data_6hxt_residue ############################ # Computer software used # ############################ 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 6hxt _Structure_validation_residue.Date_analyzed 2020-04-24 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 ' 6' ' ' GLY . . . . . 0.501 ' N ' ' O ' ' A' ' 201' ' ' HOH . . . . . . . . 0 N--CA 1.452 -0.284 0 N-CA-C 112.965 -0.054 . . . . 115.28 112.965 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 23.4 tp -117.99 136.48 53.49 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 122.866 0.467 . . . . 82.040000000000006 109.749 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . . . -139.24 121.37 15.77 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.715 -0.846 . . . . 69.200000000000003 108.715 -178.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 20.4 m -136.89 153.01 29.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 N-CA-C 108.72 -0.845 . . . . 69.780000000000001 108.72 -178.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -89.69 130.71 35.93 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.746 -0.661 . . . . 87.290000000000006 109.479 168.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -138.02 136.16 36.61 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 109.071 -0.714 . . . . 62.75 109.071 -174.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 88.3 t -96.0 119.17 43.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 109.231 -0.655 . . . . 54.75 109.231 -173.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -115.36 111.9 21.55 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.225 -1.028 . . . . 60.109999999999999 108.225 176.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? 52.56 47.62 24.31 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.93 0.871 . . . . 61.5 111.629 -179.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 89.62 -16.48 56.33 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 115.384 0.914 . . . . 60.140000000000001 115.384 175.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.6 t -102.95 119.83 51.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 118.162 0.981 . . . . 66.519999999999996 109.184 -173.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -69.24 125.88 28.07 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.258 -0.428 . . . . 88.810000000000002 109.894 175.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 67.7 m80 -115.37 154.89 28.38 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.414 0.626 . . . . 56.899999999999999 109.791 177.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -95.31 124.59 39.43 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.873 -0.788 . . . . 68.969999999999999 108.873 169.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 46.4 t -118.49 133.66 64.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.681 -0.859 . . . . 62.240000000000002 108.681 -178.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.4 mtm-85 -124.93 128.69 49.01 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.804 -0.813 . . . . 89.709999999999994 108.804 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . 0.605 ' CG1' ' CD1' ' A' ' 31' ' ' LEU . 19.1 m -119.72 138.47 50.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 N-CA-C 109.23 -0.655 . . . . 65.599999999999994 109.23 174.91 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' MSE . . . . . . . . . . . . . 1.0 OUTLIER -133.64 117.63 17.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.681 -0.691 . . . . 105.06 109.703 176.421 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.6 t -112.46 116.52 52.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 107.414 -1.328 . . . . 78.329999999999998 107.414 175.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.7 p -135.66 111.99 9.81 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 107.694 -1.224 . . . . 90.109999999999999 107.694 -178.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 64.48 -116.67 9.33 Favored Glycine 0 C--O 1.237 0.288 0 C-N-CA 120.152 -1.023 . . . . 86.790000000000006 110.985 -175.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . . . -116.41 31.29 6.82 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 122.219 -0.577 . . . . 91.790000000000006 112.413 -176.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.8 p -132.91 138.54 51.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 N-CA-C 109.19 -0.67 . . . . 84.140000000000001 109.19 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . 0.415 ' N ' ' O ' ' A' ' 46' ' ' PHE . 6.0 tp -112.88 124.7 53.21 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 123.256 0.623 . . . . 69.290000000000006 109.907 179.906 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -110.35 132.07 54.5 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 123.886 0.874 . . . . 114.76000000000001 109.072 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LEU . . . . . 0.605 ' CD1' ' CG1' ' A' ' 22' ' ' VAL . 4.0 tp -134.21 138.79 45.36 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 115.158 -0.928 . . . . 69.709999999999994 110.714 -178.186 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . . . -137.75 129.47 28.42 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 124.915 1.385 . . . . 66.980000000000004 110.493 177.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.7 t -117.41 132.0 68.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 N-CA-C 107.943 -1.132 . . . . 61.409999999999997 107.943 173.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -135.58 130.28 34.23 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 120.916 -0.313 . . . . 108.45 111.402 -175.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -92.54 107.92 19.58 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 107.15 -1.426 . . . . 82.790000000000006 107.15 167.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 43.4 mtt180 -65.28 -32.08 73.55 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.623 0.601 . . . . 99.799999999999997 112.623 -174.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' MSE . . . . . . . . . . . . . 42.4 ttm -63.06 -41.01 99.37 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.276 0.473 . . . . 83.840000000000003 112.276 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 43.6 p -105.6 -2.84 23.01 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.184 0.809 . . . . 76.450000000000003 113.184 -177.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 62.16 16.48 8.36 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 124.275 1.03 . . . . 76.109999999999999 112.439 -176.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . 0.503 ' OD1' ' OH ' ' A' ' 139' ' ' TYR . 69.2 m-20 -69.64 135.85 50.43 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 121.849 -0.532 . . . . 82.420000000000002 109.927 175.448 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . 0.453 ' OE1' ' NH1' ' A' ' 43' ' ' ARG . 33.2 mt-30 -131.73 138.58 48.69 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.197 -0.456 . . . . 87.159999999999997 109.892 177.852 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 23.9 m-90 -123.09 124.8 43.91 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.268 -1.012 . . . . 63.75 108.268 172.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ARG . . . . . 0.453 ' NH1' ' OE1' ' A' ' 41' ' ' GLN . 1.0 OUTLIER -129.76 141.6 50.84 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 119.309 -0.957 . . . . 116.88 110.238 -174.648 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -134.79 144.16 16.05 Favored Glycine 0 N--CA 1.45 -0.411 0 O-C-N 124.92 1.387 . . . . 76.810000000000002 113.546 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -123.87 125.68 45.08 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.932 -0.766 . . . . 102.77 108.932 176.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PHE . . . . . 0.415 ' O ' ' N ' ' A' ' 29' ' ' LEU . 11.7 m-85 -135.73 128.38 30.81 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.541 -0.54 . . . . 71.890000000000001 109.541 -174.281 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 p30 -92.44 166.02 12.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.817 0.817 . . . . 90.760000000000005 110.591 174.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.22 -38.92 74.48 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.186 -0.916 . . . . 76.030000000000001 111.815 -175.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.26 -44.75 97.16 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 120.107 -1.044 . . . . 85.010000000000005 113.06 177.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -62.73 -46.07 89.78 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 122.331 -0.511 . . . . 77.200000000000003 111.343 179.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 27.8 mm -59.56 -43.32 90.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-O 120.992 0.425 . . . . 66.879999999999995 110.523 -177.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -70.61 -37.26 73.83 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.61 -0.436 . . . . 71.659999999999997 111.437 -176.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -58.81 -39.65 81.77 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.025 -0.67 . . . . 114.26000000000001 110.897 169.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 6.7 tt -64.89 -53.73 41.97 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 120.79 0.329 . . . . 74.760000000000005 111.397 -179.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.7 p -64.06 -35.76 81.8 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.665 -0.414 . . . . 67.829999999999998 111.758 -178.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -63.86 -37.2 86.51 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.332 -0.547 . . . . 90.189999999999998 110.796 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . . . -65.93 -26.64 67.68 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.091 0.404 . . . . 63.740000000000002 112.091 -177.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 14.0 p -76.06 -5.89 48.56 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.968 0.729 . . . . 61.590000000000003 112.968 176.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.1 5.48 85.1 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-O 119.263 -0.743 . . . . 71.349999999999994 114.576 -174.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASN . . . . . 0.432 ' OD1' ' NZ ' ' A' ' 62' ' ' LYS . 7.0 t-20 -133.23 77.47 1.73 Allowed 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.073 -1.455 . . . . 66.439999999999998 107.073 -178.43 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -65.02 147.62 53.14 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.75 0.786 . . . . 74.239999999999995 111.879 -170.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LYS . . . . . 0.432 ' NZ ' ' OD1' ' A' ' 60' ' ' ASN . 44.7 mmtm -141.18 136.78 32.15 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.235 -0.893 . . . . 60.700000000000003 109.448 175.282 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 56.9 mm-40 -64.69 152.05 43.39 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.383 0.611 . . . . 70.120000000000005 109.956 171.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -56.95 -44.57 82.69 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.732 -0.667 . . . . 70.049999999999997 111.778 -176.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -68.42 -32.85 73.18 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.783 -0.767 . . . . 72.659999999999997 111.432 -178.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.3 mt -69.51 -43.55 80.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 120.415 -0.514 . . . . 61.189999999999998 110.417 176.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -57.06 -45.42 83.26 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 121.952 -0.467 . . . . 57.840000000000003 111.148 177.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 85.7 m -61.48 -39.23 90.17 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.797 -0.361 . . . . 67.540000000000006 111.512 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 7.7 m80 -66.24 -42.16 89.02 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.034 -0.666 . . . . 62.909999999999997 111.647 177.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' MSE . . . . . . . . . . . . . 77.5 mtp -59.3 -41.62 89.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.117 0.484 . . . . 59.659999999999997 109.764 176.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 15.8 tp -60.32 -44.02 95.85 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.232 -0.895 . . . . 68.680000000000007 111.345 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -68.61 -38.95 81.01 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.154 -0.618 . . . . 85.629999999999995 111.442 178.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 28.5 m -63.56 -38.28 90.54 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.472 -0.491 . . . . 62.960000000000001 111.32 179.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.91 -41.06 97.78 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.579 -0.449 . . . . 53.509999999999998 111.042 174.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 15.7 mt -67.15 -44.21 80.37 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.874 -0.33 . . . . 64.349999999999994 111.515 -176.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 80.5 p -84.2 -2.64 57.24 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 112.582 0.586 . . . . 68.189999999999998 112.582 178.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 58.02 39.24 26.57 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.238 0.615 . . . . 87.629999999999995 111.535 177.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 84.8 p -105.31 15.22 27.67 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.812 0.671 . . . . 76.870000000000005 112.812 -177.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 5.5 t -145.01 139.45 27.47 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 122.901 0.48 . . . . 94.420000000000002 109.794 -177.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . . . -85.53 -9.08 57.89 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.971 1.1 . . . . 71.930000000000007 113.971 -171.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 60.2 p -107.55 -12.4 15.28 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 114.054 1.131 . . . . 58.719999999999999 114.054 -174.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 8.6 m -118.35 137.84 50.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-N 118.849 0.75 . . . . 58.859999999999999 109.285 -175.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.3 t -146.89 170.83 16.23 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.385 -0.969 . . . . 61.07 108.385 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 88.1 mt -123.26 151.73 42.04 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.548 0.69 . . . . 57.240000000000002 111.722 -176.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -146.79 158.74 43.98 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 107.976 -1.12 . . . . 67.629999999999995 107.976 167.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 23.3 tp -125.1 116.17 21.66 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 107.835 -1.172 . . . . 56.049999999999997 107.835 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.8 mp -106.85 144.41 33.53 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.674 -0.491 . . . . 65.120000000000005 109.674 -174.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 73.1 p -90.45 -177.6 5.11 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 121.669 0.747 . . . . 67.909999999999997 109.483 171.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -73.34 -21.71 60.48 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 119.916 -0.714 . . . . 120.18000000000001 112.087 177.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.8 m -65.22 -42.16 93.74 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.679 -0.408 . . . . 78.590000000000003 111.09 174.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -66.81 -31.76 72.6 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.083 0.401 . . . . 86.269999999999996 112.083 -176.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.9 mt -80.24 -43.82 20.75 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.444 -0.502 . . . . 92.590000000000003 112.034 -175.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.18 -28.04 68.46 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.738 -0.785 . . . . 112.34999999999999 111.549 178.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 60.7 p -70.88 -38.13 73.05 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.087 -0.645 . . . . 89.819999999999993 110.797 171.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 19.5 mt -69.42 -10.61 58.73 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.882 0.697 . . . . 93.579999999999998 112.882 174.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ARG . . . . . 0.427 ' NH2' ' O ' ' B' ' 95' ' ' LEU . 43.5 mtm180 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 118.556 0.616 . . . . 108.37 111.132 -178.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.578 0.228 . . . . 113.42 110.882 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . . . 60.14 25.01 14.32 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.203 0.601 . . . . 107.31 112.135 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.5 p -99.05 0.68 44.23 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.983 0.734 . . . . 95.079999999999998 112.983 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 8.0 ttmt -69.59 151.12 46.33 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.479 0.657 . . . . 85.969999999999999 110.807 -175.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 80.7 mmt-85 -119.51 157.22 28.76 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.672 -0.694 . . . . 70.519999999999996 110.068 171.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -128.19 110.82 12.78 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.058 -1.09 . . . . 82.790000000000006 108.058 179.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 30.5 tp -79.51 120.1 23.41 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.094 -0.706 . . . . 62.520000000000003 109.094 174.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 35.6 mm -102.49 120.25 51.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 108.483 -0.932 . . . . 56.740000000000002 108.483 -177.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 51.3 tp -91.06 114.47 27.0 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.234 -1.025 . . . . 58.93 108.234 168.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 55.4 mt -103.08 115.75 45.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 108.058 -1.09 . . . . 58.299999999999997 108.058 -173.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -105.23 110.39 22.75 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 107.348 -1.352 . . . . 57.619999999999997 107.348 -176.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 46.9 t -119.45 109.42 15.72 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.387 -0.597 . . . . 66.329999999999998 109.387 -174.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 15.9 m -128.13 -176.99 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 108.392 -0.966 . . . . 66.0 108.392 175.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 69.2 tt0 -60.08 -42.14 93.94 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.846 -0.615 . . . . 78.849999999999994 112.258 -167.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -119.12 21.87 12.12 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.747 0.647 . . . . 53.020000000000003 112.747 -177.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -149.47 145.16 26.75 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 118.091 0.405 . . . . 67.719999999999999 109.962 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ARG . . . . . 0.714 ' NH1' ' OD2' ' B' ' 85' ' ' ASP . 44.4 ttt-85 -135.84 110.6 8.7 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 106.432 -1.692 . . . . 89.739999999999995 106.432 162.039 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 24.9 mm -118.79 139.99 44.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 108.463 -0.94 . . . . 55.310000000000002 108.463 -172.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 49.9 m80 -114.5 116.06 28.24 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.593 -0.892 . . . . 78.609999999999999 108.593 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -101.14 106.73 46.63 Favored Pre-proline 0 C--O 1.241 0.644 0 N-CA-C 109.113 -0.699 . . . . 67.189999999999998 109.113 177.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -90.76 126.71 1.21 Allowed 'Trans proline' 0 C--O 1.234 0.288 0 CA-C-N 119.39 0.818 . . . . 64.200000000000003 114.209 -175.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 70.2 mt -111.57 114.87 52.21 Favored Pre-proline 0 C--O 1.24 0.584 0 N-CA-C 109.592 -0.522 . . . . 60.630000000000003 109.592 176.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -79.68 130.43 8.74 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 120.586 0.857 . . . . 61.420000000000002 111.408 -178.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 23.3 mt -118.86 100.47 50.86 Favored Pre-proline 0 C--O 1.243 0.745 0 CA-C-N 116.087 -0.506 . . . . 67.280000000000001 109.97 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -58.88 147.3 89.88 Favored 'Trans proline' 0 C--O 1.233 0.236 0 CA-C-O 121.64 0.6 . . . . 69.930000000000007 112.339 175.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' TYR . . . . . 0.503 ' OH ' ' OD1' ' A' ' 40' ' ' ASP . 34.3 t80 -70.21 142.37 52.41 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.236 -0.893 . . . . 76.209999999999994 110.521 177.351 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 83.609999999999999 111.45 -179.581 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.009 -0.08 . . . . 127.77 112.263 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -83.11 107.45 15.69 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 109.009 -0.737 . . . . 151.59 109.009 179.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.56 165.02 41.13 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-O 122.512 1.062 . . . . 125.73999999999999 111.64 173.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -117.06 136.21 53.15 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.187 -1.042 . . . . 87.890000000000001 108.187 179.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -136.74 123.36 21.02 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 109.387 -0.597 . . . . 111.16 109.387 -173.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 15.3 t -136.15 153.41 31.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 109.203 -0.665 . . . . 96.939999999999998 109.203 -176.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -88.24 129.94 35.22 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.331 -0.989 . . . . 92.700000000000003 108.331 167.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -138.17 136.27 36.47 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.961 -0.755 . . . . 71.629999999999995 108.961 -174.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 95.3 t -94.32 119.16 41.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 108.714 -0.847 . . . . 62.039999999999999 108.714 -172.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -115.36 110.3 19.16 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 107.923 -1.14 . . . . 62.229999999999997 107.923 175.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ARG . . . . . . . . . . . . . 86.3 mtt180 51.95 47.99 23.65 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.973 0.892 . . . . 67.459999999999994 111.803 178.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 89.98 -17.08 55.19 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 115.175 0.83 . . . . 77.390000000000001 115.175 175.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 59.5 t -102.27 118.43 49.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 118.156 0.978 . . . . 68.5 108.663 -174.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -70.82 125.65 27.43 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.53 -0.544 . . . . 87.459999999999994 109.53 176.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -113.89 156.45 23.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.512 0.672 . . . . 62.049999999999997 110.268 179.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -95.78 123.61 39.43 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.225 -1.028 . . . . 57.5 108.225 168.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 62.9 t -117.59 133.27 64.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 108.552 -0.907 . . . . 65.810000000000002 108.552 -178.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 68.7 mtm-85 -122.86 127.31 48.85 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 108.825 -0.805 . . . . 74.310000000000002 108.825 177.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 26.0 m -120.87 136.86 56.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 109.084 -0.709 . . . . 79.530000000000001 109.084 175.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' MSE . . . . . . . . . . . . . 28.9 tpp -143.97 118.36 9.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.569 -0.741 . . . . 108.43000000000001 109.527 -179.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.0 p -119.92 117.77 54.