152 0 N-CA-C 108.475 -1.85 . . . . 27.26 108.475 178.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.425 ' OE2' ' HD3' ' B' ' 14' ' ' ARG . 45.2 tt0 -65.38 -48.33 73.28 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.028 0.531 . . . . 49.29 111.763 -175.277 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -57.23 -53.35 59.13 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.286 1.217 . . . . 45.42 114.286 174.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.8 mt -53.91 -36.61 62.92 Favored 'General case' 0 C--O 1.252 1.222 0 N-CA-C 114.564 1.32 . . . . 42.66 114.564 176.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 84.6 mt -75.42 -31.39 60.37 Favored 'General case' 0 C--O 1.243 0.726 0 C-N-CA 119.065 -1.054 . . . . 48.21 110.49 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.04 -47.61 79.52 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 104.986 -2.227 . . . . 50.91 104.986 179.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -67.21 3.15 1.28 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 115.469 1.655 . . . . 57.35 115.469 173.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 68.01 11.66 61.34 Favored Glycine 0 CA--C 1.54 1.6 0 N-CA-C 115.787 1.075 . . . . 50.85 115.787 -179.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.477 ' OD1' ' HD2' ' A' ' 88' ' ' LYS . 50.9 t0 -81.01 78.03 7.86 Favored 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 119.587 1.694 . . . . 53.18 107.783 165.577 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 12.1 m-30 -60.15 -28.69 68.12 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.107 -0.951 . . . . 55.54 112.945 -175.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -78.43 -49.47 13.42 Favored 'General case' 0 N--CA 1.433 -1.289 0 C-N-CA 119.281 -0.968 . . . . 57.92 109.986 -172.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.477 ' HD2' ' OD1' ' A' ' 85' ' ' ASP . 76.6 mttt -70.41 -33.43 71.35 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 113.671 0.989 . . . . 52.47 113.671 177.005 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.16 -44.8 97.01 Favored Glycine 0 CA--C 1.544 1.897 0 N-CA-C 110.346 -1.102 . . . . 29.93 110.346 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 54.2 t -64.66 -33.5 63.62 Favored 'Isoleucine or valine' 0 C--O 1.252 1.185 0 C-N-CA 124.67 1.188 . . . . 29.53 113.173 178.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -63.67 -48.87 75.44 Favored 'General case' 0 C--O 1.186 -2.282 0 O-C-N 123.928 0.767 . . . . 41.01 109.076 177.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -60.66 -51.08 70.9 Favored 'General case' 0 CA--C 1.572 1.811 0 C-N-CA 123.641 0.776 . . . . 34.47 112.5 176.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 94.5 mt -53.7 -39.93 65.59 Favored 'General case' 0 N--CA 1.492 1.631 0 CA-C-O 119.11 -0.471 . . . . 22.15 111.312 173.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 21.9 m -63.02 -43.09 99.67 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-O 121.196 0.522 . . . . 25.02 111.997 179.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -57.04 -42.38 80.4 Favored 'General case' 0 C--O 1.204 -1.314 0 N-CA-C 113.084 0.772 . . . . 21.79 113.084 171.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.63 -40.09 84.63 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 119.189 0.904 . . . . 15.88 109.86 179.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 54.9 mt -65.52 -42.07 92.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 N-CA-C 108.317 -0.994 . . . . 20.14 108.317 179.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -57.36 -28.82 63.5 Favored 'General case' 0 C--O 1.283 2.867 0 N-CA-C 115.433 1.642 . . . . 21.53 115.433 -178.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . 0.281 27.5 m -90.66 1.55 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.076 0 N-CA-C 115.662 1.727 . . . . 20.47 115.662 -178.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 63.2 m -101.0 130.28 46.96 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 108.643 -0.873 . . . . 27.76 108.643 179.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -69.25 -27.41 73.72 Favored Glycine 0 N--CA 1.438 -1.17 0 C-N-CA 118.915 -1.612 . . . . 26.09 113.256 177.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLN . . . . . 0.411 ' OE1' ' HB3' ' C' ' 58' ' ' SER . 79.9 mt-30 -135.27 82.66 40.56 Favored Pre-proline 0 C--O 1.242 0.68 0 N-CA-C 108.4 -0.963 . . . . 48.38 108.4 -178.608 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -80.04 8.95 3.79 Favored 'Trans proline' 0 CA--C 1.554 1.489 0 N-CA-C 114.915 1.083 . . . . 27.47 114.915 -173.