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 107.987 -1.116 . . . . 84.959999999999994 107.987 179.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 30.3 p -135.75 114.71 12.16 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 108.065 -1.087 . . . . 92.0 108.065 -177.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.55 -116.17 8.42 Favored Glycine 0 C--O 1.237 0.298 0 C-N-CA 120.88 -0.676 . . . . 74.659999999999997 111.473 -175.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . . . -114.94 30.41 7.37 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 122.126 -0.632 . . . . 82.379999999999995 112.41 -176.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 56.1 t -132.76 136.78 55.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 108.575 -0.898 . . . . 75.859999999999999 108.575 179.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 5.6 tp -114.65 123.91 50.49 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.734 -0.839 . . . . 69.159999999999997 108.734 177.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -110.98 134.18 52.8 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.923 -0.399 . . . . 114.77 109.923 178.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 15.4 tp -138.47 129.06 26.31 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.058 -0.719 . . . . 90.099999999999994 109.058 -172.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' GLU . . . . . 0.481 ' OE2' ' NH1' ' B' ' 43' ' ' ARG . 91.2 mt-10 -135.1 130.55 35.7 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 122.903 0.481 . . . . 93.409999999999997 110.153 -179.881 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' VAL . . . . . . . . . . . . . 94.3 t -116.73 132.93 64.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 107.693 -1.225 . . . . 65.680000000000007 107.693 171.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -134.03 129.9 36.77 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.603 0.239 . . . . 82.480000000000004 110.862 -175.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -92.18 108.15 19.74 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 106.924 -1.51 . . . . 85.739999999999995 106.924 167.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ARG . . . . . . . . . . . . . 71.1 mtt-85 -65.03 -34.23 77.94 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.415 -0.514 . . . . 96.260000000000005 111.825 -174.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' MSE . . . . . . . . . . . . . 26.2 ttp -66.7 -39.57 88.14 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.677 0.621 . . . . 130.38999999999999 112.677 -173.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 44.3 p -102.52 -3.67 26.47 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.849 0.685 . . . . 81.150000000000006 112.849 179.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . 62.07 15.97 7.82 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.505 1.122 . . . . 84.719999999999999 112.543 -177.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -70.03 134.79 48.64 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.403 -0.591 . . . . 84.010000000000005 109.403 174.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -132.69 136.63 46.55 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.546 -0.539 . . . . 91.909999999999997 109.546 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' TRP . . . . . . . . . . . . . 24.5 m-90 -122.06 134.12 54.78 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.409 -0.96 . . . . 72.930000000000007 108.409 173.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ARG . . . . . 0.481 ' NH1' ' OE2' ' B' ' 32' ' ' GLU . 34.2 ttt85 -133.83 135.38 43.73 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.442 -0.345 . . . . 82.159999999999997 110.298 -171.686 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . -129.75 141.96 13.15 Favored Glycine 0 CA--C 1.502 -0.73 0 N-CA-C 111.825 -0.51 . . . . 61.149999999999999 111.825 173.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . . . -125.14 127.21 46.5 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 107.909 -1.145 . . . . 66.370000000000005 107.909 175.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -134.64 133.82 40.51 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 110.059 -0.348 . . . . 65.769999999999996 110.059 -172.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -88.49 159.56 17.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.455 0.645 . . . . 75.939999999999998 109.809 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.57 -39.55 84.43 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.451 -0.795 . . . . 70.159999999999997 111.607 -175.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.04 -44.52 97.18 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 120.329 -0.938 . . . . 65.969999999999999 112.399 177.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -61.94 -45.89 91.7 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.532 -0.467 . . . . 67.400000000000006 111.08 178.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' ILE . . . . . . . . . . . . . 27.7 mm -60.36 -44.4 95.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 121.099 0.476 . . . . 58.920000000000002 110.578 -177.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -71.42 -37.89 71.44 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 119.963 -0.695 . . . . 88.730000000000004 111.356 -177.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -58.45 -37.62 75.82 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 120.037 -0.665 . . . . 91.689999999999998 110.908 171.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 6.7 tt -62.03 -50.37 72.29 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.74 0.305 . . . . 65.879999999999995 110.704 179.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 68.7 p -61.21 -34.22 74.73 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.577 -0.449 . . . . 62.030000000000001 111.465 179.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -62.06 -38.86 90.37 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.881 -0.328 . . . . 86.530000000000001 111.416 176.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . . . -66.78 -27.99 68.03 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.488 -0.485 . . . . 65.590000000000003 111.806 -177.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 15.1 p -77.68 -6.85 55.3 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 112.858 0.688 . . . . 62.869999999999997 112.858 175.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.87 6.45 85.51 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 115.426 0.93 . . . . 57.619999999999997 115.426 -175.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ASN . . . . . 0.6 ' OD1' ' NZ ' ' B' ' 62' ' ' LYS . 6.5 t-20 -132.81 79.31 1.84 Allowed 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 107.377 -1.342 . . . . 64.400000000000006 107.377 -177.719 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -63.6 147.59 51.11 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.724 0.773 . . . . 58.799999999999997 111.485 -170.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' LYS . . . . . 0.6 ' NZ ' ' OD1' ' B' ' 60' ' ' ASN . 45.2 mmtm -141.1 134.86 30.3 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.175 -0.92 . . . . 68.650000000000006 108.721 174.688 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . . . -64.99 153.18 41.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.31 0.576 . . . . 72.180000000000007 110.234 171.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -55.52 -44.66 76.85 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.606 -0.725 . . . . 71.760000000000005 111.475 -176.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -69.06 -33.11 73.04 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.259 -0.576 . . . . 102.52 111.334 -179.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ILE . . . . . . . . . . . . . 42.9 mm -68.74 -44.24 82.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 C-N-CA 120.679 -0.409 . . . . 67.859999999999999 110.565 177.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -57.98 -46.31 85.37 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 122.103 -0.373 . . . . 61.210000000000001 111.469 178.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' CYS . . . . . . . . . . . . . 88.0 m -61.26 -39.61 91.02 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 122.158 -0.339 . . . . 68.359999999999999 111.728 -179.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -66.36 -36.34 82.64 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 119.878 -0.729 . . . . 82.700000000000003 111.247 178.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' MSE . . . . . . . . . . . . . 79.4 mtp -64.37 -38.88 92.59 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.072 0.463 . . . . 65.760000000000005 110.024 174.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 15.7 tp -65.22 -44.25 88.86 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.672 -0.695 . . . . 71.700000000000003 111.225 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . . . -68.0 -37.91 82.0 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.624 -0.43 . . . . 78.349999999999994 111.388 178.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 21.9 m -63.24 -36.72 84.59 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.608 -0.437 . . . . 81.370000000000005 111.455 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.61 -42.4 98.21 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.376 -0.53 . . . . 64.280000000000001 111.376 175.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 17.5 mt -66.64 -42.56 86.53 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.556 -0.458 . . . . 84.909999999999997 111.114 -176.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 81.5 p -84.12 -3.28 58.0 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.621 0.6 . . . . 79.090000000000003 112.621 176.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 57.33 40.64 27.5 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.259 0.552 . . . . 82.060000000000002 111.346 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 84.4 p -104.25 14.5 30.2 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 112.988 0.736 . . . . 90.560000000000002 112.988 -176.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' SER . . . . . . . . . . . . . 10.5 t -146.16 139.45 25.92 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.383 -0.969 . . . . 85.700000000000003 108.383 -179.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . . . -85.07 -8.66 58.58 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 113.485 0.92 . . . . 69.569999999999993 113.485 -172.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 57.6 p -107.29 1.18 23.66 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 113.509 0.929 . . . . 59.979999999999997 113.509 -174.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' VAL . . . . . . . . . . . . . 39.2 t -134.07 132.74 56.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 108.883 -0.784 . . . . 65.480000000000004 108.883 -172.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -146.21 163.29 35.88 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 124.651 1.22 . . . . 67.530000000000001 108.959 -175.221 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 84.6 mt -120.15 152.66 37.32 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 124.756 1.285 . . . . 59.060000000000002 111.559 -175.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ASP . . . . . 0.714 ' OD2' ' NH1' ' A' ' 130' ' ' ARG . 41.9 t0 -147.21 160.54 42.34 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.127 -0.942 . . . . 65.269999999999996 108.588 167.269 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 25.0 tp -123.37 118.91 28.57 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 108.506 -0.924 . . . . 62.009999999999998 108.506 -177.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' LEU . . . . . . . . . . . . . 18.7 mt -105.04 141.97 35.67 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.392 -0.595 . . . . 76.25 109.392 -173.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 63.2 p -92.72 179.59 5.44 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 122.149 0.976 . . . . 74.5 110.874 172.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -65.24 -30.42 71.31 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.365 -0.834 . . . . 98.769999999999996 111.373 172.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' THR . . . . . . . . . . . . . 94.7 m -65.36 -41.05 94.25 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 121.017 -0.273 . . . . 90.060000000000002 111.493 -179.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -66.78 -35.93 81.23 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.334 -0.547 . . . . 76.980000000000004 112.158 -173.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 2.2 mp -83.77 -23.5 31.49 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.616 -0.833 . . . . 107.69 112.726 -177.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -71.15 -27.17 63.37 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.83 -0.748 . . . . 112.95 111.294 173.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 43.1 t -68.07 -38.88 82.89 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.164 -0.615 . . . . 89.069999999999993 110.643 170.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' LEU . . . . . 0.427 ' O ' ' NH2' ' A' ' 96' ' ' ARG . 96.2 mt -70.46 -32.91 70.66 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.533 -0.467 . . . . 91.930000000000007 111.447 173.181 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . . . -74.42 -30.29 61.86 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 112.385 0.513 . . . . 105.48 112.385 -178.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ASN . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.2 0 C-N-CA 123.046 0.538 . . . . 114.93000000000001 111.788 -179.855 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.877 0.37 . . . . 97.870000000000005 111.431 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 7.4 p -99.88 0.17 40.83 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.216 0.821 . . . . 81.709999999999994 113.216 178.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 7.9 ttmt -70.69 151.39 44.97 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.669 0.747 . . . . 86.319999999999993 111.208 -174.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' ARG . . . . . . . . . . . . . 68.7 mmt-85 -117.47 157.8 25.64 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.437 -0.801 . . . . 81.010000000000005 110.204 171.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -129.72 110.63 11.92 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.076 -0.965 . . . . 90.0 108.618 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 30.8 tp -79.58 122.04 26.01 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.551 -0.537 . . . . 62.0 109.551 174.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' ILE . . . . . . . . . . . . . 35.0 mm -101.99 120.8 52.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 108.943 -0.762 . . . . 63.43 108.943 -177.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 59.1 tp -90.93 114.71 27.26 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.746 -1.205 . . . . 63.640000000000001 107.746 169.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 57.4 mt -104.04 114.21 43.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 108.341 -0.985 . . . . 69.689999999999998 108.341 -173.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -108.02 111.21 23.16 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.2 1.0 . . . . 59.740000000000002 108.769 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 48.3 t -119.99 110.38 16.62 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.493 -0.558 . . . . 63.009999999999998 109.493 -174.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 15.2 m -127.16 -176.98 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 108.465 -0.939 . . . . 59.549999999999997 108.465 174.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -59.05 -41.63 88.35 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.657 -0.701 . . . . 79.219999999999999 112.06 -167.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -119.68 21.72 11.91 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.662 0.616 . . . . 52.909999999999997 112.662 -177.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -149.1 144.57 26.74 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.478 0.581 . . . . 64.150000000000006 110.162 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' ARG . . . . . 0.5 ' NH1' ' O ' ' B' ' 201' ' ' HOH . 23.5 ttt85 -135.55 110.51 8.81 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 106.922 -1.51 . . . . 79.180000000000007 106.922 164.233 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 24.6 mm -119.48 139.88 45.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 108.847 -0.797 . . . . 46.170000000000002 108.847 -172.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -114.91 116.32 28.33 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.567 -0.901 . . . . 61.450000000000003 108.567 176.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -100.74 107.06 47.26 Favored Pre-proline 0 C--O 1.24 0.58 0 N-CA-C 109.33 -0.619 . . . . 58.939999999999998 109.33 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -91.36 126.16 1.0 Allowed 'Trans proline' 0 C--O 1.234 0.323 0 CA-C-N 119.434 0.834 . . . . 60.909999999999997 113.612 -176.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' LEU . . . . . . . . . . . . . 68.1 mt -112.31 115.16 50.11 Favored Pre-proline 0 C--O 1.239 0.536 0 N-CA-C 109.372 -0.603 . . . . 59.869999999999997 109.372 175.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -79.11 130.04 9.13 Favored 'Trans proline' 0 N--CA 1.473 0.28 0 CA-C-N 119.452 0.84 . . . . 67.319999999999993 111.648 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 22.0 mt -118.59 99.04 51.48 Favored Pre-proline 0 C--O 1.246 0.907 0 CA-C-N 115.978 -0.555 . . . . 74.569999999999993 109.926 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -59.24 148.36 86.46 Favored 'Trans proline' 0 C--N 1.333 -0.28 0 C-N-CA 120.614 0.876 . . . . 74.730000000000004 112.535 175.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -68.59 121.8 17.17 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.022 -0.99 . . . . 91.450000000000003 109.617 176.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 . . . . . 0 N--CA 1.463 0.201 0 C-N-CA 123.015 0.526 . . . . 100.36 111.301 -175.477 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' PRO . . . . . 0.581 ' N ' ' CE ' ' C' ' 23' ' ' MSE . 78.4 Cg_exo . . . . . 0 C--O 1.232 0.184 0 N-CA-C 112.745 0.248 . . . . 130.88999999999999 112.745 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' ALA . . . . . . . . . . . . . . . -91.67 91.4 7.98 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 108.621 -0.881 . . . . 116.11 108.621 -176.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' GLY . . . . . . . . . . . . . . . -97.57 164.95 22.18 Favored Glycine 0 N--CA 1.444 -0.803 0 CA-C-N 115.875 -0.602 . . . . 98.680000000000007 112.676 178.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' LEU . . . . . . . . . . . . . 25.6 tp -119.07 138.71 52.68 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 123.091 0.556 . . . . 75.560000000000002 110.258 179.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 -136.4 122.97 20.92 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.443 -0.947 . . . . 108.37 108.443 -178.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' VAL . . . . . . . . . . . . . 12.9 t -135.14 150.33 29.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 108.568 -0.901 . . . . 83.829999999999998 108.568 -177.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -90.25 128.98 36.54 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.878 -0.786 . . . . 121.40000000000001 108.878 168.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -139.6 135.36 33.25 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.759 -0.459 . . . . 82.519999999999996 109.759 -174.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' VAL . . . . . . . . . . . . . 91.5 t -95.99 120.86 45.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 108.188 -1.041 . . . . 91.569999999999993 108.188 -174.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -113.16 110.62 20.72 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.464 -0.939 . . . . 89.920000000000002 108.464 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' ARG . . . . . . . . . . . . . 61.8 mtt-85 50.96 47.02 25.55 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.718 0.771 . . . . 98.319999999999993 111.485 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.13 -17.35 54.04 Favored Glycine 0 N--CA 1.443 -0.887 0 CA-C-O 119.29 -0.728 . . . . 98.599999999999994 114.896 176.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 49.0 t -102.39 115.75 44.84 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 N-CA-C 107.648 -1.241 . . . . 90.959999999999994 107.648 -175.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -72.21 124.18 24.49 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.389 -0.368 . . . . 104.53 110.629 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -116.31 155.29 28.67 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.539 0.685 . . . . 83.340000000000003 110.502 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.95 125.89 41.7 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.069 -0.969 . . . . 80.989999999999995 108.794 167.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' VAL . . . . . . . . . . . . . 62.0 t -117.89 132.81 66.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 108.598 -0.89 . . . . 72.430000000000007 108.598 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' ARG . . . . . 0.501 ' NH2' ' OE1' ' C' ' 34' ' ' GLU . 60.2 mtm-85 -124.02 127.06 47.33 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.226 0.61 . . . . 89.140000000000001 109.398 177.492 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 13.6 m -122.39 137.39 56.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 N-CA-C 106.998 -1.482 . . . . 71.890000000000001 106.998 178.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' MSE . . . . . 0.581 ' CE ' ' N ' ' C' ' 4' ' ' PRO . 2.8 tpt -137.98 126.44 23.38 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 107.408 -1.33 . . . . 158.55000000000001 107.408 177.44 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' VAL . . . . . 0.633 ' N ' ' O ' ' C' ' 201' ' ' HOH . 57.3 t -110.24 124.24 66.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 106.459 -1.682 . . . . 68.430000000000007 106.459 178.311 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' SER . . . . . . . . . . . . . . . -138.25 111.87 8.22 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.632 -1.247 . . . . 94.849999999999994 107.632 -178.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.26 -116.66 9.62 Favored Glycine 0 C--O 1.237 0.31 0 N-CA-C 111.213 -0.755 . . . . 110.34999999999999 111.213 -176.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' GLN . . . . . . . . . . . . . 95.2 mm-40 -115.6 30.66 7.21 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 122.909 0.484 . . . . 93.799999999999997 111.554 -177.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' VAL . . . . . . . . . . . . . 2.5 t -132.94 137.26 54.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 N-CA-C 108.45 -0.945 . . . . 69.260000000000005 108.45 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 6.6 tp -113.6 124.64 52.82 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 107.132 -1.433 . . . . 65.810000000000002 107.132 179.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -110.86 135.61 51.15 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 124.859 1.35 . . . . 96.629999999999995 109.078 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' LEU . . . . . . . . . . . . . 25.2 tp -137.64 130.86 30.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.928 -0.578 . . . . 74.25 109.615 -170.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -132.71 130.45 40.04 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.389 -0.597 . . . . 82.019999999999996 109.389 178.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' VAL . . . . . . . . . . . . . 87.4 t -115.88 134.22 59.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 108.044 -1.095 . . . . 72.510000000000005 108.044 173.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' GLU . . . . . 0.501 ' OE1' ' NH2' ' C' ' 21' ' ' ARG . 34.1 tt0 -132.87 129.89 39.02 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 109.383 -0.599 . . . . 92.390000000000001 109.383 -175.678 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -91.18 108.28 19.77 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 107.414 -1.328 . . . . 91.900000000000006 107.414 170.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' ARG . . . . . . . . . . . . . . . -64.6 -35.09 79.89 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.428 -0.509 . . . . 112.34 111.357 -175.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' MSE . . . . . . . . . . . . . 1.8 ttt -63.97 -36.61 84.55 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 117.974 -1.012 . . . . 172.05000000000001 111.514 -178.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' THR . . . . . . . . . . . . . 37.5 p -116.88 -4.66 11.54 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 124.685 1.241 . . . . 106.11 114.046 -172.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' ALA . . . . . . . . . . . . . . . 61.54 15.03 6.4 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.345 1.458 . . . . 87.780000000000001 112.874 -176.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -71.61 137.02 47.63 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.971 -0.455 . . . . 83.159999999999997 110.849 174.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -130.9 137.32 49.27 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.057 0.456 . . . . 88.060000000000002 111.33 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' TRP . . . . . . . . . . . . . 26.0 m-90 -123.77 140.79 52.64 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.604 -0.888 . . . . 65.319999999999993 108.604 171.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' ARG . . . . . . . . . . . . . 29.9 ttt-85 -140.32 140.35 35.62 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.589 0.233 . . . . 88.310000000000002 110.537 -174.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' GLY . . . . . . . . . . . . . . . -140.25 145.03 15.69 Favored Glycine 0 N--CA 1.452 -0.3 0 N-CA-C 111.426 -0.669 . . . . 70.099999999999994 111.426 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -123.57 126.78 47.26 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 123.603 0.761 . . . . 100.81999999999999 109.369 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -134.89 128.66 33.04 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.699 -0.482 . . . . 73.590000000000003 109.699 -174.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 p30 -92.67 166.12 12.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.652 0.739 . . . . 86.760000000000005 110.501 174.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.29 -38.53 71.34 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.521 -0.763 . . . . 77.879999999999995 111.687 -174.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.72 -44.7 97.62 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 119.95 -1.119 . . . . 70.209999999999994 112.937 177.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -64.19 -47.57 79.27 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 122.249 -0.56 . . . . 67.310000000000002 111.28 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' ILE . . . . . . . . . . . . . 26.1 mm -60.94 -44.73 98.63 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-O 120.868 0.366 . . . . 65.930000000000007 110.987 -177.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -70.47 -38.14 74.36 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.356 -0.538 . . . . 74.769999999999996 111.424 -176.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -59.14 -38.97 80.95 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.715 -0.394 . . . . 101.89 111.001 171.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' LEU . . . . . . . . . . . . . 3.6 tt -63.56 -52.82 59.42 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 120.693 0.282 . . . . 66.450000000000003 111.504 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' THR . . . . . . . . . . . . . 60.4 p -62.73 -33.57 75.4 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.569 -0.453 . . . . 55.719999999999999 111.698 -179.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' HIS . . . . . . . . . . . . . 39.9 t-80 -61.0 -38.32 85.63 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 111.852 0.316 . . . . 88.280000000000001 111.852 176.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' LYS . . . . . . . . . . . . . . . -65.2 -27.25 68.56 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.182 -0.607 . . . . 64.849999999999994 111.975 -176.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' THR . . . . . . . . . . . . . 14.1 p -77.1 -6.87 54.51 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 113.112 0.782 . . . . 57.399999999999999 113.112 175.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.59 6.02 86.49 Favored Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 115.307 0.883 . . . . 63.82 115.307 -174.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' ASN . . . . . 0.406 ' OD1' ' NZ ' ' C' ' 62' ' ' LYS . 7.0 t-20 -132.54 77.65 1.76 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 106.723 -1.584 . . . . 59.369999999999997 106.723 -178.82 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -65.78 149.12 50.67 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.481 -0.782 . . . . 61.880000000000003 111.455 -170.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' LYS . . . . . 0.406 ' NZ ' ' OD1' ' C' ' 60' ' ' ASN . 43.9 mmtm -139.69 136.5 34.31 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.284 -0.871 . . . . 61.57 109.541 175.233 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -64.32 151.68 43.19 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.966 -0.561 . . . . 67.719999999999999 109.525 170.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -57.21 -43.62 82.96 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.85 -0.614 . . . . 54.57 111.831 -175.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -68.99 -34.05 74.66 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.327 -0.549 . . . . 69.659999999999997 112.0 -177.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' ILE . . . . . . . . . . . . . 18.8 mt -69.76 -42.43 80.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 C-N-CA 120.237 -0.585 . . . . 60.729999999999997 110.464 176.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 67' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -56.37 -46.11 80.19 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 122.01 -0.431 . . . . 56.979999999999997 111.282 178.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 68' ' ' CYS . . . . . . . . . . . . . 88.0 m -61.13 -39.67 90.92 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.617 -0.433 . . . . 69.430000000000007 111.351 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 69' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -66.98 -40.82 87.51 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.517 -0.473 . . . . 58.340000000000003 111.411 178.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 70' ' ' MSE . . . . . . . . . . . . . 81.5 mtp -59.21 -41.02 87.6 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.174 0.511 . . . . 67.840000000000003 110.381 175.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 16.1 tp -64.92 -42.96 94.25 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.214 -0.903 . . . . 68.560000000000002 111.311 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 72' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -67.3 -39.41 85.96 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.349 -0.541 . . . . 105.38 111.002 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 73' ' ' SER . . . . . . . . . . . . . 20.4 m -63.06 -37.0 85.44 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 120.763 -0.375 . . . . 67.090000000000003 110.96 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.17 -41.65 97.04 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.832 -0.347 . . . . 61.32 111.373 175.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 12.8 mt -66.84 -43.73 82.92 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.174 -0.61 . . . . 78.150000000000006 111.747 -177.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 76' ' ' THR . . . . . . . . . . . . . 82.0 p -83.04 -3.23 57.04 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.474 0.546 . . . . 78.430000000000007 112.474 179.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 77' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 57.0 39.12 29.58 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.701 0.763 . . . . 94.540000000000006 110.551 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 78' ' ' SER . . . . . . . . . . . . . 81.8 p -104.83 15.38 27.94 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 123.539 0.736 . . . . 84.870000000000005 112.077 -177.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 79' ' ' SER . . . . . . . . . . . . . 12.5 t -144.72 138.82 27.49 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.015 -0.735 . . . . 83.890000000000001 109.015 -177.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . . . -85.66 -9.42 57.25 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.535 0.939 . . . . 74.200000000000003 113.535 -172.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 81' ' ' SER . . . . . . . . . . . . . 59.9 p -107.77 -7.21 16.41 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 114.093 1.146 . . . . 62.82 114.093 -174.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 8.7 m -127.92 137.14 58.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 CA-C-N 119.054 0.843 . . . . 60.950000000000003 109.804 -176.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.09 173.14 11.77 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 108.485 -0.931 . . . . 63.369999999999997 108.485 174.16 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 84' ' ' LEU . . . . . . . . . . . . . 86.1 mt -121.72 152.09 39.79 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.858 -0.61 . . . . 71.989999999999995 110.63 -176.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 85' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -147.41 156.81 43.22 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 108.573 -0.899 . . . . 75.420000000000002 108.573 169.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 23.7 tp -126.14 113.81 17.54 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.99 -0.744 . . . . 67.040000000000006 108.99 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 87' ' ' LEU . . . . . . . . . . . . . 10.3 mp -111.99 148.73 33.18 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 123.561 0.744 . . . . 66.450000000000003 111.799 -174.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 88' ' ' THR . . . . . . . . . . . . . 72.8 p -88.97 175.0 7.6 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.818 -1.179 . . . . 65.079999999999998 107.818 165.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 89' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -65.08 -33.93 77.2 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 118.353 -1.339 . . . . 80.340000000000003 111.647 -178.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 90' ' ' THR . . . . . . . . . . . . . 96.0 m -62.23 -43.12 99.56 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.28 -0.568 . . . . 100.75 110.993 175.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 91' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -67.89 -33.4 74.65 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 122.27 -0.269 . . . . 94.469999999999999 111.337 -178.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 92' ' ' LEU . . . . . 0.439 ' CD1' ' C ' ' C' ' 92' ' ' LEU . 2.1 tm? -66.29 -40.85 90.32 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 117.765 -1.112 . . . . 97.819999999999993 111.491 -178.31 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 93' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' C' ' 97' ' ' ASN . 6.8 mm-40 -75.83 -30.56 59.01 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 125.02 1.45 . . . . 121.47 108.801 -177.77 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 94' ' ' SER . . . . . . . . . . . . . 47.3 m -63.54 -43.09 98.1 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 118.181 -1.408 . . . . 96.329999999999998 108.347 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.22 -42.34 96.63 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 107.325 -1.361 . . . . 115.31999999999999 107.325 175.311 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 96' ' ' ARG . . . . . . . . . . . . . . . -63.78 -38.62 91.79 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 118.041 -0.981 . . . . 120.77 109.863 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 97' ' ' ASN . . . . . 0.402 ' N ' ' O ' ' C' ' 93' ' ' GLU . . . . . . . . 0 N--CA 1.486 1.344 0 O-C-N 125.404 1.69 . . . . 120.59999999999999 108.741 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 111' ' ' SER . . . . . . . . . . . . . 6.4 p . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 118.593 -0.718 . . . . 129.38 109.353 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 112' ' ' ALA . . . . . . . . . . . . . . . -80.28 -7.97 59.27 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 124.754 1.283 . . . . 110.63 112.652 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 113' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -61.82 137.36 58.24 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.106 0.479 . . . . 85.430000000000007 110.639 177.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 114' ' ' LEU . . . . . . . . . . . . . 89.2 mt -85.32 121.65 28.36 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.022 -0.732 . . . . 69.269999999999996 109.022 179.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 115' ' ' ASN . . . . . . . . . . . . . 62.3 t-20 -167.46 104.78 0.52 Allowed 'General case' 0 C--O 1.235 0.309 0 N-CA-C 107.621 -1.252 . . . . 78.680000000000007 107.621 -165.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 116' ' ' SER . . . . . . . . . . . . . 7.4 p -93.65 1.36 56.64 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.346 0.499 . . . . 71.469999999999999 112.346 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 117' ' ' LYS . . . . . . . . . . . . . 16.7 mtmt -69.34 155.93 39.63 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 122.117 0.961 . . . . 66.739999999999995 110.772 -177.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 118' ' ' ARG . . . . . . . . . . . . . 81.6 mmt-85 -115.65 156.59 25.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.991 -1.004 . . . . 69.590000000000003 108.363 169.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 119' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -126.1 110.32 13.39 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.519 -0.919 . . . . 67.180000000000007 108.519 -177.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 120' ' ' LEU . . . . . . . . . . . . . 29.5 tp -78.47 120.26 22.94 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 107.843 -1.169 . . . . 60.579999999999998 107.843 173.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 121' ' ' ILE . . . . . . . . . . . . . 33.2 mm -100.98 118.71 48.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 107.792 -1.188 . . . . 55.899999999999999 107.792 -177.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 122' ' ' LEU . . . . . . . . . . . . . 50.6 tp -89.78 114.31 25.99 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 106.792 -1.558 . . . . 56.609999999999999 106.792 169.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 123' ' ' ILE . . . . . . . . . . . . . 58.7 mt -103.36 114.24 42.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 107.886 -1.153 . . . . 55.75 107.886 -173.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 124' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -106.08 109.77 21.82 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.694 -1.224 . . . . 60.759999999999998 107.694 -177.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 125' ' ' SER . . . . . . . . . . . . . 47.5 t -119.96 109.68 15.81 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.228 -0.656 . . . . 61.210000000000001 109.228 -174.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 126' ' ' VAL . . . . . . . . . . . . . 16.0 m -127.52 -176.68 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 108.337 -0.986 . . . . 63.310000000000002 108.337 175.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 127' ' ' GLU . . . . . . . . . . . . . 69.0 tt0 -59.3 -41.95 90.18 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.761 -0.654 . . . . 96.640000000000001 112.071 -167.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 128' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -119.07 22.88 11.67 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.632 0.604 . . . . 61.43 112.632 -177.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 129' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -148.6 144.48 27.25 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 121.373 0.606 . . . . 82.230000000000004 109.983 178.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 130' ' ' ARG . . . . . . . . . . . . . 10.8 tpp180 -134.84 109.34 8.46 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 106.468 -1.679 . . . . 89.359999999999999 106.468 164.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 131' ' ' ILE . . . . . . . . . . . . . 23.2 mm -122.18 137.98 53.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 N-CA-C 109.433 -0.58 . . . . 57.810000000000002 109.433 -173.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 132' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -115.03 117.32 30.25 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.108 -1.071 . . . . 73.010000000000005 108.108 175.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 133' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -100.04 106.66 42.74 Favored Pre-proline 0 C--O 1.241 0.607 0 N-CA-C 108.563 -0.903 . . . . 63.590000000000003 108.563 177.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -90.15 127.24 1.44 Allowed 'Trans proline' 0 C--N 1.331 -0.368 0 CA-C-N 119.39 0.818 . . . . 60.210000000000001 112.888 -175.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 135' ' ' LEU . . . . . . . . . . . . . 67.9 mt -111.13 113.6 54.35 Favored Pre-proline 0 C--O 1.242 0.662 0 N-CA-C 109.609 -0.515 . . . . 54.460000000000001 109.609 176.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 136' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -78.99 129.68 9.06 Favored 'Trans proline' 0 C--N 1.332 -0.314 0 CA-C-N 119.266 0.774 . . . . 60.049999999999997 110.388 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 137' ' ' LEU . . . . . . . . . . . . . 24.1 mt -118.64 102.39 49.84 Favored Pre-proline 0 C--O 1.243 0.72 0 N-CA-C 109.407 -0.59 . . . . 60.939999999999998 109.407 -179.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 138' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -56.97 146.92 77.52 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 120.25 0.633 . . . . 63.25 112.305 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 139' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -69.83 137.0 51.42 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.025 -0.989 . . . . 77.060000000000002 110.857 179.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 140' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 -110.89 14.95 22.05 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.661 0.615 . . . . 74.700000000000003 112.661 -177.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 141' ' ' GLY . . . . . . . . . . . . . . . 75.96 -147.98 35.73 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.434 -0.889 . . . . 83.989999999999995 111.229 -174.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 142' ' ' LYS . . . . . 0.518 ' NZ ' ' O ' ' C' ' 202' ' ' HOH . 97.1 mttt -124.54 76.75 63.26 Favored Pre-proline 0 C--O 1.242 0.674 0 N-CA-C 108.683 -0.858 . . . . 100.34999999999999 108.683 177.395 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 143' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo . . . . . 0 C--N 1.342 0.231 0 C-N-CA 120.874 1.049 . . . . 112.87 112.49 177.78 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . 0.501 ' O ' ' N ' ' A' ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HOH . . . . . 0.5 ' O ' ' NH1' ' B' ' 130' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 201' ' ' HOH . . . . . 0.633 ' O ' ' N ' ' C' ' 24' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 202' ' ' HOH . . . . . 0.518 ' O ' ' NZ ' ' C' ' 142' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . 0.501 ' N ' ' O ' ' A' ' 201' ' ' HOH . . . . . . . . 0 N--CA 1.452 -0.284 0 N-CA-C 112.965 -0.054 . . . . 115.28 112.965 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 23.4 tp -117.99 136.48 53.49 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 122.866 0.467 . . . . 82.04 109.749 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . . . -139.24 121.37 15.77 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.715 -0.846 . . . . 69.2 108.715 -178.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 20.4 m -136.89 153.01 29.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 N-CA-C 108.72 -0.845 . . . . 69.78 108.72 -178.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -89.69 130.71 35.93 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.746 -0.661 . . . . 87.29 109.479 168.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -138.02 136.16 36.61 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 109.071 -0.714 . . . . 62.75 109.071 -174.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 88.3 t -96.0 119.17 43.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 109.231 -0.655 . . . . 54.75 109.231 -173.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -115.36 111.9 21.55 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.225 -1.028 . . . . 60.11 108.225 176.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? 52.56 47.62 24.31 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.93 0.871 . . . . 61.5 111.629 -179.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 89.62 -16.48 56.33 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 115.384 0.914 . . . . 60.14 115.384 175.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.6 t -102.95 119.83 51.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 118.162 0.981 . . . . 66.52 109.184 -173.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -69.24 125.88 28.07 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.258 -0.428 . . . . 88.81 109.894 175.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 67.7 m80 -115.37 154.89 28.38 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.414 0.626 . . . . 56.9 109.791 177.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -95.31 124.59 39.43 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.873 -0.788 . . . . 68.97 108.873 169.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . 0.41 HG11 HD21 ' A' ' 75' ' ' LEU . 46.4 t -118.49 133.66 64.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.681 -0.859 . . . . 62.24 108.681 -178.838 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.4 mtm-85 -124.93 128.69 49.01 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.804 -0.813 . . . . 89.71 108.804 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . 1.154 HG12 HD12 ' A' ' 31' ' ' LEU . 19.1 m -119.72 138.47 50.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 N-CA-C 109.23 -0.655 . . . . 65.6 109.23 174.91 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' MSE . . . . . 0.58 ' HB3' ' HB2' ' A' ' 30' ' ' GLU . 1.0 OUTLIER -133.64 117.63 17.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.681 -0.691 . . . . 105.06 109.703 176.421 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.6 t -112.46 116.52 52.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 107.414 -1.328 . . . . 78.33 107.414 175.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.7 p -135.66 111.99 9.81 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 107.694 -1.224 . . . . 90.11 107.694 -178.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 64.48 -116.67 9.33 Favored Glycine 0 C--O 1.237 0.288 0 C-N-CA 120.152 -1.023 . . . . 86.79 110.985 -175.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . . . -116.41 31.29 6.82 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 122.219 -0.577 . . . . 91.79 112.413 -176.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.8 p -132.91 138.54 51.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 N-CA-C 109.19 -0.67 . . . . 84.14 109.19 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.0 tp -112.88 124.7 53.21 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 123.256 0.623 . . . . 69.29 109.907 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . 0.58 ' HB2' ' HB3' ' A' ' 23' ' ' MSE . 42.0 mt-10 -110.35 132.07 54.5 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 123.886 0.874 . . . . 114.76 109.072 178.57 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LEU . . . . . 1.154 HD12 HG12 ' A' ' 22' ' ' VAL . 4.0 tp -134.21 138.79 45.36 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 115.158 -0.928 . . . . 69.71 110.714 -178.186 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . . . -137.75 129.47 28.42 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 124.915 1.385 . . . . 66.98 110.493 177.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.7 t -117.41 132.0 68.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 N-CA-C 107.943 -1.132 . . . . 61.41 107.943 173.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . 0.426 ' HB2' ' HG2' ' A' ' 41' ' ' GLN . 18.6 tt0 -135.58 130.28 34.23 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 120.916 -0.313 . . . . 108.45 111.402 -175.032 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -92.54 107.92 19.58 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 107.15 -1.426 . . . . 82.79 107.15 167.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 43.4 mtt180 -65.28 -32.08 73.55 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.623 0.601 . . . . 99.8 112.623 -174.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' MSE . . . . . . . . . . . . . 42.4 ttm -63.06 -41.01 99.37 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.276 0.473 . . . . 83.84 112.276 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 43.6 p -105.6 -2.84 23.01 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.184 0.809 . . . . 