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -58.75 -46.3 87.75 Favored 'General case' 0 N--CA 1.514 2.753 0 CA-C-N 119.527 1.058 . . . . 41.27 112.721 -171.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -66.8 -39.51 87.78 Favored 'General case' 0 C--O 1.253 1.282 0 N-CA-C 113.797 1.036 . . . . 50.73 113.797 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 24.6 tp -63.77 -38.89 92.79 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 107.447 -1.316 . . . . 26.05 107.447 178.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 48.6 mt -69.26 -41.09 77.36 Favored 'General case' 0 C--O 1.249 1.072 0 CA-C-O 121.822 0.82 . . . . 21.52 113.085 -178.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.99 -40.7 90.06 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.845 -0.616 . . . . 46.9 112.441 172.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 51.5 t -64.9 -49.69 78.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 122.408 1.099 . . . . 24.16 109.256 176.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 95.5 mt -57.15 -37.47 72.11 Favored 'General case' 0 C--N 1.312 -1.042 0 O-C-N 120.032 -1.667 . . . . 22.18 114.423 174.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 21.2 tm0? -62.97 -29.46 70.83 Favored 'General case' 0 CA--C 1.561 1.373 0 O-C-N 120.426 -1.421 . . . . 30.9 109.866 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 70.5 mm-40 -82.78 -11.32 58.37 Favored 'General case' 0 C--O 1.214 -0.789 0 CA-C-O 121.824 0.821 . . . . 29.15 112.254 -176.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' THR . . . . . 0.528 ' CG2' ' O ' ' A' ' 19' ' ' HOH . 0.9 OUTLIER -114.12 -23.58 9.43 Favored 'General case' 0 C--O 1.205 -1.246 0 C-N-CA 125.686 1.595 . . . . 33.68 110.266 -165.398 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 68.3 mt -108.02 154.78 40.95 Favored Pre-proline 0 CA--C 1.493 -1.25 0 O-C-N 120.885 -1.134 . . . . 24.77 110.783 -174.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -65.08 144.1 80.77 Favored 'Trans proline' 0 N--CA 1.502 2.02 0 C-N-CA 116.963 -1.558 . . . . 24.49 111.407 168.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -47.66 -47.66 17.71 Favored 'Trans proline' 0 CA--C 1.503 -1.073 0 N-CA-C 116.694 1.767 . . . . 26.28 116.694 -177.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -66.64 -30.08 42.78 Favored 'Trans proline' 0 N--CA 1.5 1.905 0 C-N-CA 115.509 -2.528 . . . . 28.97 110.644 -177.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 42.8 t -67.89 -40.63 83.84 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 N-CA-C 111.905 0.335 . . . . 25.69 111.905 177.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -65.17 -44.12 89.52 Favored 'General case' 0 N--CA 1.425 -1.701 0 N-CA-C 111.757 0.28 . . . . 25.4 111.757 175.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -58.89 -40.67 85.16 Favored 'General case' 0 CA--C 1.495 -1.172 0 CA-C-O 122.626 1.203 . . . . 34.65 112.497 171.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 2.9 ttm -59.08 -44.06 91.85 Favored 'General case' 0 N--CA 1.422 -1.852 0 CA-C-N 113.372 -1.74 . . . . 49.61 107.087 -175.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.749 ' C ' HD23 ' A' ' 122' ' ' LEU . 5.2 tt -59.47 -40.39 86.79 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-O 118.742 -0.647 . . . . 27.89 110.081 -177.116 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 58.0 mt -60.91 -31.52 71.03 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 115.466 1.654 . . . . 25.52 115.466 174.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 46.8 p -72.01 -27.57 62.82 Favored 'General case' 0 CA--C 1.554 1.103 0 CA-C-N 118.602 0.637 . . . . 30.64 109.491 -176.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.623 ' O ' ' HB2' ' A' ' 126' ' ' LEU . 45.7 mttm -85.98 1.8 48.77 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.995 -0.548 . . . . 46.7 111.723 -178.993 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.623 ' HB2' ' O ' ' A' ' 125' ' ' LYS . 2.7 mp . . . . . 0 N--CA 1.511 2.612 0 N-CA-C 120.703 3.594 . . . . 46.62 120.703 -169.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.511 3.652 0 CA-C-O 119.651 -0.527 . . . . 43.53 113.016 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' DCY . . . . . 0.478 ' HB3' ' HG3' ' A' ' 75' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ARG . . . . . 0.786 HH11 ' HG3' ' B' ' 14' ' ' ARG . 0.0 OUTLIER -55.65 -37.24 67.98 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.241 0.83 . . . . 59.71 113.241 -177.94 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.7 tp -58.31 -46.83 85.4 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 113.333 0.864 . . . . 