76.45 113.184 -177.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 62.16 16.48 8.36 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 124.275 1.03 . . . . 76.11 112.439 -176.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -69.64 135.85 50.43 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 121.849 -0.532 . . . . 82.42 109.927 175.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . 0.453 ' OE1' ' NH1' ' A' ' 43' ' ' ARG . 33.2 mt-30 -131.73 138.58 48.69 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.197 -0.456 . . . . 87.16 109.892 177.852 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 23.9 m-90 -123.09 124.8 43.91 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.268 -1.012 . . . . 63.75 108.268 172.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ARG . . . . . 0.453 ' NH1' ' OE1' ' A' ' 41' ' ' GLN . 1.0 OUTLIER -129.76 141.6 50.84 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 119.309 -0.957 . . . . 116.88 110.238 -174.648 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -134.79 144.16 16.05 Favored Glycine 0 N--CA 1.45 -0.411 0 O-C-N 124.92 1.387 . . . . 76.81 113.546 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -123.87 125.68 45.08 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.932 -0.766 . . . . 102.77 108.932 176.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -135.73 128.38 30.81 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.541 -0.54 . . . . 71.89 109.541 -174.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 p30 -92.44 166.02 12.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.817 0.817 . . . . 90.76 110.591 174.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . 0.416 ' HA ' ' CD1' ' A' ' 64' ' ' PHE . . . -57.22 -38.92 74.48 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.186 -0.916 . . . . 76.03 111.815 -175.58 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.26 -44.75 97.16 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 120.107 -1.044 . . . . 85.01 113.06 177.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -62.73 -46.07 89.78 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 122.331 -0.511 . . . . 77.2 111.343 179.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 27.8 mm -59.56 -43.32 90.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-O 120.992 0.425 . . . . 66.88 110.523 -177.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -70.61 -37.26 73.83 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.61 -0.436 . . . . 71.66 111.437 -176.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -58.81 -39.65 81.77 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.025 -0.67 . . . . 114.26 110.897 169.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . 0.424 HD11 ' O ' ' A' ' 134' ' ' PRO . 6.7 tt -64.89 -53.73 41.97 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 120.79 0.329 . . . . 74.76 111.397 -179.682 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.7 p -64.06 -35.76 81.8 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.665 -0.414 . . . . 67.83 111.758 -178.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -63.86 -37.2 86.51 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.332 -0.547 . . . . 90.19 110.796 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . . . -65.93 -26.64 67.68 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.091 0.404 . . . . 63.74 112.091 -177.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' THR . . . . . 0.612 HG22 ' OG ' ' B' ' 94' ' ' SER . 14.0 p -76.06 -5.89 48.56 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.968 0.729 . . . . 61.59 112.968 176.247 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.1 5.48 85.1 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-O 119.263 -0.743 . . . . 71.35 114.576 -174.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASN . . . . . 0.432 ' OD1' ' NZ ' ' A' ' 62' ' ' LYS . 7.0 t-20 -133.23 77.47 1.73 Allowed 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.073 -1.455 . . . . 66.44 107.073 -178.43 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -65.02 147.62 53.14 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.75 0.786 . . . . 74.24 111.879 -170.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LYS . . . . . 0.432 ' NZ ' ' OD1' ' A' ' 60' ' ' ASN . 44.7 mmtm -141.18 136.78 32.15 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.235 -0.893 . . . . 60.7 109.448 175.282 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 56.9 mm-40 -64.69 152.05 43.39 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.383 0.611 . . . . 70.12 109.956 171.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PHE . . . . . 0.416 ' CD1' ' HA ' ' A' ' 48' ' ' ALA . 60.3 t80 -56.95 -44.57 82.69 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.732 -0.667 . . . . 70.05 111.778 -176.808 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -68.42 -32.85 73.18 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.783 -0.767 . . . . 72.66 111.432 -178.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.3 mt -69.51 -43.55 80.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 120.415 -0.514 . . . . 61.19 110.417 176.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -57.06 -45.42 83.26 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 121.952 -0.467 . . . . 57.84 111.148 177.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 85.7 m -61.48 -39.23 90.17 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.797 -0.361 . . . . 67.54 111.512 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 7.7 m80 -66.24 -42.16 89.02 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.034 -0.666 . . . . 62.91 111.647 177.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' MSE . . . . . . . . . . . . . 77.5 mtp -59.3 -41.62 89.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.117 0.484 . . . . 59.66 109.764 176.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 15.8 tp -60.32 -44.02 95.85 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.232 -0.895 . . . . 68.68 111.345 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -68.61 -38.95 81.01 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.154 -0.618 . . . . 85.63 111.442 178.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 28.5 m -63.56 -38.28 90.54 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.472 -0.491 . . . . 62.96 111.32 179.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.91 -41.06 97.78 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.579 -0.449 . . . . 53.51 111.042 174.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . 0.41 HD21 HG11 ' A' ' 20' ' ' VAL . 15.7 mt -67.15 -44.21 80.37 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.874 -0.33 . . . . 64.35 111.515 -176.825 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 80.5 p -84.2 -2.64 57.24 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 112.582 0.586 . . . . 68.19 112.582 178.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 58.02 39.24 26.57 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.238 0.615 . . . . 87.63 111.535 177.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 84.8 p -105.31 15.22 27.67 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.812 0.671 . . . . 76.87 112.812 -177.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 5.5 t -145.01 139.45 27.47 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 122.901 0.48 . . . . 94.42 109.794 -177.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . . . -85.53 -9.08 57.89 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.971 1.1 . . . . 71.93 113.971 -171.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 60.2 p -107.55 -12.4 15.28 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 114.054 1.131 . . . . 58.72 114.054 -174.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 8.6 m -118.35 137.84 50.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-N 118.849 0.75 . . . . 58.86 109.285 -175.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . 0.558 HG22 ' HB ' ' A' ' 123' ' ' ILE . 1.3 t -146.89 170.83 16.23 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.385 -0.969 . . . . 61.07 108.385 179.885 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 88.1 mt -123.26 151.73 42.04 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.548 0.69 . . . . 57.24 111.722 -176.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -146.79 158.74 43.98 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 107.976 -1.12 . . . . 67.63 107.976 167.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 23.3 tp -125.1 116.17 21.66 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 107.835 -1.172 . . . . 56.05 107.835 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.8 mp -106.85 144.41 33.53 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.674 -0.491 . . . . 65.12 109.674 -174.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 73.1 p -90.45 -177.6 5.11 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 121.669 0.747 . . . . 67.91 109.483 171.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -73.34 -21.71 60.48 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 119.916 -0.714 . . . . 120.18 112.087 177.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.8 m -65.22 -42.16 93.74 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.679 -0.408 . . . . 78.59 111.09 174.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -66.81 -31.76 72.6 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.083 0.401 . . . . 86.27 112.083 -176.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.9 mt -80.24 -43.82 20.75 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.444 -0.502 . . . . 92.59 112.034 -175.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.18 -28.04 68.46 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.738 -0.785 . . . . 112.35 111.549 178.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 60.7 p -70.88 -38.13 73.05 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.087 -0.645 . . . . 89.82 110.797 171.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 19.5 mt -69.42 -10.61 58.73 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.882 0.697 . . . . 93.58 112.882 174.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 118.556 0.616 . . . . 108.37 111.132 -178.848 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.578 0.228 . . . . 113.42 110.882 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . . . 60.14 25.01 14.32 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.203 0.601 . . . . 107.31 112.135 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.5 p -99.05 0.68 44.23 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.983 0.734 . . . . 95.08 112.983 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 8.0 ttmt -69.59 151.12 46.33 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.479 0.657 . . . . 85.97 110.807 -175.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 80.7 mmt-85 -119.51 157.22 28.76 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.672 -0.694 . . . . 70.52 110.068 171.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -128.19 110.82 12.78 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.058 -1.09 . . . . 82.79 108.058 179.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LEU . . . . . 0.42 ' CD2' HD21 ' A' ' 31' ' ' LEU . 30.5 tp -79.51 120.1 23.41 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.094 -0.706 . . . . 62.52 109.094 174.587 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 35.6 mm -102.49 120.25 51.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 108.483 -0.932 . . . . 56.74 108.483 -177.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 51.3 tp -91.06 114.47 27.0 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.234 -1.025 . . . . 58.93 108.234 168.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ILE . . . . . 0.558 ' HB ' HG22 ' A' ' 83' ' ' THR . 55.4 mt -103.08 115.75 45.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 108.058 -1.09 . . . . 58.3 108.058 -173.297 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -105.23 110.39 22.75 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 107.348 -1.352 . . . . 57.62 107.348 -176.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 46.9 t -119.45 109.42 15.72 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.387 -0.597 . . . . 66.33 109.387 -174.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 15.9 m -128.13 -176.99 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 108.392 -0.966 . . . . 66.0 108.392 175.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 69.2 tt0 -60.08 -42.14 93.94 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.846 -0.615 . . . . 78.85 112.258 -167.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -119.12 21.87 12.12 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.747 0.647 . . . . 53.02 112.747 -177.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -149.47 145.16 26.75 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 118.091 0.405 . . . . 67.72 109.962 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ARG . . . . . 0.714 ' NH1' ' OD2' ' B' ' 85' ' ' ASP . 44.4 ttt-85 -135.84 110.6 8.7 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 106.432 -1.692 . . . . 89.74 106.432 162.039 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 24.9 mm -118.79 139.99 44.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 108.463 -0.94 . . . . 55.31 108.463 -172.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 49.9 m80 -114.5 116.06 28.24 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.593 -0.892 . . . . 78.61 108.593 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -101.14 106.73 46.63 Favored Pre-proline 0 C--O 1.241 0.644 0 N-CA-C 109.113 -0.699 . . . . 67.19 109.113 177.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' PRO . . . . . 0.424 ' O ' HD11 ' A' ' 54' ' ' LEU . 95.5 Cg_endo -90.76 126.71 1.21 Allowed 'Trans proline' 0 C--O 1.234 0.288 0 CA-C-N 119.39 0.818 . . . . 64.2 114.209 -175.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 70.2 mt -111.57 114.87 52.21 Favored Pre-proline 0 C--O 1.24 0.584 0 N-CA-C 109.592 -0.522 . . . . 60.63 109.592 176.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -79.68 130.43 8.74 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 120.586 0.857 . . . . 61.42 111.408 -178.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 23.3 mt -118.86 100.47 50.86 Favored Pre-proline 0 C--O 1.243 0.745 0 CA-C-N 116.087 -0.506 . . . . 67.28 109.97 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -58.88 147.3 89.88 Favored 'Trans proline' 0 C--O 1.233 0.236 0 CA-C-O 121.64 0.6 . . . . 69.93 112.339 175.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -70.21 142.37 52.41 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.236 -0.893 . . . . 76.21 110.521 177.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 83.61 111.45 -179.581 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.009 -0.08 . . . . 127.77 112.263 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -83.11 107.45 15.69 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 109.009 -0.737 . . . . 151.59 109.009 179.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.56 165.02 41.13 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-O 122.512 1.062 . . . . 125.74 111.64 173.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -117.06 136.21 53.15 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.187 -1.042 . . . . 87.89 108.187 179.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLN . . . . . 0.775 ' HG2' ' HG2' ' B' ' 21' ' ' ARG . 6.5 mt-30 -136.74 123.36 21.02 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 109.387 -0.597 . . . . 111.16 109.387 -173.441 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 15.3 t -136.15 153.41 31.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 109.203 -0.665 . . . . 96.94 109.203 -176.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -88.24 129.94 35.22 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.331 -0.989 . . . . 92.7 108.331 167.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -138.17 136.27 36.47 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.961 -0.755 . . . . 71.63 108.961 -174.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 95.3 t -94.32 119.16 41.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 108.714 -0.847 . . . . 62.04 108.714 -172.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -115.36 110.3 19.16 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 107.923 -1.14 . . . . 62.23 107.923 175.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ARG . . . . . . . . . . . . . 86.3 mtt180 51.95 47.99 23.65 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.973 0.892 . . . . 67.46 111.803 178.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 89.98 -17.08 55.19 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 115.175 0.83 . . . . 77.39 115.175 175.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 59.5 t -102.27 118.43 49.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 118.156 0.978 . . . . 68.5 108.663 -174.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -70.82 125.65 27.43 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.53 -0.544 . . . . 87.46 109.53 176.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -113.89 156.45 23.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.512 0.672 . . . . 62.05 110.268 179.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -95.78 123.61 39.43 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.225 -1.028 . . . . 57.5 108.225 168.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 62.9 t -117.59 133.27 64.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 108.552 -0.907 . . . . 65.81 108.552 -178.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ARG . . . . . 0.775 ' HG2' ' HG2' ' B' ' 8' ' ' GLN . 68.7 mtm-85 -122.86 127.31 48.85 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 108.825 -0.805 . . . . 74.31 108.825 177.359 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' VAL . . . . . 0.554 HG12 HD13 ' B' ' 31' ' ' LEU . 26.0 m -120.87 136.86 56.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 109.084 -0.709 . . . . 79.53 109.084 175.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' MSE . . . . . . . . . . . . . 28.9 tpp -143.97 118.36 9.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.569 -0.741 . . . . 108.43 109.527 -179.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.0 p -119.92 117.77 54.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 107.987 -1.116 . . . . 84.96 107.987 179.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 30.3 p -135.75 114.71 12.16 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 108.065 -1.087 . . . . 92.0 108.065 -177.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.55 -116.17 8.42 Favored Glycine 0 C--O 1.237 0.298 0 C-N-CA 120.88 -0.676 . . . . 74.66 111.473 -175.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . . . -114.94 30.41 7.37 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 122.126 -0.632 . . . . 82.38 112.41 -176.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 56.1 t -132.76 136.78 55.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 108.575 -0.898 . . . . 75.86 108.575 179.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 5.6 tp -114.65 123.91 50.49 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.734 -0.839 . . . . 69.16 108.734 177.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -110.98 134.18 52.8 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.923 -0.399 . . . . 114.77 109.923 178.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LEU . . . . . 0.554 HD13 HG12 ' B' ' 22' ' ' VAL . 15.4 tp -138.47 129.06 26.31 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.058 -0.719 . . . . 90.1 109.058 -172.534 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' GLU . . . . . 0.512 ' HG2' ' HG3' ' B' ' 43' ' ' ARG . 91.2 mt-10 -135.1 130.55 35.7 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 122.903 0.481 . . . . 93.41 110.153 -179.881 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' VAL . . . . . . . . . . . . . 94.3 t -116.73 132.93 64.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 107.693 -1.225 . . . . 65.68 107.693 171.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -134.03 129.9 36.77 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.603 0.239 . . . . 82.48 110.862 -175.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -92.18 108.15 19.74 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 106.924 -1.51 . . . . 85.74 106.924 167.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ARG . . . . . . . . . . . . . 71.1 mtt-85 -65.03 -34.23 77.94 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.415 -0.514 . . . . 96.26 111.825 -174.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' MSE . . . . . . . . . . . . . 26.2 ttp -66.7 -39.57 88.14 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.677 0.621 . . . . 130.39 112.677 -173.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 44.3 p -102.52 -3.67 26.47 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.849 0.685 . . . . 81.15 112.849 179.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . 62.07 15.97 7.82 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.505 1.122 . . . . 84.72 112.543 -177.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -70.03 134.79 48.64 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.403 -0.591 . . . . 84.01 109.403 174.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -132.69 136.63 46.55 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.546 -0.539 . . . . 91.91 109.546 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' TRP . . . . . . . . . . . . . 24.5 m-90 -122.06 134.12 54.78 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.409 -0.96 . . . . 72.93 108.409 173.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ARG . . . . . 0.512 ' HG3' ' HG2' ' B' ' 32' ' ' GLU . 34.2 ttt85 -133.83 135.38 43.73 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.442 -0.345 . . . . 82.16 110.298 -171.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . -129.75 141.96 13.15 Favored Glycine 0 CA--C 1.502 -0.73 0 N-CA-C 111.825 -0.51 . . . . 61.15 111.825 173.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . . . -125.14 127.21 46.5 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 107.909 -1.145 . . . . 66.37 107.909 175.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -134.64 133.82 40.51 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 110.059 -0.348 . . . . 65.77 110.059 -172.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -88.49 159.56 17.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.455 0.645 . . . . 75.94 109.809 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.57 -39.55 84.43 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.451 -0.795 . . . . 70.16 111.607 -175.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.04 -44.52 97.18 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 120.329 -0.938 . . . . 65.97 112.399 177.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -61.94 -45.89 91.7 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.532 -0.467 . . . . 67.4 111.08 178.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' ILE . . . . . . . . . . . . . 27.7 mm -60.36 -44.4 95.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 121.099 0.476 . . . . 58.92 110.578 -177.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -71.42 -37.89 71.44 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 119.963 -0.695 . . . . 88.73 111.356 -177.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -58.45 -37.62 75.82 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 120.037 -0.665 . . . . 91.69 110.908 171.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' LEU . . . . . 0.499 HD21 ' HD2' ' B' ' 134' ' ' PRO . 6.7 tt -62.03 -50.37 72.29 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.74 0.305 . . . . 65.88 110.704 179.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 68.7 p -61.21 -34.22 74.73 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.577 -0.449 . . . . 62.03 111.465 179.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -62.06 -38.86 90.37 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.881 -0.328 . . . . 86.53 111.416 176.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . . . -66.78 -27.99 68.03 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.488 -0.485 . . . . 65.59 111.806 -177.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 15.1 p -77.68 -6.85 55.3 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 112.858 0.688 . . . . 62.87 112.858 175.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.87 6.45 85.51 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 115.426 0.93 . . . . 57.62 115.426 -175.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ASN . . . . . 0.6 ' OD1' ' NZ ' ' B' ' 62' ' ' LYS . 6.5 t-20 -132.81 79.31 1.84 Allowed 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 107.377 -1.342 . . . . 64.4 107.377 -177.719 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 61' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -63.6 147.59 51.11 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.724 0.773 . . . . 58.8 111.485 -170.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' LYS . . . . . 0.6 ' NZ ' ' OD1' ' B' ' 60' ' ' ASN . 45.2 mmtm -141.1 134.86 30.3 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.175 -0.92 . . . . 68.65 108.721 174.688 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . . . -64.99 153.18 41.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.31 0.576 . . . . 72.18 110.234 171.