35.87 113.333 172.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 62.9 m -57.27 -39.96 76.76 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.174 0.897 . . . . 42.78 113.385 176.43 -56.902 nan nan nan nan nan nan nan 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ARG . . . . . . . . . . . . . 1.6 tpp180 -67.36 -48.12 68.4 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 126.975 2.11 . . . . 59.37 106.264 -175.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 43.9 tp -59.68 -41.93 91.8 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 114.03 -1.441 . . . . 37.06 112.069 177.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 91.0 mt -63.06 -40.44 97.69 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 113.421 0.897 . . . . 33.83 113.421 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.7 m -62.36 -37.9 87.46 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 114.819 1.415 . . . . 39.22 114.819 178.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.34 108.56 0.72 Allowed 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 115.614 -0.721 . . . . 39.37 111.98 -174.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.277 2.517 0 N-CA-C 116.789 2.144 . . . . 46.8 116.789 -167.668 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.197 -2.187 0 CA-C-O 118.012 -1.438 . . . . 31.93 113.769 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.48 -47.37 3.09 Favored 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 114.683 -3.078 . . . . 32.15 115.878 -158.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' LEU . . . . . . . . . . . . . 65.1 tp -68.58 -48.53 63.98 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 107.897 -1.149 . . . . 32.6 107.897 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' GLY . . . . . . . . . . . . . . . -54.49 -41.43 72.75 Favored Glycine 0 CA--C 1.552 2.397 0 C-N-CA 119.369 -1.396 . . . . 24.52 112.224 178.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' SER . . . . . 1.009 ' HA ' ' HZ2' ' C' ' 61' ' ' LYS 0.286 0.3 OUTLIER -71.63 -28.5 63.82 Favored 'General case' 0 CA--C 1.502 -0.9 0 C-N-CA 116.352 -2.139 . . . . 29.94 112.435 179.527 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -72.21 -34.76 68.6 Favored 'General case' 0 CA--C 1.509 -0.609 0 C-N-CA 118.504 -1.278 . . . . 40.62 109.051 -176.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' LEU . . . . . . . . . . . . . 14.7 mt -69.76 -37.56 76.46 Favored 'General case' 0 C--O 1.191 -1.995 0 O-C-N 123.641 0.588 . . . . 29.12 112.128 177.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' LYS . . . . . 1.009 ' HZ2' ' HA ' ' C' ' 58' ' ' SER . 9.6 mtmp? -62.74 -43.67 98.19 Favored 'General case' 0 C--O 1.209 -1.031 0 N-CA-C 113.704 1.001 . . . . 54.55 113.704 173.238 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -51.53 -50.73 59.43 Favored 'General case' 0 C--O 1.185 -2.322 0 C-N-CA 123.485 0.714 . . . . 29.39 110.804 168.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.06 -37.2 78.38 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 108.177 -1.046 . . . . 22.06 108.177 -169.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' GLU . . . . . . . . . . . . . 66.4 tt0 -72.08 -41.04 67.81 Favored 'General case' 0 C--O 1.269 2.125 0 N-CA-C 113.185 0.809 . . . . 40.19 113.185 176.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.99 -42.38 76.27 Favored 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 119.419 -0.912 . . . . 20.91 112.607 171.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' VAL . . . . . . . . . . . . . 23.0 t -69.34 -45.68 78.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 O-C-N 121.113 -0.992 . . . . 22.27 110.548 -176.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 67' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -58.26 -42.06 85.63 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 115.208 1.559 . . . . 31.77 115.208 174.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 68' ' ' LYS . . . . . 0.657 ' O ' ' HG3' ' C' ' 72' ' ' GLU . 18.9 tttt -68.53 -43.68 76.19 Favored 'General case' 0 N--CA 1.41 -2.467 0 CA-C-N 114.471 -1.24 . . . . 36.18 108.978 -179.027 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 69' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -62.55 -49.86 73.61 Favored 'General case' 0 CA--C 1.503 -0.839 0 N-CA-C 108.467 -0.938 . . . . 21.45 108.467 177.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 70' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -54.09 -51.83 62.9 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 118.846 -1.141 . . . . 