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -55.52 -44.66 76.85 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.606 -0.725 . . . . 71.76 111.475 -176.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -69.06 -33.11 73.04 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.259 -0.576 . . . . 102.52 111.334 -179.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ILE . . . . . . . . . . . . . 42.9 mm -68.74 -44.24 82.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 C-N-CA 120.679 -0.409 . . . . 67.86 110.565 177.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -57.98 -46.31 85.37 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 122.103 -0.373 . . . . 61.21 111.469 178.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' CYS . . . . . . . . . . . . . 88.0 m -61.26 -39.61 91.02 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 122.158 -0.339 . . . . 68.36 111.728 -179.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -66.36 -36.34 82.64 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 119.878 -0.729 . . . . 82.7 111.247 178.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' MSE . . . . . . . . . . . . . 79.4 mtp -64.37 -38.88 92.59 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.072 0.463 . . . . 65.76 110.024 174.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 15.7 tp -65.22 -44.25 88.86 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.672 -0.695 . . . . 71.7 111.225 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . . . -68.0 -37.91 82.0 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.624 -0.43 . . . . 78.35 111.388 178.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 21.9 m -63.24 -36.72 84.59 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.608 -0.437 . . . . 81.37 111.455 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ALA . . . . . 0.775 ' HB2' HG12 ' B' ' 82' ' ' VAL . . . -63.61 -42.4 98.21 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.376 -0.53 . . . . 64.28 111.376 175.145 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 17.5 mt -66.64 -42.56 86.53 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.556 -0.458 . . . . 84.91 111.114 -176.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 81.5 p -84.12 -3.28 58.0 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.621 0.6 . . . . 79.09 112.621 176.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 57.33 40.64 27.5 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.259 0.552 . . . . 82.06 111.346 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 84.4 p -104.25 14.5 30.2 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 112.988 0.736 . . . . 90.56 112.988 -176.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' SER . . . . . . . . . . . . . 10.5 t -146.16 139.45 25.92 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.383 -0.969 . . . . 85.7 108.383 -179.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . . . -85.07 -8.66 58.58 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 113.485 0.92 . . . . 69.57 113.485 -172.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 57.6 p -107.29 1.18 23.66 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 113.509 0.929 . . . . 59.98 113.509 -174.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' VAL . . . . . 0.775 HG12 ' HB2' ' B' ' 74' ' ' ALA . 39.2 t -134.07 132.74 56.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 108.883 -0.784 . . . . 65.48 108.883 -172.688 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' THR . . . . . 0.575 HG22 ' HB ' ' B' ' 123' ' ' ILE . 0.6 OUTLIER -146.21 163.29 35.88 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 124.651 1.22 . . . . 67.53 108.959 -175.221 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 84' ' ' LEU . . . . . 0.495 ' HG ' ' HB1' ' B' ' 74' ' ' ALA . 84.6 mt -120.15 152.66 37.32 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 124.756 1.285 . . . . 59.06 111.559 -175.73 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ASP . . . . . 0.714 ' OD2' ' NH1' ' A' ' 130' ' ' ARG . 41.9 t0 -147.21 160.54 42.34 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.127 -0.942 . . . . 65.27 108.588 167.269 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 25.0 tp -123.37 118.91 28.57 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 108.506 -0.924 . . . . 62.01 108.506 -177.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' LEU . . . . . . . . . . . . . 18.7 mt -105.04 141.97 35.67 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.392 -0.595 . . . . 76.25 109.392 -173.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 63.2 p -92.72 179.59 5.44 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 122.149 0.976 . . . . 74.5 110.874 172.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -65.24 -30.42 71.31 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.365 -0.834 . . . . 98.77 111.373 172.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' THR . . . . . . . . . . . . . 94.7 m -65.36 -41.05 94.25 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 121.017 -0.273 . . . . 90.06 111.493 -179.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -66.78 -35.93 81.23 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.334 -0.547 . . . . 76.98 112.158 -173.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 2.2 mp -83.77 -23.5 31.49 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.616 -0.833 . . . . 107.69 112.726 -177.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -71.15 -27.17 63.37 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.83 -0.748 . . . . 112.95 111.294 173.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' SER . . . . . 0.612 ' OG ' HG22 ' A' ' 58' ' ' THR . 43.1 t -68.07 -38.88 82.89 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.164 -0.615 . . . . 89.07 110.643 170.568 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 96.2 mt -70.46 -32.91 70.66 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.533 -0.467 . . . . 91.93 111.447 173.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . . . -74.42 -30.29 61.86 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 112.385 0.513 . . . . 105.48 112.385 -178.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ASN . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.2 0 C-N-CA 123.046 0.538 . . . . 114.93 111.788 -179.855 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 115' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.877 0.37 . . . . 97.87 111.431 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 7.4 p -99.88 0.17 40.83 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.216 0.821 . . . . 81.71 113.216 178.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 7.9 ttmt -70.69 151.39 44.97 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.669 0.747 . . . . 86.32 111.208 -174.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' ARG . . . . . . . . . . . . . 68.7 mmt-85 -117.47 157.8 25.64 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.437 -0.801 . . . . 81.01 110.204 171.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -129.72 110.63 11.92 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.076 -0.965 . . . . 90.0 108.618 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' LEU . . . . . 0.55 HD23 HD21 ' B' ' 31' ' ' LEU . 30.8 tp -79.58 122.04 26.01 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.551 -0.537 . . . . 62.0 109.551 174.947 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 121' ' ' ILE . . . . . . . . . . . . . 35.0 mm -101.99 120.8 52.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 108.943 -0.762 . . . . 63.43 108.943 -177.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' LEU . . . . . 0.638 ' HB3' ' HB2' ' B' ' 133' ' ' TYR . 59.1 tp -90.93 114.71 27.26 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.746 -1.205 . . . . 63.64 107.746 169.163 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 123' ' ' ILE . . . . . 0.575 ' HB ' HG22 ' B' ' 83' ' ' THR . 57.4 mt -104.04 114.21 43.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 108.341 -0.985 . . . . 69.69 108.341 -173.928 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 124' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -108.02 111.21 23.16 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.2 1.0 . . . . 59.74 108.769 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 48.3 t -119.99 110.38 16.62 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.493 -0.558 . . . . 63.01 109.493 -174.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 15.2 m -127.16 -176.98 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 108.465 -0.939 . . . . 59.55 108.465 174.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -59.05 -41.63 88.35 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.657 -0.701 . . . . 79.22 112.06 -167.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -119.68 21.72 11.91 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.662 0.616 . . . . 52.91 112.662 -177.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -149.1 144.57 26.74 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.478 0.581 . . . . 64.15 110.162 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 23.5 ttt85 -135.55 110.51 8.81 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 106.922 -1.51 . . . . 79.18 106.922 164.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 24.6 mm -119.48 139.88 45.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 108.847 -0.797 . . . . 46.17 108.847 -172.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -114.91 116.32 28.33 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.567 -0.901 . . . . 61.45 108.567 176.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' TYR . . . . . 0.638 ' HB2' ' HB3' ' B' ' 122' ' ' LEU . 92.4 m-85 -100.74 107.06 47.26 Favored Pre-proline 0 C--O 1.24 0.58 0 N-CA-C 109.33 -0.619 . . . . 58.94 109.33 177.735 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 134' ' ' PRO . . . . . 0.499 ' HD2' HD21 ' B' ' 54' ' ' LEU . 97.1 Cg_endo -91.36 126.16 1.0 Allowed 'Trans proline' 0 C--O 1.234 0.323 0 CA-C-N 119.434 0.834 . . . . 60.91 113.612 -176.878 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 135' ' ' LEU . . . . . . . . . . . . . 68.1 mt -112.31 115.16 50.11 Favored Pre-proline 0 C--O 1.239 0.536 0 N-CA-C 109.372 -0.603 . . . . 59.87 109.372 175.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -79.11 130.04 9.13 Favored 'Trans proline' 0 N--CA 1.473 0.28 0 CA-C-N 119.452 0.84 . . . . 67.32 111.648 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 22.0 mt -118.59 99.04 51.48 Favored Pre-proline 0 C--O 1.246 0.907 0 CA-C-N 115.978 -0.555 . . . . 74.57 109.926 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -59.24 148.36 86.46 Favored 'Trans proline' 0 C--N 1.333 -0.28 0 C-N-CA 120.614 0.876 . . . . 74.73 112.535 175.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -68.59 121.8 17.17 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.022 -0.99 . . . . 91.45 109.617 176.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 . . . . . 0 N--CA 1.463 0.201 0 C-N-CA 123.015 0.526 . . . . 100.36 111.301 -175.477 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 4' ' ' PRO . . . . . 0.936 ' CA ' ' HE1' ' C' ' 23' ' ' MSE . 78.4 Cg_exo . . . . . 0 C--O 1.232 0.184 0 N-CA-C 112.745 0.248 . . . . 130.89 112.745 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' ALA . . . . . . . . . . . . . . . -91.67 91.4 7.98 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 108.621 -0.881 . . . . 116.11 108.621 -176.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' GLY . . . . . . . . . . . . . . . -97.57 164.95 22.18 Favored Glycine 0 N--CA 1.444 -0.803 0 CA-C-N 115.875 -0.602 . . . . 98.68 112.676 178.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' LEU . . . . . . . . . . . . . 25.6 tp -119.07 138.71 52.68 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 123.091 0.556 . . . . 75.56 110.258 179.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 8' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 -136.4 122.97 20.92 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.443 -0.947 . . . . 108.37 108.443 -178.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' VAL . . . . . . . . . . . . . 12.9 t -135.14 150.33 29.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 108.568 -0.901 . . . . 83.83 108.568 -177.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -90.25 128.98 36.54 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.878 -0.786 . . . . 121.4 108.878 168.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -139.6 135.36 33.25 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.759 -0.459 . . . . 82.52 109.759 -174.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' VAL . . . . . . . . . . . . . 91.5 t -95.99 120.86 45.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 108.188 -1.041 . . . . 91.57 108.188 -174.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -113.16 110.62 20.72 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.464 -0.939 . . . . 89.92 108.464 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' ARG . . . . . . . . . . . . . 61.8 mtt-85 50.96 47.02 25.55 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.718 0.771 . . . . 98.32 111.485 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.13 -17.35 54.04 Favored Glycine 0 N--CA 1.443 -0.887 0 CA-C-O 119.29 -0.728 . . . . 98.6 114.896 176.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 49.0 t -102.39 115.75 44.84 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 N-CA-C 107.648 -1.241 . . . . 90.96 107.648 -175.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -72.21 124.18 24.49 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.389 -0.368 . . . . 104.53 110.629 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -116.31 155.29 28.67 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.539 0.685 . . . . 83.34 110.502 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.95 125.89 41.7 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.069 -0.969 . . . . 80.99 108.794 167.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' VAL . . . . . . . . . . . . . 62.0 t -117.89 132.81 66.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 108.598 -0.89 . . . . 72.43 108.598 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 60.2 mtm-85 -124.02 127.06 47.33 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.226 0.61 . . . . 89.14 109.398 177.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 13.6 m -122.39 137.39 56.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 N-CA-C 106.998 -1.482 . . . . 71.89 106.998 178.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' MSE . . . . . 0.936 ' HE1' ' CA ' ' C' ' 4' ' ' PRO . 2.8 tpt -137.98 126.44 23.38 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 107.408 -1.33 . . . . 158.55 107.408 177.44 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 57.3 t -110.24 124.24 66.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 106.459 -1.682 . . . . 68.43 106.459 178.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' SER . . . . . . . . . . . . . . . -138.25 111.87 8.22 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.632 -1.247 . . . . 94.85 107.632 -178.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.26 -116.66 9.62 Favored Glycine 0 C--O 1.237 0.31 0 N-CA-C 111.213 -0.755 . . . . 110.35 111.213 -176.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 27' ' ' GLN . . . . . . . . . . . . . 95.2 mm-40 -115.6 30.66 7.21 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 122.909 0.484 . . . . 93.8 111.554 -177.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' VAL . . . . . . . . . . . . . 2.5 t -132.94 137.26 54.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 N-CA-C 108.45 -0.945 . . . . 69.26 108.45 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 6.6 tp -113.6 124.64 52.82 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 107.132 -1.433 . . . . 65.81 107.132 179.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' GLU . . . . . 0.55 ' HG2' ' HG2' ' C' ' 45' ' ' GLU . 65.2 mt-10 -110.86 135.61 51.15 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 124.859 1.35 . . . . 96.63 109.078 178.536 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 31' ' ' LEU . . . . . 0.408 HD21 HD23 ' C' ' 120' ' ' LEU . 25.2 tp -137.64 130.86 30.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.928 -0.578 . . . . 74.25 109.615 -170.993 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -132.71 130.45 40.04 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.389 -0.597 . . . . 82.02 109.389 178.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 33' ' ' VAL . . . . . . . . . . . . . 87.4 t -115.88 134.22 59.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 108.044 -1.095 . . . . 72.51 108.044 173.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 34' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -132.87 129.89 39.02 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 109.383 -0.599 . . . . 92.39 109.383 -175.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 35' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -91.18 108.28 19.77 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 107.414 -1.328 . . . . 91.9 107.414 170.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 36' ' ' ARG . . . . . . . . . . . . . . . -64.6 -35.09 79.89 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.428 -0.509 . . . . 112.34 111.357 -175.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 37' ' ' MSE . . . . . . . . . . . . . 1.8 ttt -63.97 -36.61 84.55 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 117.974 -1.012 . . . . 172.05 111.514 -178.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 38' ' ' THR . . . . . . . . . . . . . 37.5 p -116.88 -4.66 11.54 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 124.685 1.241 . . . . 106.11 114.046 -172.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 39' ' ' ALA . . . . . . . . . . . . . . . 61.54 15.03 6.4 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.345 1.458 . . . . 87.78 112.874 -176.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -71.61 137.02 47.63 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.971 -0.455 . . . . 83.16 110.849 174.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 41' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -130.9 137.32 49.27 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.057 0.456 . . . . 88.06 111.33 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 42' ' ' TRP . . . . . . . . . . . . . 26.0 m-90 -123.77 140.79 52.64 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.604 -0.888 . . . . 65.32 108.604 171.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 43' ' ' ARG . . . . . . . . . . . . . 29.9 ttt-85 -140.32 140.35 35.62 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.589 0.233 . . . . 88.31 110.537 -174.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 44' ' ' GLY . . . . . . . . . . . . . . . -140.25 145.03 15.69 Favored Glycine 0 N--CA 1.452 -0.3 0 N-CA-C 111.426 -0.669 . . . . 70.1 111.426 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 45' ' ' GLU . . . . . 0.55 ' HG2' ' HG2' ' C' ' 30' ' ' GLU . 28.1 mt-10 -123.57 126.78 47.26 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 123.603 0.761 . . . . 100.82 109.369 176.404 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 46' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -134.89 128.66 33.04 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.699 -0.482 . . . . 73.59 109.699 -174.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 p30 -92.67 166.12 12.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.652 0.739 . . . . 86.76 110.501 174.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.29 -38.53 71.34 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.521 -0.763 . . . . 77.88 111.687 -174.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.72 -44.7 97.62 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 119.95 -1.119 . . . . 70.21 112.937 177.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 50' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -64.19 -47.57 79.27 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 122.249 -0.56 . . . . 67.31 111.28 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 51' ' ' ILE . . . . . . . . . . . . . 26.1 mm -60.94 -44.73 98.63 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-O 120.868 0.366 . . . . 65.93 110.987 -177.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 52' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -70.47 -38.14 74.36 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.356 -0.538 . . . . 74.77 111.424 -176.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 53' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -59.14 -38.97 80.95 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.715 -0.394 . . . . 101.89 111.001 171.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 54' ' ' LEU . . . . . . . . . . . . . 3.6 tt -63.56 -52.82 59.42 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 120.693 0.282 . . . . 66.45 111.504 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 55' ' ' THR . . . . . . . . . . . . . 60.4 p -62.73 -33.57 75.4 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.569 -0.453 . . . . 55.72 111.698 -179.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 56' ' ' HIS . . . . . . . . . . . . . 39.9 t-80 -61.0 -38.32 85.63 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 111.852 0.316 . . . . 88.28 111.852 176.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 57' ' ' LYS . . . . . . . . . . . . . . . -65.2 -27.25 68.56 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.182 -0.607 . . . . 64.85 111.975 -176.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 58' ' ' THR . . . . . . . . . . . . . 14.1 p -77.1 -6.87 54.51 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 113.112 0.782 . . . . 57.4 113.112 175.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.59 6.02 86.49 Favored Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 115.307 0.883 . . . . 63.82 115.307 -174.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 60' ' ' ASN . . . . . 0.406 ' OD1' ' NZ ' ' C' ' 62' ' ' LYS . 7.0 t-20 -132.54 77.65 1.76 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 106.723 -1.584 . . . . 59.37 106.723 -178.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 61' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -65.78 149.12 50.67 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.481 -0.782 . . . . 61.88 111.455 -170.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 62' ' ' LYS . . . . . 0.406 ' NZ ' ' OD1' ' C' ' 60' ' ' ASN . 43.9 mmtm -139.69 136.5 34.31 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.284 -0.871 . . . . 61.57 109.541 175.233 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 63' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -64.32 151.68 43.19 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.966 -0.561 . . . . 67.72 109.525 170.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 64' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -57.21 -43.62 82.96 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.85 -0.614 . . . . 54.57 111.831 -175.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 65' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -68.99 -34.05 74.66 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.327 -0.549 . . . . 69.66 112.0 -177.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 66' ' ' ILE . . . . . . . . . . . . . 18.8 mt -69.76 -42.43 80.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 C-N-CA 120.237 -0.585 . . . . 60.73 110.464 176.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 67' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -56.37 -46.11 80.19 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 122.01 -0.431 . . . . 56.98 111.282 178.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 68' ' ' CYS . . . . . . . . . . . . . 88.0 m -61.13 -39.67 90.92 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.617 -0.433 . . . . 69.43 111.351 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 69' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -66.98 -40.82 87.51 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.517 -0.473 . . . . 58.34 111.411 178.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 70' ' ' MSE . . . . . . . . . . . . . 81.5 mtp -59.21 -41.02 87.6 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.174 0.511 . . . . 67.84 110.381 175.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 16.1 tp -64.92 -42.96 94.25 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.214 -0.903 . . . . 68.56 111.311 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 72' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -67.3 -39.41 85.96 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.349 -0.541 . . . . 105.38 111.002 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 73' ' ' SER . . . . . . . . . . . . . 20.4 m -63.06 -37.0 85.44 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 120.763 -0.375 . . . . 67.09 110.96 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.17 -41.65 97.04 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.832 -0.347 . . . . 61.32 111.373 175.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 12.8 mt -66.84 -43.73 82.92 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.174 -0.61 . . . . 78.15 111.747 -177.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 76' ' ' THR . . . . . . . . . . . . . 82.0 p -83.04 -3.23 57.04 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.474 0.546 . . . . 78.43 112.474 179.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 77' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 57.0 39.12 29.58 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.701 0.763 . . . . 94.54 110.551 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 78' ' ' SER . . . . . . . . . . . . . 81.8 p -104.83 15.38 27.94 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 123.539 0.736 . . . . 84.87 112.077 -177.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 79' ' ' SER . . . . . . . . . . . . . 12.5 t -144.72 138.82 27.49 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.015 -0.735 . . . . 83.89 109.015 -177.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . . . -85.66 -9.42 57.25 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.535 0.939 . . . . 74.2 113.535 -172.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 81' ' ' SER . . . . . . . . . . . . . 59.9 p -107.77 -7.21 16.41 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 114.093 1.146 . . . . 62.82 114.093 -174.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 8.7 m -127.92 137.14 58.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 CA-C-N 119.054 0.843 . . . . 60.95 109.804 -176.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.09 173.14 11.77 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 108.485 -0.931 . . . . 63.37 108.485 174.16 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 84' ' ' LEU . . . . . . . . . . . . . 86.1 mt -121.72 152.09 39.79 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.858 -0.61 . . . . 71.99 110.63 -176.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 85' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -147.41 156.81 43.22 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 108.573 -0.899 . . . . 75.42 108.573 169.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 23.7 tp -126.14 113.81 17.54 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.99 -0.744 . . . . 67.04 108.99 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 87' ' ' LEU . . . . . . . . . . . . . 10.3 mp -111.99 148.73 33.18 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 123.561 0.744 . . . . 66.45 111.799 -174.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 88' ' ' THR . . . . . . . . . . . . . 72.8 p -88.97 175.0 7.6 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.818 -1.179 . . . . 65.08 107.818 165.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 89' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -65.08 -33.93 77.2 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 118.353 -1.339 . . . . 80.34 111.647 -178.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 90' ' ' THR . . . . . . . . . . . . . 96.0 m -62.23 -43.12 99.56 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.28 -0.568 . . . . 100.75 110.993 175.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 91' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -67.89 -33.4 74.65 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 122.27 -0.269 . . . . 94.47 111.337 -178.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 92' ' ' LEU . . . . . 0.751 HD13 ' O ' ' C' ' 92' ' ' LEU . 2.1 tm? -66.29 -40.85 90.32 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 117.765 -1.112 . . . . 97.82 111.491 -178.31 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -75.83 -30.56 59.01 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 125.02 1.45 . . . . 121.47 108.801 -177.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 94' ' ' SER . . . . . . . . . . . . . 47.3 m -63.54 -43.09 98.1 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 118.181 -1.408 . . . . 96.33 108.347 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.22 -42.34 96.63 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 107.325 -1.361 . . . . 115.32 107.325 175.311 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 96' ' ' ARG . . . . . . . . . . . . . . . -63.78 -38.62 91.79 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 118.041 -0.981 . . . . 120.77 109.863 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 97' ' ' ASN . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.344 0 O-C-N 125.404 1.69 . . . . 120.6 108.741 -178.26 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 111' ' ' SER . . . . . . . . . . . . . 6.4 p . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 118.593 -0.718 . . . . 129.38 109.353 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 112' ' ' ALA . . . . . . . . . . . . . . . -80.28 -7.97 59.27 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 124.754 1.283 . . . . 110.63 112.652 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 113' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -61.82 137.36 58.24 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.106 0.479 . . . . 85.43 110.639 177.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 114' ' ' LEU . . . . . . . . . . . . . 89.2 mt -85.32 121.65 28.36 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.022 -0.732 . . . . 69.27 109.022 179.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 115' ' ' ASN . . . . . . . . . . . . . 62.3 t-20 -167.46 104.78 0.52 Allowed 'General case' 0 C--O 1.235 0.309 0 N-CA-C 107.621 -1.252 . . . . 78.68 107.621 -165.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 116' ' ' SER . . . . . . . . . . . . . 7.4 p -93.65 1.36 56.64 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.346 0.499 . . . . 71.47 112.346 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 117' ' ' LYS . . . . . 0.659 ' HG2' ' HA ' ' C' ' 138' ' ' PRO . 16.7 mtmt -69.34 155.93 39.63 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 122.117 0.961 . . . . 66.74 110.772 -177.598 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 118' ' ' ARG . . . . . . . . . . . . . 81.6 mmt-85 -115.65 156.59 25.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.991 -1.004 . . . . 69.59 108.363 169.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 119' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -126.1 110.32 13.39 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.519 -0.919 . . . . 67.18 108.519 -177.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 120' ' ' LEU . . . . . 0.408 HD23 HD21 ' C' ' 31' ' ' LEU . 29.5 tp -78.47 120.26 22.94 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 107.843 -1.169 . . . . 60.58 107.843 173.848 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 121' ' ' ILE . . . . . . . . . . . . . 33.2 mm -100.98 118.71 48.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 107.792 -1.188 . . . . 55.9 107.792 -177.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 122' ' ' LEU . . . . . . . . . . . . . 50.6 tp -89.78 114.31 25.99 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 106.792 -1.558 . . . . 56.61 106.792 169.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 123' ' ' ILE . . . . . . . . . . . . . 58.7 mt -103.36 114.24 42.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 107.886 -1.153 . . . . 55.75 107.886 -173.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 124' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -106.08 109.77 21.82 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.694 -1.224 . . . . 60.76 107.694 -177.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 125' ' ' SER . . . . . . . . . . . . . 47.5 t -119.96 109.68 15.81 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.228 -0.656 . . . . 61.21 109.228 -174.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 126' ' ' VAL . . . . . . . . . . . . . 16.0 m -127.52 -176.68 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 108.337 -0.986 . . . . 63.31 108.337 175.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 127' ' ' GLU . . . . . . . . . . . . . 69.0 tt0 -59.3 -41.95 90.18 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.761 -0.654 . . . . 96.64 112.071 -167.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 128' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -119.07 22.88 11.67 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.632 0.604 . . . . 61.43 112.632 -177.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 129' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -148.6 144.48 27.25 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 121.373 0.606 . . . . 82.23 109.983 178.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 130' ' ' ARG . . . . . . . . . . . . . 10.8 tpp180 -134.84 109.34 8.46 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 106.468 -1.679 . . . . 89.36 106.468 164.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 131' ' ' ILE . . . . . . . . . . . . . 23.2 mm -122.18 137.98 53.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 N-CA-C 109.433 -0.58 . . . . 57.81 109.433 -173.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 132' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -115.03 117.32 30.25 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.108 -1.071 . . . . 73.01 108.108 175.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 133' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -100.04 106.66 42.74 Favored Pre-proline 0 C--O 1.241 0.607 0 N-CA-C 108.563 -0.903 . . . . 63.59 108.563 177.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -90.15 127.24 1.44 Allowed 'Trans proline' 0 C--N 1.331 -0.368 0 CA-C-N 119.39 0.818 . . . . 60.21 112.888 -175.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 135' ' ' LEU . . . . . . . . . . . . . 67.9 mt -111.13 113.6 54.35 Favored Pre-proline 0 C--O 1.242 0.662 0 N-CA-C 109.609 -0.515 . . . . 54.46 109.609 176.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 136' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -78.99 129.68 9.06 Favored 'Trans proline' 0 C--N 1.332 -0.314 0 CA-C-N 119.266 0.774 . . . . 60.05 110.388 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 137' ' ' LEU . . . . . . . . . . . . . 24.1 mt -118.64 102.39 49.84 Favored Pre-proline 0 C--O 1.243 0.72 0 N-CA-C 109.407 -0.59 . . . . 60.94 109.407 -179.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 138' ' ' PRO . . . . . 0.659 ' HA ' ' HG2' ' C' ' 117' ' ' LYS . 75.8 Cg_exo -56.97 146.92 77.52 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 120.25 0.633 . . . . 63.25 112.305 177.31 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 139' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -69.83 137.0 51.42 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.025 -0.989 . . . . 77.06 110.857 179.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 140' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 -110.89 14.95 22.05 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.661 0.615 . . . . 74.7 112.661 -177.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 141' ' ' GLY . . . . . . . . . . . . . . . 75.96 -147.98 35.73 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.434 -0.889 . . . . 83.99 111.229 -174.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 142' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -124.54 76.75 63.26 Favored Pre-proline 0 C--O 1.242 0.674 0 N-CA-C 108.683 -0.858 . . . . 100.35 108.683 177.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 143' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo . . . . . 0 C--N 1.342 0.231 0 C-N-CA 120.874 1.049 . . . . 112.87 112.49 177.78 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . 0.501 ' O ' ' N ' ' A' ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.501 ' N ' ' O ' ' A' ' 201' ' ' HOH . . . . . . . . 0 N--CA 1.452 -0.284 0 N-CA-C 112.965 -0.054 . . . . 115.28 112.965 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 23.4 tp -117.99 136.48 53.49 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 122.866 0.467 . . . . 82.04 109.749 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . . . -139.24 121.37 15.77 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.715 -0.846 . . . . 69.2 108.715 -178.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 20.4 m -136.89 153.01 29.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 N-CA-C 108.72 -0.845 . . . . 69.78 108.72 -178.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -89.69 130.71 35.93 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.746 -0.661 . . . . 87.29 109.479 168.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -138.02 136.16 36.61 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 109.071 -0.714 . . . . 62.75 109.071 -174.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 88.3 t -96.0 119.17 43.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 109.231 -0.655 . . . . 54.75 109.231 -173.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -115.36 111.9 21.55 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.225 -1.028 . . . . 60.11 108.225 176.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? 52.56 47.62 24.31 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.93 0.871 . . . . 61.5 111.629 -179.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 89.62 -16.48 56.33 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 115.384 0.914 . . . . 60.14 115.384 175.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.6 t -102.95 119.83 51.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-N 118.162 0.981 . . . . 66.52 109.184 -173.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -69.24 125.88 28.07 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.258 -0.428 . . . . 88.81 109.894 175.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 67.7 m80 -115.37 154.89 28.38 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.414 0.626 . . . . 56.9 109.791 177.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -95.31 124.59 39.43 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.873 -0.788 . . . . 68.97 108.873 169.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.41 HG11 HD21 ' A' ' 75' ' ' LEU . 46.4 t -118.49 133.66 64.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.681 -0.859 . . . . 62.24 108.681 -178.838 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.4 mtm-85 -124.93 128.69 49.01 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.804 -0.813 . . . . 89.71 108.804 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . 1.154 HG12 HD12 ' A' ' 31' ' ' LEU . 19.1 m -119.72 138.47 50.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 N-CA-C 109.23 -0.655 . . . . 65.6 109.23 174.91 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' MSE . . . . . 0.58 ' HB3' ' HB2' ' A' ' 30' ' ' GLU . 1.0 OUTLIER -133.64 117.63 17.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.681 -0.691 . . . . 105.06 109.703 176.421 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.6 t -112.46 116.52 52.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 107.414 -1.328 . . . . 78.33 107.414 175.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.7 p -135.66 111.99 9.81 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 107.694 -1.224 . . . . 90.11 107.694 -178.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 64.48 -116.67 9.33 Favored Glycine 0 C--O 1.237 0.288 0 C-N-CA 120.152 -1.023 . . . . 86.79 110.985 -175.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . . . -116.41 31.29 6.82 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 122.219 -0.577 . . . . 91.79 112.413 -176.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.8 p -132.91 138.54 51.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 N-CA-C 109.19 -0.67 . . . . 84.14 109.19 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.0 tp -112.88 124.7 53.21 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 123.256 0.623 . . . . 69.29 109.907 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.58 ' HB2' ' HB3' ' A' ' 23' ' ' MSE . 42.0 mt-10 -110.35 132.07 54.5 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 123.886 0.874 . . . . 114.76 109.072 178.57 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LEU . . . . . 1.154 HD12 HG12 ' A' ' 22' ' ' VAL . 4.0 tp -134.21 138.79 45.36 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 115.158 -0.928 . . . . 69.71 110.714 -178.186 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . . . -137.75 129.47 28.42 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 124.915 1.385 . . . . 66.98 110.493 177.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 94.7 t -117.41 132.0 68.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 N-CA-C 107.943 -1.132 . . . . 61.41 107.943 173.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.426 ' HB2' ' HG2' ' A' ' 41' ' ' GLN . 18.6 tt0 -135.58 130.28 34.23 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 120.916 -0.313 . . . . 108.45 111.402 -175.032 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -92.54 107.92 19.58 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 107.15 -1.426 . . . . 82.79 107.15 167.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 43.4 mtt180 -65.28 -32.08 73.55 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.623 0.601 . . . . 99.8 112.623 -174.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' MSE . . . . . . . . . . . . . 42.4 ttm -63.06 -41.01 99.37 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.276 0.473 . . . . 83.84 112.276 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 43.6 p -105.6 -2.84 23.01 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.184 0.809 . . . . 76.45 113.184 -177.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 62.16 16.48 8.36 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 124.275 1.03 . . . . 76.11 112.439 -176.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -69.64 135.85 50.43 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 121.849 -0.532 . . . . 82.42 109.927 175.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.453 ' OE1' ' NH1' ' A' ' 43' ' ' ARG . 33.2 mt-30 -131.73 138.58 48.69 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.197 -0.456 . . . . 87.16 109.892 177.852 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 23.9 m-90 -123.09 124.8 43.91 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.268 -1.012 . . . . 63.75 108.268 172.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.453 ' NH1' ' OE1' ' A' ' 41' ' ' GLN . 1.0 OUTLIER -129.76 141.6 50.84 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 119.309 -0.957 . . . . 116.88 110.238 -174.648 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -134.79 144.16 16.05 Favored Glycine 0 N--CA 1.45 -0.411 0 O-C-N 124.92 1.387 . . . . 76.81 113.546 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -123.87 125.68 45.08 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.932 -0.766 . . . . 102.77 108.932 176.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -135.73 128.38 30.81 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.541 -0.54 . . . . 71.89 109.541 -174.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 p30 -92.44 166.02 12.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.817 0.817 . . . . 90.76 110.591 174.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.416 ' HA ' ' CD1' ' A' ' 64' ' ' PHE . . . -57.22 -38.92 74.48 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.186 -0.916 . . . . 76.03 111.815 -175.58 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.26 -44.75 97.16 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 120.107 -1.044 . . . . 85.01 113.06 177.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -62.73 -46.07 89.78 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 122.331 -0.511 . . . . 77.2 111.343 179.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 27.8 mm -59.56 -43.32 90.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-O 120.992 0.425 . . . . 66.88 110.523 -177.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -70.61 -37.26 73.83 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.61 -0.436 . . . . 71.66 111.437 -176.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -58.81 -39.65 81.77 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.025 -0.67 . . . . 114.26 110.897 169.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.424 HD11 ' O ' ' A' ' 134' ' ' PRO . 6.7 tt -64.89 -53.73 41.97 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 120.79 0.329 . . . . 74.76 111.397 -179.682 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.7 p -64.06 -35.76 81.8 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.665 -0.414 . . . . 67.83 111.758 -178.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -63.86 -37.2 86.51 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.332 -0.547 . . . . 90.19 110.796 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . . . -65.93 -26.64 67.68 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.091 0.404 . . . . 63.74 112.091 -177.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' THR . . . . . 0.612 HG22 ' OG ' ' B' ' 94' ' ' SER . 14.0 p -76.06 -5.89 48.56 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.968 0.729 . . . . 61.59 112.968 176.247 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.1 5.48 85.1 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-O 119.263 -0.743 . . . . 71.35 114.576 -174.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.432 ' OD1' ' NZ ' ' A' ' 62' ' ' LYS . 7.0 t-20 -133.23 77.47 1.73 Allowed 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 107.073 -1.455 . . . . 66.44 107.073 -178.43 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -65.02 147.62 53.14 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.75 0.786 . . . . 74.24 111.879 -170.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.432 ' NZ ' ' OD1' ' A' ' 60' ' ' ASN . 44.7 mmtm -141.18 136.78 32.15 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.235 -0.893 . . . . 60.7 109.448 175.282 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 56.9 mm-40 -64.69 152.05 43.39 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.383 0.611 . . . . 70.12 109.956 171.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.416 ' CD1' ' HA ' ' A' ' 48' ' ' ALA . 60.3 t80 -56.95 -44.57 82.69 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.732 -0.667 . . . . 70.05 111.778 -176.808 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -68.42 -32.85 73.18 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.783 -0.767 . . . . 72.66 111.432 -178.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.3 mt -69.51 -43.55 80.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 120.415 -0.514 . . . . 61.19 110.417 176.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -57.06 -45.42 83.26 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 121.952 -0.467 . . . . 57.84 111.148 177.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' CYS . . . . . . . . . . . . . 85.7 m -61.48 -39.23 90.17 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.797 -0.361 . . . . 67.54 111.512 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 7.7 m80 -66.24 -42.16 89.02 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.034 -0.666 . . . . 62.91 111.647 177.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' MSE . . . . . . . . . . . . . 77.5 mtp -59.3 -41.62 89.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.117 0.484 . . . . 59.66 109.764 176.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 15.8 tp -60.32 -44.02 95.85 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.232 -0.895 . . . . 68.68 111.345 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -68.61 -38.95 81.01 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.154 -0.618 . . . . 85.63 111.442 178.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 28.5 m -63.56 -38.28 90.54 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.472 -0.491 . . . . 62.96 111.32 179.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.91 -41.06 97.78 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.579 -0.449 . . . . 53.51 111.042 174.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.41 HD21 HG11 ' A' ' 20' ' ' VAL . 15.7 mt -67.15 -44.21 80.37 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.874 -0.33 . . . . 64.35 111.515 -176.825 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 80.5 p -84.2 -2.64 57.24 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 112.582 0.586 . . . . 68.19 112.582 178.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 58.02 39.24 26.57 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.238 0.615 . . . . 87.63 111.535 177.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 84.8 p -105.31 15.22 27.67 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.812 0.671 . . . . 76.87 112.812 -177.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 5.5 t -145.01 139.45 27.47 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 122.901 0.48 . . . . 94.42 109.794 -177.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . . . -85.53 -9.08 57.89 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.971 1.1 . . . . 71.93 113.971 -171.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 60.2 p -107.55 -12.4 15.28 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 114.054 1.131 . . . . 58.72 114.054 -174.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 8.6 m -118.35 137.84 50.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-N 118.849 0.75 . . . . 58.86 109.285 -175.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . 0.558 HG22 ' HB ' ' A' ' 123' ' ' ILE . 1.3 t -146.89 170.83 16.23 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.385 -0.969 . . . . 61.07 108.385 179.885 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 88.1 mt -123.26 151.73 42.04 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.548 0.69 . . . . 57.24 111.722 -176.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -146.79 158.74 43.98 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 107.976 -1.12 . . . . 