29.65 112.327 178.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.67 -40.43 92.41 Favored 'General case' 0 C--N 1.316 -0.89 0 O-C-N 120.336 -1.477 . . . . 26.25 111.781 -177.277 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 72' ' ' GLU . . . . . 0.657 ' HG3' ' O ' ' C' ' 68' ' ' LYS . 47.9 mt-10 -64.24 -38.5 91.29 Favored 'General case' 0 C--O 1.18 -2.597 0 C-N-CA 119.267 -0.973 . . . . 34.25 112.64 175.056 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 73' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -65.34 -34.27 77.94 Favored 'General case' 0 CA--C 1.556 1.183 0 CA-C-N 119.886 1.221 . . . . 36.6 111.433 -179.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 74' ' ' ILE . . . . . 0.423 HD13 HD13 ' D' ' 19' ' ' LEU . 4.7 mt -70.51 -49.62 51.46 Favored 'Isoleucine or valine' 0 C--O 1.251 1.156 0 N-CA-C 107.958 -1.127 . . . . 27.23 107.958 -179.799 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 75' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -57.07 -51.79 67.87 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 123.882 0.739 . . . . 38.3 112.78 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 76' ' ' LEU . . . . . . . . . . . . . 9.8 tp -65.23 -39.21 92.44 Favored 'General case' 0 CA--C 1.57 1.73 0 N-CA-C 112.809 0.67 . . . . 32.52 112.809 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.91 -46.96 92.85 Favored Glycine 0 N--CA 1.476 1.361 0 N-CA-C 109.243 -1.543 . . . . 31.11 109.243 173.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 78' ' ' GLU . . . . . . . . . . . . 0.317 22.2 pt-20 -67.29 -34.95 78.46 Favored 'General case' 0 C--O 1.217 -0.628 0 N-CA-C 114.658 1.355 . . . . 51.73 114.658 177.534 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 79' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -62.22 -40.87 97.55 Favored 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 119.483 1.038 . . . . 33.89 111.946 172.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 80' ' ' LEU . . . . . . . . . . . . . 45.9 mt -70.29 -41.88 72.8 Favored 'General case' 0 N--CA 1.44 -0.944 0 O-C-N 123.207 0.317 . . . . 37.97 110.707 -177.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 81' ' ' LEU . . . . . . . . . . . . . 78.1 mt -56.36 -52.49 64.38 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-O 118.137 -0.935 . . . . 42.76 112.893 173.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -52.83 -14.96 0.63 Allowed 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.472 1.286 . . . . 46.55 114.472 177.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 83' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -120.66 11.25 11.21 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 113.684 0.994 . . . . 51.54 113.684 -179.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.55 -12.96 61.42 Favored Glycine 0 C--O 1.243 0.667 0 N-CA-C 120.88 3.112 . . . . 54.81 120.88 172.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 85' ' ' ASP . . . . . 0.498 ' N ' ' OD1' ' C' ' 85' ' ' ASP . 0.0 OUTLIER -87.1 79.53 8.63 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 120.334 2.067 . . . . 65.49 107.896 -177.645 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 86' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -55.15 -36.23 65.58 Favored 'General case' 0 N--CA 1.426 -1.637 0 O-C-N 124.497 1.123 . . . . 73.49 112.292 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 87' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -56.99 -66.07 0.51 Allowed 'General case' 0 C--O 1.246 0.909 0 C-N-CA 124.82 1.248 . . . . 71.05 110.544 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 88' ' ' LYS . . . . . 0.573 ' O ' ' HB2' ' C' ' 91' ' ' ASP . 2.9 mtpt -65.53 -39.64 92.0 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-N 115.048 -0.978 . . . . 62.98 113.151 -176.317 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 89' ' ' GLY . . . . . . . . . . . . . . . -59.47 -43.88 97.14 Favored Glycine 0 C--N 1.333 0.41 0 N-CA-C 115.179 0.832 . . . . 43.26 115.179 178.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 90' ' ' VAL . . . . . . . . . . . . . 50.1 t -69.76 -38.54 76.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.23 -0.656 . . . . 38.53 109.23 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 91' ' ' ASP . . . . . 0.573 ' HB2' ' O ' ' C' ' 88' ' ' LYS . 57.3 m-20 -47.55 -54.83 10.59 Favored 'General case' 0 C--O 1.212 -0.885 0 CA-C-O 121.619 0.723 . . . . 49.31 111.475 170.627 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 92' ' ' HIS . . . . . . . . . . . . . 86.3 m-70 -58.29 -46.36 86.24 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.062 0.764 . . . . 