67.63 107.976 167.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 23.3 tp -125.1 116.17 21.66 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 107.835 -1.172 . . . . 56.05 107.835 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.8 mp -106.85 144.41 33.53 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.674 -0.491 . . . . 65.12 109.674 -174.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 73.1 p -90.45 -177.6 5.11 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 121.669 0.747 . . . . 67.91 109.483 171.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -73.34 -21.71 60.48 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 119.916 -0.714 . . . . 120.18 112.087 177.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.8 m -65.22 -42.16 93.74 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.679 -0.408 . . . . 78.59 111.09 174.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -66.81 -31.76 72.6 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.083 0.401 . . . . 86.27 112.083 -176.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.9 mt -80.24 -43.82 20.75 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.444 -0.502 . . . . 92.59 112.034 -175.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.18 -28.04 68.46 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.738 -0.785 . . . . 112.35 111.549 178.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 60.7 p -70.88 -38.13 73.05 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.087 -0.645 . . . . 89.82 110.797 171.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 19.5 mt -69.42 -10.61 58.73 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.882 0.697 . . . . 93.58 112.882 174.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 118.556 0.616 . . . . 108.37 111.132 -178.848 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.578 0.228 . . . . 113.42 110.882 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . . . 60.14 25.01 14.32 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.203 0.601 . . . . 107.31 112.135 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 8.5 p -99.05 0.68 44.23 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.983 0.734 . . . . 95.08 112.983 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 8.0 ttmt -69.59 151.12 46.33 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.479 0.657 . . . . 85.97 110.807 -175.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 80.7 mmt-85 -119.51 157.22 28.76 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.672 -0.694 . . . . 70.52 110.068 171.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -128.19 110.82 12.78 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.058 -1.09 . . . . 82.79 108.058 179.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.42 ' CD2' HD21 ' A' ' 31' ' ' LEU . 30.5 tp -79.51 120.1 23.41 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.094 -0.706 . . . . 62.52 109.094 174.587 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 35.6 mm -102.49 120.25 51.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 108.483 -0.932 . . . . 56.74 108.483 -177.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 51.3 tp -91.06 114.47 27.0 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.234 -1.025 . . . . 58.93 108.234 168.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ILE . . . . . 0.558 ' HB ' HG22 ' A' ' 83' ' ' THR . 55.4 mt -103.08 115.75 45.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 108.058 -1.09 . . . . 58.3 108.058 -173.297 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -105.23 110.39 22.75 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 107.348 -1.352 . . . . 57.62 107.348 -176.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 46.9 t -119.45 109.42 15.72 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.387 -0.597 . . . . 66.33 109.387 -174.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 15.9 m -128.13 -176.99 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 108.392 -0.966 . . . . 66.0 108.392 175.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 69.2 tt0 -60.08 -42.14 93.94 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.846 -0.615 . . . . 78.85 112.258 -167.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -119.12 21.87 12.12 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.747 0.647 . . . . 53.02 112.747 -177.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -149.47 145.16 26.75 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 118.091 0.405 . . . . 67.72 109.962 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.714 ' NH1' ' OD2' ' B' ' 85' ' ' ASP . 44.4 ttt-85 -135.84 110.6 8.7 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 106.432 -1.692 . . . . 89.74 106.432 162.039 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 24.9 mm -118.79 139.99 44.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 108.463 -0.94 . . . . 55.31 108.463 -172.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 49.9 m80 -114.5 116.06 28.24 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.593 -0.892 . . . . 78.61 108.593 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -101.14 106.73 46.63 Favored Pre-proline 0 C--O 1.241 0.644 0 N-CA-C 109.113 -0.699 . . . . 67.19 109.113 177.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.424 ' O ' HD11 ' A' ' 54' ' ' LEU . 95.5 Cg_endo -90.76 126.71 1.21 Allowed 'Trans proline' 0 C--O 1.234 0.288 0 CA-C-N 119.39 0.818 . . . . 64.2 114.209 -175.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 70.2 mt -111.57 114.87 52.21 Favored Pre-proline 0 C--O 1.24 0.584 0 N-CA-C 109.592 -0.522 . . . . 60.63 109.592 176.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -79.68 130.43 8.74 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 120.586 0.857 . . . . 61.42 111.408 -178.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 23.3 mt -118.86 100.47 50.86 Favored Pre-proline 0 C--O 1.243 0.745 0 CA-C-N 116.087 -0.506 . . . . 67.28 109.97 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -58.88 147.3 89.88 Favored 'Trans proline' 0 C--O 1.233 0.236 0 CA-C-O 121.64 0.6 . . . . 69.93 112.339 175.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -70.21 142.37 52.41 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.236 -0.893 . . . . 76.21 110.521 177.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 83.61 111.45 -179.581 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.009 -0.08 . . . . 127.77 112.263 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -83.11 107.45 15.69 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 109.009 -0.737 . . . . 151.59 109.009 179.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.56 165.02 41.13 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-O 122.512 1.062 . . . . 125.74 111.64 173.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -117.06 136.21 53.15 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.187 -1.042 . . . . 87.89 108.187 179.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLN . . . . . 0.775 ' HG2' ' HG2' ' B' ' 21' ' ' ARG . 6.5 mt-30 -136.74 123.36 21.02 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 109.387 -0.597 . . . . 111.16 109.387 -173.441 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 15.3 t -136.15 153.41 31.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 109.203 -0.665 . . . . 96.94 109.203 -176.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -88.24 129.94 35.22 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.331 -0.989 . . . . 92.7 108.331 167.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -138.17 136.27 36.47 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.961 -0.755 . . . . 71.63 108.961 -174.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 95.3 t -94.32 119.16 41.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 108.714 -0.847 . . . . 62.04 108.714 -172.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -115.36 110.3 19.16 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 107.923 -1.14 . . . . 62.23 107.923 175.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ARG . . . . . . . . . . . . . 86.3 mtt180 51.95 47.99 23.65 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.973 0.892 . . . . 67.46 111.803 178.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 89.98 -17.08 55.19 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 115.175 0.83 . . . . 77.39 115.175 175.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 59.5 t -102.27 118.43 49.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 118.156 0.978 . . . . 68.5 108.663 -174.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -70.82 125.65 27.43 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.53 -0.544 . . . . 87.46 109.53 176.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -113.89 156.45 23.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.512 0.672 . . . . 62.05 110.268 179.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -95.78 123.61 39.43 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.225 -1.028 . . . . 57.5 108.225 168.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 62.9 t -117.59 133.27 64.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 108.552 -0.907 . . . . 65.81 108.552 -178.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ARG . . . . . 0.775 ' HG2' ' HG2' ' B' ' 8' ' ' GLN . 68.7 mtm-85 -122.86 127.31 48.85 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 108.825 -0.805 . . . . 74.31 108.825 177.359 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.554 HG12 HD13 ' B' ' 31' ' ' LEU . 26.0 m -120.87 136.86 56.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 109.084 -0.709 . . . . 79.53 109.084 175.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' MSE . . . . . . . . . . . . . 28.9 tpp -143.97 118.36 9.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.569 -0.741 . . . . 108.43 109.527 -179.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.0 p -119.92 117.77 54.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 107.987 -1.116 . . . . 84.96 107.987 179.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 30.3 p -135.75 114.71 12.16 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 108.065 -1.087 . . . . 92.0 108.065 -177.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.55 -116.17 8.42 Favored Glycine 0 C--O 1.237 0.298 0 C-N-CA 120.88 -0.676 . . . . 74.66 111.473 -175.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . . . -114.94 30.41 7.37 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 122.126 -0.632 . . . . 82.38 112.41 -176.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 56.1 t -132.76 136.78 55.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 108.575 -0.898 . . . . 75.86 108.575 179.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 5.6 tp -114.65 123.91 50.49 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.734 -0.839 . . . . 69.16 108.734 177.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -110.98 134.18 52.8 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.923 -0.399 . . . . 114.77 109.923 178.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LEU . . . . . 0.554 HD13 HG12 ' B' ' 22' ' ' VAL . 15.4 tp -138.47 129.06 26.31 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.058 -0.719 . . . . 90.1 109.058 -172.534 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' GLU . . . . . 0.512 ' HG2' ' HG3' ' B' ' 43' ' ' ARG . 91.2 mt-10 -135.1 130.55 35.7 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 122.903 0.481 . . . . 93.41 110.153 -179.881 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' VAL . . . . . . . . . . . . . 94.3 t -116.73 132.93 64.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 107.693 -1.225 . . . . 65.68 107.693 171.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -134.03 129.9 36.77 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.603 0.239 . . . . 82.48 110.862 -175.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -92.18 108.15 19.74 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 106.924 -1.51 . . . . 85.74 106.924 167.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ARG . . . . . . . . . . . . . 71.1 mtt-85 -65.03 -34.23 77.94 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.415 -0.514 . . . . 96.26 111.825 -174.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' MSE . . . . . . . . . . . . . 26.2 ttp -66.7 -39.57 88.14 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.677 0.621 . . . . 130.39 112.677 -173.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 44.3 p -102.52 -3.67 26.47 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.849 0.685 . . . . 81.15 112.849 179.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . 62.07 15.97 7.82 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.505 1.122 . . . . 84.72 112.543 -177.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -70.03 134.79 48.64 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.403 -0.591 . . . . 84.01 109.403 174.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -132.69 136.63 46.55 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.546 -0.539 . . . . 91.91 109.546 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' TRP . . . . . . . . . . . . . 24.5 m-90 -122.06 134.12 54.78 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.409 -0.96 . . . . 72.93 108.409 173.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ARG . . . . . 0.512 ' HG3' ' HG2' ' B' ' 32' ' ' GLU . 34.2 ttt85 -133.83 135.38 43.73 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.442 -0.345 . . . . 82.16 110.298 -171.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . -129.75 141.96 13.15 Favored Glycine 0 CA--C 1.502 -0.73 0 N-CA-C 111.825 -0.51 . . . . 61.15 111.825 173.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . . . -125.14 127.21 46.5 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 107.909 -1.145 . . . . 66.37 107.909 175.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -134.64 133.82 40.51 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 110.059 -0.348 . . . . 65.77 110.059 -172.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -88.49 159.56 17.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.455 0.645 . . . . 75.94 109.809 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.57 -39.55 84.43 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.451 -0.795 . . . . 70.16 111.607 -175.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.04 -44.52 97.18 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 120.329 -0.938 . . . . 65.97 112.399 177.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -61.94 -45.89 91.7 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.532 -0.467 . . . . 67.4 111.08 178.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' ILE . . . . . . . . . . . . . 27.7 mm -60.36 -44.4 95.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 121.099 0.476 . . . . 58.92 110.578 -177.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -71.42 -37.89 71.44 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 119.963 -0.695 . . . . 88.73 111.356 -177.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -58.45 -37.62 75.82 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 120.037 -0.665 . . . . 91.69 110.908 171.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.499 HD21 ' HD2' ' B' ' 134' ' ' PRO . 6.7 tt -62.03 -50.37 72.29 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.74 0.305 . . . . 65.88 110.704 179.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 68.7 p -61.21 -34.22 74.73 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.577 -0.449 . . . . 62.03 111.465 179.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -62.06 -38.86 90.37 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.881 -0.328 . . . . 86.53 111.416 176.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . . . -66.78 -27.99 68.03 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.488 -0.485 . . . . 65.59 111.806 -177.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 15.1 p -77.68 -6.85 55.3 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 112.858 0.688 . . . . 62.87 112.858 175.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.87 6.45 85.51 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 115.426 0.93 . . . . 57.62 115.426 -175.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ASN . . . . . 0.6 ' OD1' ' NZ ' ' B' ' 62' ' ' LYS . 6.5 t-20 -132.81 79.31 1.84 Allowed 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 107.377 -1.342 . . . . 64.4 107.377 -177.719 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -63.6 147.59 51.11 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.724 0.773 . . . . 58.8 111.485 -170.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.6 ' NZ ' ' OD1' ' B' ' 60' ' ' ASN . 45.2 mmtm -141.1 134.86 30.3 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.175 -0.92 . . . . 68.65 108.721 174.688 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . . . -64.99 153.18 41.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.31 0.576 . . . . 72.18 110.234 171.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -55.52 -44.66 76.85 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.606 -0.725 . . . . 71.76 111.475 -176.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -69.06 -33.11 73.04 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.259 -0.576 . . . . 102.52 111.334 -179.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ILE . . . . . . . . . . . . . 42.9 mm -68.74 -44.24 82.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 C-N-CA 120.679 -0.409 . . . . 67.86 110.565 177.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -57.98 -46.31 85.37 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 122.103 -0.373 . . . . 61.21 111.469 178.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' CYS . . . . . . . . . . . . . 88.0 m -61.26 -39.61 91.02 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 122.158 -0.339 . . . . 68.36 111.728 -179.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -66.36 -36.34 82.64 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 119.878 -0.729 . . . . 82.7 111.247 178.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' MSE . . . . . . . . . . . . . 79.4 mtp -64.37 -38.88 92.59 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.072 0.463 . . . . 65.76 110.024 174.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 15.7 tp -65.22 -44.25 88.86 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.672 -0.695 . . . . 71.7 111.225 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . . . -68.0 -37.91 82.0 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.624 -0.43 . . . . 78.35 111.388 178.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 21.9 m -63.24 -36.72 84.59 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.608 -0.437 . . . . 81.37 111.455 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ALA . . . . . 0.775 ' HB2' HG12 ' B' ' 82' ' ' VAL . . . -63.61 -42.4 98.21 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.376 -0.53 . . . . 64.28 111.376 175.145 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 17.5 mt -66.64 -42.56 86.53 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.556 -0.458 . . . . 84.91 111.114 -176.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 81.5 p -84.12 -3.28 58.0 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.621 0.6 . . . . 79.09 112.621 176.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 57.33 40.64 27.5 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.259 0.552 . . . . 82.06 111.346 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 84.4 p -104.25 14.5 30.2 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 112.988 0.736 . . . . 90.56 112.988 -176.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' SER . . . . . . . . . . . . . 10.5 t -146.16 139.45 25.92 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.383 -0.969 . . . . 85.7 108.383 -179.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' GLU . . . . . . . . . . . . . . . -85.07 -8.66 58.58 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 113.485 0.92 . . . . 69.57 113.485 -172.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 57.6 p -107.29 1.18 23.66 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 113.509 0.929 . . . . 59.98 113.509 -174.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' VAL . . . . . 0.775 HG12 ' HB2' ' B' ' 74' ' ' ALA . 39.2 t -134.07 132.74 56.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 108.883 -0.784 . . . . 65.48 108.883 -172.688 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' THR . . . . . 0.575 HG22 ' HB ' ' B' ' 123' ' ' ILE . 0.6 OUTLIER -146.21 163.29 35.88 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 124.651 1.22 . . . . 67.53 108.959 -175.221 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.495 ' HG ' ' HB1' ' B' ' 74' ' ' ALA . 84.6 mt -120.15 152.66 37.32 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 124.756 1.285 . . . . 59.06 111.559 -175.73 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ASP . . . . . 0.714 ' OD2' ' NH1' ' A' ' 130' ' ' ARG . 41.9 t0 -147.21 160.54 42.34 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.127 -0.942 . . . . 65.27 108.588 167.269 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 25.0 tp -123.37 118.91 28.57 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 108.506 -0.924 . . . . 62.01 108.506 -177.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' LEU . . . . . . . . . . . . . 18.7 mt -105.04 141.97 35.67 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.392 -0.595 . . . . 76.25 109.392 -173.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 63.2 p -92.72 179.59 5.44 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 122.149 0.976 . . . . 74.5 110.874 172.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -65.24 -30.42 71.31 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.365 -0.834 . . . . 98.77 111.373 172.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' THR . . . . . . . . . . . . . 94.7 m -65.36 -41.05 94.25 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 121.017 -0.273 . . . . 90.06 111.493 -179.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -66.78 -35.93 81.23 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.334 -0.547 . . . . 76.98 112.158 -173.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 2.2 mp -83.77 -23.5 31.49 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.616 -0.833 . . . . 107.69 112.726 -177.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -71.15 -27.17 63.37 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.83 -0.748 . . . . 112.95 111.294 173.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' SER . . . . . 0.612 ' OG ' HG22 ' A' ' 58' ' ' THR . 43.1 t -68.07 -38.88 82.89 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.164 -0.615 . . . . 89.07 110.643 170.568 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 96.2 mt -70.46 -32.91 70.66 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.533 -0.467 . . . . 91.93 111.447 173.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . . . -74.42 -30.29 61.86 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 112.385 0.513 . . . . 105.48 112.385 -178.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ASN . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.2 0 C-N-CA 123.046 0.538 . . . . 114.93 111.788 -179.855 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.877 0.37 . . . . 97.87 111.431 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 7.4 p -99.88 0.17 40.83 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.216 0.821 . . . . 81.71 113.216 178.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 7.9 ttmt -70.69 151.39 44.97 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.669 0.747 . . . . 86.32 111.208 -174.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' ARG . . . . . . . . . . . . . 68.7 mmt-85 -117.47 157.8 25.64 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.437 -0.801 . . . . 81.01 110.204 171.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -129.72 110.63 11.92 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.076 -0.965 . . . . 90.0 108.618 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.55 HD23 HD21 ' B' ' 31' ' ' LEU . 30.8 tp -79.58 122.04 26.01 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.551 -0.537 . . . . 62.0 109.551 174.947 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' ILE . . . . . . . . . . . . . 35.0 mm -101.99 120.8 52.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 108.943 -0.762 . . . . 63.43 108.943 -177.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.638 ' HB3' ' HB2' ' B' ' 133' ' ' TYR . 59.1 tp -90.93 114.71 27.26 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.746 -1.205 . . . . 63.64 107.746 169.163 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' ILE . . . . . 0.575 ' HB ' HG22 ' B' ' 83' ' ' THR . 57.4 mt -104.04 114.21 43.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 108.341 -0.985 . . . . 69.69 108.341 -173.928 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -108.02 111.21 23.16 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.2 1.0 . . . . 59.74 108.769 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 48.3 t -119.99 110.38 16.62 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.493 -0.558 . . . . 63.01 109.493 -174.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 15.2 m -127.16 -176.98 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 108.465 -0.939 . . . . 59.55 108.465 174.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -59.05 -41.63 88.35 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.657 -0.701 . . . . 