35.14 113.062 178.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 93' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.82 -39.37 94.08 Favored 'General case' 0 C--O 1.204 -1.341 0 O-C-N 123.501 0.501 . . . . 35.51 112.039 179.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 94' ' ' THR . . . . . . . . . . . . . 1.8 m -53.08 -42.19 65.64 Favored 'General case' 0 C--O 1.258 1.504 0 C-N-CA 124.716 1.207 . . . . 39.0 112.262 169.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 95' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -64.44 -38.09 89.81 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.288 -0.883 . . . . 26.14 110.991 174.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.46 -43.67 76.52 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 118.831 -1.148 . . . . 25.93 109.573 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 97' ' ' ILE . . . . . . . . . . . . . 3.4 mt -64.48 -38.82 83.58 Favored 'Isoleucine or valine' 0 C--O 1.24 0.554 0 C-N-CA 117.268 -1.773 . . . . 29.67 110.176 179.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.01 -23.53 66.49 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 114.455 1.28 . . . . 31.23 114.455 -178.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 99' ' ' VAL . . . . . . . . . . . . 0.289 33.6 m -87.87 -3.09 9.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 115.653 1.723 . . . . 28.85 115.653 172.239 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 100' ' ' CYS . . . . . . . . . . . . . 22.7 t -89.07 138.13 31.69 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 118.447 -1.301 . . . . 42.73 113.233 -176.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' GLY . . . . . . . . . . . . . . . -66.56 -38.84 93.67 Favored Glycine 0 C--O 1.271 2.46 0 N-CA-C 115.748 1.059 . . . . 42.74 115.748 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -117.84 80.07 13.97 Favored Pre-proline 0 C--O 1.212 -0.884 0 N-CA-C 108.183 -1.043 . . . . 60.8 108.183 -179.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -71.36 -22.45 25.16 Favored 'Trans proline' 0 C--O 1.251 1.137 0 C-N-CA 122.842 2.361 . . . . 49.75 116.813 -172.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' GLN . . . . . . . . . . . . . 21.0 mm100 -72.65 -46.79 52.17 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 124.292 0.995 . . . . 64.72 110.474 173.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 105' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -54.99 -27.44 44.14 Favored 'General case' 0 CA--C 1.559 1.321 0 N-CA-C 112.564 0.579 . . . . 66.88 112.564 174.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 106' ' ' LEU . . . . . . . . . . . . . 7.3 tp -92.43 -38.03 12.22 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.644 1.178 . . . . 60.4 111.78 -177.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 107' ' ' LEU . . . . . . . . . . . . . 36.7 mt -61.81 -14.82 36.51 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-O 120.84 0.352 . . . . 65.08 111.707 172.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.413 ' HA ' HE21 ' C' ' 108' ' ' GLN . 0.0 OUTLIER -62.45 -49.17 76.49 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 126.515 1.926 . . . . 71.62 110.901 175.748 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 109' ' ' VAL . . . . . . . . . . . . . 58.3 t -72.39 -36.16 54.09 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 O-C-N 124.672 1.232 . . . . 68.97 110.012 -178.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 110' ' ' LEU . . . . . 0.431 ' HA ' HG22 ' C' ' 113' ' ' THR . 12.6 mt -78.88 -27.36 44.0 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.167 1.173 . . . . 70.81 114.167 -178.452 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 111' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -61.8 -43.74 98.25 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 121.672 0.748 . . . . 72.16 109.418 170.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 112' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -92.99 47.48 1.28 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.361 1.464 . . . . 75.06 107.807 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 113' ' ' THR . . . . . 0.431 HG22 ' HA ' ' C' ' 110' ' ' LEU . 0.5 OUTLIER -163.95 -30.5 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 114.832 1.419 . . . . 69.08 114.832 175.997 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 114' ' ' LEU . . . . . . . . . . . . . 61.7 mt -97.95 157.98 33.64 Favored Pre-proline 0 CA--C 1.511 -0.545 0 O-C-N 121.499 -0.751 . . . . 66.68 111.661 -174.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 115' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -58.8 147.3 89.2 Favored 'Trans proline' 0 C--N 1.355 0.887 0 N-CA-C 107.807 -1.651 . . . . 65.89 107.807 165.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 116' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_exo -54.7 -43.19 61.43 Favored 'Trans proline' 0 CA--C 1.557 1.651 0 C-N-CA 117.301 -1.333 . . . . 66.44 115.46 173.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 117' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.43 -43.81 55.28 Favored 'Trans proline' 0 C--N 1.365 1.442 0 N-CA-C 115.149 1.173 . . . . 64.09 115.149 -176.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 118' ' ' VAL . . . . . . . . . . . . . 5.0 m -82.41 -37.53 14.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 O-C-N 123.905 0.753 . . . . 61.58 111.403 -177.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 119' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -54.66 -33.43 60.72 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.245 0.545 . . . . 61.28 109.873 171.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 120' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -75.17 -39.08 60.59 Favored 'General case' 0 C--O 1.249 1.04 0 CA-C-N 114.303 -1.317 . . . . 61.4 110.617 175.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 121' ' ' MET . . . . . . . . . . . . . 5.5 ttm -58.46 -50.0 75.31 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.307 0.575 . . . . 75.89 110.162 172.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 122' ' ' LEU . . . . . . . . . . . . . 56.0 tp -51.65 -42.94 62.45 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.924 1.453 . . . . 63.55 114.924 172.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 123' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.52 -27.39 69.23 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 113.735 1.013 . . . . 66.35 113.735 -178.731 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 124' ' ' THR . . . . . . . . . . . . . 82.6 m -56.42 -30.46 62.83 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 115.253 1.575 . . . . 69.7 115.253 172.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 125' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.473 0.678 0 N-CA-C 113.801 1.037 . . . . 75.08 113.801 -169.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' GLY . . . . . 0.942 ' O ' ' HB2' ' D' ' 13' ' ' DCY . . . . . . . . 0 N--CA 1.508 3.446 0 N-CA-C 114.163 0.425 . . . . 65.23 114.163 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' DCY . . . . . 0.942 ' HB2' ' O ' ' D' ' 12' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -70.58 -36.91 73.84 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 119.239 0.927 . . . . 59.2 111.248 176.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' LEU . . . . . . . . . . . . . 87.7 mt -74.16 -19.87 60.41 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 123.382 0.426 . . . . 53.94 112.078 -176.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' CYS . . . . . . . . . . . . . 95.0 m -67.18 -54.84 17.46 Favored 'General case' 0 C--O 1.25 1.125 0 N-CA-C 115.321 1.601 . . . . 63.57 115.321 167.645 -65.154 nan nan nan nan nan nan nan 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' ARG . . . . . . . . . . . . . 3.6 mtt85 -53.73 -49.57 67.85 Favored 'General case' 0 C--O 1.27 2.175 0 CA-C-O 122.645 1.212 . . . . 64.31 108.866 175.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' LEU . . . . . . . . . . . . . 15.0 tp -52.2 -47.37 65.63 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-N 113.963 -1.471 . . . . 51.92 111.762 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' LEU . . . . . 0.423 HD13 HD13 ' C' ' 74' ' ' ILE . 26.8 tp -61.75 -38.12 86.79 Favored 'General case' 0 CA--C 1.558 1.254 0 N-CA-C 113.743 1.016 . . . . 52.06 113.743 -177.744 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' SER . . . . . . . . . . . . . 53.7 p -69.37 -43.6 73.24 Favored 'General case' 0 C--O 1.242 0.708 0 N-CA-C 108.599 -0.889 . . . . 57.12 108.599 178.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -53.11 -40.93 64.51 Favored 'General case' 0 C--O 1.246 0.9 0 C-N-CA 120.257 -0.577 . . . . 56.92 110.761 176.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.522 0 N-CA-C 114.582 1.327 . . . . 58.99 114.582 -171.196 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' HOH . . . . . 0.618 ' O ' ' HE3' ' A' ' 125' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' HOH . . . . . 0.528 ' O ' ' CG2' ' A' ' 113' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_