79.22 112.06 -167.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -119.68 21.72 11.91 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.662 0.616 . . . . 52.91 112.662 -177.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -149.1 144.57 26.74 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.478 0.581 . . . . 64.15 110.162 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 23.5 ttt85 -135.55 110.51 8.81 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 106.922 -1.51 . . . . 79.18 106.922 164.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 24.6 mm -119.48 139.88 45.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 108.847 -0.797 . . . . 46.17 108.847 -172.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -114.91 116.32 28.33 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.567 -0.901 . . . . 61.45 108.567 176.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' TYR . . . . . 0.638 ' HB2' ' HB3' ' B' ' 122' ' ' LEU . 92.4 m-85 -100.74 107.06 47.26 Favored Pre-proline 0 C--O 1.24 0.58 0 N-CA-C 109.33 -0.619 . . . . 58.94 109.33 177.735 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' PRO . . . . . 0.499 ' HD2' HD21 ' B' ' 54' ' ' LEU . 97.1 Cg_endo -91.36 126.16 1.0 Allowed 'Trans proline' 0 C--O 1.234 0.323 0 CA-C-N 119.434 0.834 . . . . 60.91 113.612 -176.878 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' LEU . . . . . . . . . . . . . 68.1 mt -112.31 115.16 50.11 Favored Pre-proline 0 C--O 1.239 0.536 0 N-CA-C 109.372 -0.603 . . . . 59.87 109.372 175.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -79.11 130.04 9.13 Favored 'Trans proline' 0 N--CA 1.473 0.28 0 CA-C-N 119.452 0.84 . . . . 67.32 111.648 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 22.0 mt -118.59 99.04 51.48 Favored Pre-proline 0 C--O 1.246 0.907 0 CA-C-N 115.978 -0.555 . . . . 74.57 109.926 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -59.24 148.36 86.46 Favored 'Trans proline' 0 C--N 1.333 -0.28 0 C-N-CA 120.614 0.876 . . . . 74.73 112.535 175.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -68.59 121.8 17.17 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.022 -0.99 . . . . 91.45 109.617 176.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 . . . . . 0 N--CA 1.463 0.201 0 C-N-CA 123.015 0.526 . . . . 100.36 111.301 -175.477 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' PRO . . . . . 0.936 ' CA ' ' HE1' ' C' ' 23' ' ' MSE . 78.4 Cg_exo . . . . . 0 C--O 1.232 0.184 0 N-CA-C 112.745 0.248 . . . . 130.89 112.745 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' ALA . . . . . . . . . . . . . . . -91.67 91.4 7.98 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 108.621 -0.881 . . . . 116.11 108.621 -176.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' GLY . . . . . . . . . . . . . . . -97.57 164.95 22.18 Favored Glycine 0 N--CA 1.444 -0.803 0 CA-C-N 115.875 -0.602 . . . . 98.68 112.676 178.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' LEU . . . . . . . . . . . . . 25.6 tp -119.07 138.71 52.68 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 123.091 0.556 . . . . 75.56 110.258 179.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 -136.4 122.97 20.92 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.443 -0.947 . . . . 108.37 108.443 -178.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' VAL . . . . . . . . . . . . . 12.9 t -135.14 150.33 29.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 108.568 -0.901 . . . . 83.83 108.568 -177.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -90.25 128.98 36.54 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.878 -0.786 . . . . 121.4 108.878 168.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -139.6 135.36 33.25 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.759 -0.459 . . . . 82.52 109.759 -174.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' VAL . . . . . . . . . . . . . 91.5 t -95.99 120.86 45.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 108.188 -1.041 . . . . 91.57 108.188 -174.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -113.16 110.62 20.72 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.464 -0.939 . . . . 89.92 108.464 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' ARG . . . . . . . . . . . . . 61.8 mtt-85 50.96 47.02 25.55 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.718 0.771 . . . . 98.32 111.485 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.13 -17.35 54.04 Favored Glycine 0 N--CA 1.443 -0.887 0 CA-C-O 119.29 -0.728 . . . . 98.6 114.896 176.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 49.0 t -102.39 115.75 44.84 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 N-CA-C 107.648 -1.241 . . . . 90.96 107.648 -175.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -72.21 124.18 24.49 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.389 -0.368 . . . . 104.53 110.629 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -116.31 155.29 28.67 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.539 0.685 . . . . 83.34 110.502 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.95 125.89 41.7 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.069 -0.969 . . . . 80.99 108.794 167.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' VAL . . . . . . . . . . . . . 62.0 t -117.89 132.81 66.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 108.598 -0.89 . . . . 72.43 108.598 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 60.2 mtm-85 -124.02 127.06 47.33 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.226 0.61 . . . . 89.14 109.398 177.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 13.6 m -122.39 137.39 56.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 N-CA-C 106.998 -1.482 . . . . 71.89 106.998 178.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' MSE . . . . . 0.936 ' HE1' ' CA ' ' C' ' 4' ' ' PRO . 2.8 tpt -137.98 126.44 23.38 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 107.408 -1.33 . . . . 158.55 107.408 177.44 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 57.3 t -110.24 124.24 66.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 106.459 -1.682 . . . . 68.43 106.459 178.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' SER . . . . . . . . . . . . . . . -138.25 111.87 8.22 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.632 -1.247 . . . . 94.85 107.632 -178.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.26 -116.66 9.62 Favored Glycine 0 C--O 1.237 0.31 0 N-CA-C 111.213 -0.755 . . . . 110.35 111.213 -176.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' GLN . . . . . . . . . . . . . 95.2 mm-40 -115.6 30.66 7.21 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 122.909 0.484 . . . . 93.8 111.554 -177.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' VAL . . . . . . . . . . . . . 2.5 t -132.94 137.26 54.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 N-CA-C 108.45 -0.945 . . . . 69.26 108.45 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 6.6 tp -113.6 124.64 52.82 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 107.132 -1.433 . . . . 65.81 107.132 179.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' GLU . . . . . 0.55 ' HG2' ' HG2' ' C' ' 45' ' ' GLU . 65.2 mt-10 -110.86 135.61 51.15 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 124.859 1.35 . . . . 96.63 109.078 178.536 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' LEU . . . . . 0.408 HD21 HD23 ' C' ' 120' ' ' LEU . 25.2 tp -137.64 130.86 30.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.928 -0.578 . . . . 74.25 109.615 -170.993 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -132.71 130.45 40.04 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.389 -0.597 . . . . 82.02 109.389 178.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' VAL . . . . . . . . . . . . . 87.4 t -115.88 134.22 59.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 108.044 -1.095 . . . . 72.51 108.044 173.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -132.87 129.89 39.02 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 109.383 -0.599 . . . . 92.39 109.383 -175.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -91.18 108.28 19.77 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 107.414 -1.328 . . . . 91.9 107.414 170.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' ARG . . . . . . . . . . . . . . . -64.6 -35.09 79.89 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.428 -0.509 . . . . 112.34 111.357 -175.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' MSE . . . . . . . . . . . . . 1.8 ttt -63.97 -36.61 84.55 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 117.974 -1.012 . . . . 172.05 111.514 -178.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' THR . . . . . . . . . . . . . 37.5 p -116.88 -4.66 11.54 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 124.685 1.241 . . . . 106.11 114.046 -172.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' ALA . . . . . . . . . . . . . . . 61.54 15.03 6.4 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.345 1.458 . . . . 87.78 112.874 -176.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -71.61 137.02 47.63 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.971 -0.455 . . . . 83.16 110.849 174.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -130.9 137.32 49.27 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.057 0.456 . . . . 88.06 111.33 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' TRP . . . . . . . . . . . . . 26.0 m-90 -123.77 140.79 52.64 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.604 -0.888 . . . . 65.32 108.604 171.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' ARG . . . . . . . . . . . . . 29.9 ttt-85 -140.32 140.35 35.62 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.589 0.233 . . . . 88.31 110.537 -174.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' GLY . . . . . . . . . . . . . . . -140.25 145.03 15.69 Favored Glycine 0 N--CA 1.452 -0.3 0 N-CA-C 111.426 -0.669 . . . . 70.1 111.426 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' GLU . . . . . 0.55 ' HG2' ' HG2' ' C' ' 30' ' ' GLU . 28.1 mt-10 -123.57 126.78 47.26 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 123.603 0.761 . . . . 100.82 109.369 176.404 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -134.89 128.66 33.04 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.699 -0.482 . . . . 73.59 109.699 -174.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 p30 -92.67 166.12 12.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.652 0.739 . . . . 86.76 110.501 174.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.29 -38.53 71.34 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.521 -0.763 . . . . 77.88 111.687 -174.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.72 -44.7 97.62 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 119.95 -1.119 . . . . 70.21 112.937 177.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -64.19 -47.57 79.27 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 122.249 -0.56 . . . . 67.31 111.28 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' ILE . . . . . . . . . . . . . 26.1 mm -60.94 -44.73 98.63 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-O 120.868 0.366 . . . . 65.93 110.987 -177.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -70.47 -38.14 74.36 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.356 -0.538 . . . . 74.77 111.424 -176.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -59.14 -38.97 80.95 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.715 -0.394 . . . . 101.89 111.001 171.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' LEU . . . . . . . . . . . . . 3.6 tt -63.56 -52.82 59.42 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 120.693 0.282 . . . . 66.45 111.504 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' THR . . . . . . . . . . . . . 60.4 p -62.73 -33.57 75.4 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.569 -0.453 . . . . 55.72 111.698 -179.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' HIS . . . . . . . . . . . . . 39.9 t-80 -61.0 -38.32 85.63 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 111.852 0.316 . . . . 88.28 111.852 176.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' LYS . . . . . . . . . . . . . . . -65.2 -27.25 68.56 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.182 -0.607 . . . . 64.85 111.975 -176.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' THR . . . . . . . . . . . . . 14.1 p -77.1 -6.87 54.51 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 113.112 0.782 . . . . 57.4 113.112 175.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.59 6.02 86.49 Favored Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 115.307 0.883 . . . . 63.82 115.307 -174.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' ASN . . . . . 0.406 ' OD1' ' NZ ' ' C' ' 62' ' ' LYS . 7.0 t-20 -132.54 77.65 1.76 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 106.723 -1.584 . . . . 59.37 106.723 -178.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -65.78 149.12 50.67 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.481 -0.782 . . . . 61.88 111.455 -170.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' LYS . . . . . 0.406 ' NZ ' ' OD1' ' C' ' 60' ' ' ASN . 43.9 mmtm -139.69 136.5 34.31 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.284 -0.871 . . . . 61.57 109.541 175.233 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -64.32 151.68 43.19 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.966 -0.561 . . . . 67.72 109.525 170.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -57.21 -43.62 82.96 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.85 -0.614 . . . . 54.57 111.831 -175.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -68.99 -34.05 74.66 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.327 -0.549 . . . . 69.66 112.0 -177.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' ILE . . . . . . . . . . . . . 18.8 mt -69.76 -42.43 80.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 C-N-CA 120.237 -0.585 . . . . 60.73 110.464 176.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 67' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -56.37 -46.11 80.19 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 122.01 -0.431 . . . . 56.98 111.282 178.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 68' ' ' CYS . . . . . . . . . . . . . 88.0 m -61.13 -39.67 90.92 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.617 -0.433 . . . . 69.43 111.351 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 69' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -66.98 -40.82 87.51 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.517 -0.473 . . . . 58.34 111.411 178.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 70' ' ' MSE . . . . . . . . . . . . . 81.5 mtp -59.21 -41.02 87.6 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.174 0.511 . . . . 67.84 110.381 175.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 16.1 tp -64.92 -42.96 94.25 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.214 -0.903 . . . . 68.56 111.311 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 72' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -67.3 -39.41 85.96 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.349 -0.541 . . . . 105.38 111.002 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 73' ' ' SER . . . . . . . . . . . . . 20.4 m -63.06 -37.0 85.44 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 120.763 -0.375 . . . . 67.09 110.96 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.17 -41.65 97.04 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.832 -0.347 . . . . 61.32 111.373 175.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 12.8 mt -66.84 -43.73 82.92 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.174 -0.61 . . . . 78.15 111.747 -177.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 76' ' ' THR . . . . . . . . . . . . . 82.0 p -83.04 -3.23 57.04 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.474 0.546 . . . . 78.43 112.474 179.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 77' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 57.0 39.12 29.58 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.701 0.763 . . . . 94.54 110.551 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 78' ' ' SER . . . . . . . . . . . . . 81.8 p -104.83 15.38 27.94 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 123.539 0.736 . . . . 84.87 112.077 -177.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 79' ' ' SER . . . . . . . . . . . . . 12.5 t -144.72 138.82 27.49 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.015 -0.735 . . . . 83.89 109.015 -177.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 80' ' ' GLU . . . . . . . . . . . . . . . -85.66 -9.42 57.25 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.535 0.939 . . . . 74.2 113.535 -172.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 81' ' ' SER . . . . . . . . . . . . . 59.9 p -107.77 -7.21 16.41 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 114.093 1.146 . . . . 62.82 114.093 -174.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 8.7 m -127.92 137.14 58.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 CA-C-N 119.054 0.843 . . . . 60.95 109.804 -176.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.09 173.14 11.77 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 108.485 -0.931 . . . . 63.37 108.485 174.16 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 84' ' ' LEU . . . . . . . . . . . . . 86.1 mt -121.72 152.09 39.79 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.858 -0.61 . . . . 71.99 110.63 -176.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 85' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -147.41 156.81 43.22 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 108.573 -0.899 . . . . 75.42 108.573 169.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 23.7 tp -126.14 113.81 17.54 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.99 -0.744 . . . . 67.04 108.99 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 87' ' ' LEU . . . . . . . . . . . . . 10.3 mp -111.99 148.73 33.18 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 123.561 0.744 . . . . 66.45 111.799 -174.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 88' ' ' THR . . . . . . . . . . . . . 72.8 p -88.97 175.0 7.6 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.818 -1.179 . . . . 65.08 107.818 165.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 89' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -65.08 -33.93 77.2 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 118.353 -1.339 . . . . 80.34 111.647 -178.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 90' ' ' THR . . . . . . . . . . . . . 96.0 m -62.23 -43.12 99.56 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.28 -0.568 . . . . 100.75 110.993 175.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 91' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -67.89 -33.4 74.65 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 122.27 -0.269 . . . . 94.47 111.337 -178.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 92' ' ' LEU . . . . . 0.751 HD13 ' O ' ' C' ' 92' ' ' LEU . 2.1 tm? -66.29 -40.85 90.32 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 117.765 -1.112 . . . . 97.82 111.491 -178.31 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -75.83 -30.56 59.01 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 125.02 1.45 . . . . 121.47 108.801 -177.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 94' ' ' SER . . . . . . . . . . . . . 47.3 m -63.54 -43.09 98.1 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 118.181 -1.408 . . . . 96.33 108.347 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.22 -42.34 96.63 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 107.325 -1.361 . . . . 115.32 107.325 175.311 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 96' ' ' ARG . . . . . . . . . . . . . . . -63.78 -38.62 91.79 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 118.041 -0.981 . . . . 120.77 109.863 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 97' ' ' ASN . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.344 0 O-C-N 125.404 1.69 . . . . 120.6 108.741 -178.26 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 111' ' ' SER . . . . . . . . . . . . . 6.4 p . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 118.593 -0.718 . . . . 129.38 109.353 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 112' ' ' ALA . . . . . . . . . . . . . . . -80.28 -7.97 59.27 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 124.754 1.283 . . . . 110.63 112.652 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 113' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -61.82 137.36 58.24 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.106 0.479 . . . . 85.43 110.639 177.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 114' ' ' LEU . . . . . . . . . . . . . 89.2 mt -85.32 121.65 28.36 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.022 -0.732 . . . . 69.27 109.022 179.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 115' ' ' ASN . . . . . . . . . . . . . 62.3 t-20 -167.46 104.78 0.52 Allowed 'General case' 0 C--O 1.235 0.309 0 N-CA-C 107.621 -1.252 . . . . 78.68 107.621 -165.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 116' ' ' SER . . . . . . . . . . . . . 7.4 p -93.65 1.36 56.64 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.346 0.499 . . . . 71.47 112.346 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 117' ' ' LYS . . . . . 0.659 ' HG2' ' HA ' ' C' ' 138' ' ' PRO . 16.7 mtmt -69.34 155.93 39.63 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 122.117 0.961 . . . . 66.74 110.772 -177.598 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 118' ' ' ARG . . . . . . . . . . . . . 81.6 mmt-85 -115.65 156.59 25.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.991 -1.004 . . . . 69.59 108.363 169.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 119' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -126.1 110.32 13.39 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.519 -0.919 . . . . 67.18 108.519 -177.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 120' ' ' LEU . . . . . 0.408 HD23 HD21 ' C' ' 31' ' ' LEU . 29.5 tp -78.47 120.26 22.94 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 107.843 -1.169 . . . . 60.58 107.843 173.848 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 121' ' ' ILE . . . . . . . . . . . . . 33.2 mm -100.98 118.71 48.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 107.792 -1.188 . . . . 55.9 107.792 -177.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 122' ' ' LEU . . . . . . . . . . . . . 50.6 tp -89.78 114.31 25.99 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 106.792 -1.558 . . . . 56.61 106.792 169.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 123' ' ' ILE . . . . . . . . . . . . . 58.7 mt -103.36 114.24 42.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 107.886 -1.153 . . . . 55.75 107.886 -173.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 124' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -106.08 109.77 21.82 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.694 -1.224 . . . . 60.76 107.694 -177.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 125' ' ' SER . . . . . . . . . . . . . 47.5 t -119.96 109.68 15.81 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.228 -0.656 . . . . 61.21 109.228 -174.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 126' ' ' VAL . . . . . . . . . . . . . 16.0 m -127.52 -176.68 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 108.337 -0.986 . . . . 63.31 108.337 175.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 127' ' ' GLU . . . . . . . . . . . . . 69.0 tt0 -59.3 -41.95 90.18 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.761 -0.654 . . . . 96.64 112.071 -167.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 128' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -119.07 22.88 11.67 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.632 0.604 . . . . 61.43 112.632 -177.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 129' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -148.6 144.48 27.25 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 121.373 0.606 . . . . 82.23 109.983 178.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 130' ' ' ARG . . . . . . . . . . . . . 10.8 tpp180 -134.84 109.34 8.46 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 106.468 -1.679 . . . . 89.36 106.468 164.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 131' ' ' ILE . . . . . . . . . . . . . 23.2 mm -122.18 137.98 53.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 N-CA-C 109.433 -0.58 . . . . 57.81 109.433 -173.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 132' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -115.03 117.32 30.25 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.108 -1.071 . . . . 73.01 108.108 175.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 133' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -100.04 106.66 42.74 Favored Pre-proline 0 C--O 1.241 0.607 0 N-CA-C 108.563 -0.903 . . . . 63.59 108.563 177.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 134' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -90.15 127.24 1.44 Allowed 'Trans proline' 0 C--N 1.331 -0.368 0 CA-C-N 119.39 0.818 . . . . 60.21 112.888 -175.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 135' ' ' LEU . . . . . . . . . . . . . 67.9 mt -111.13 113.6 54.35 Favored Pre-proline 0 C--O 1.242 0.662 0 N-CA-C 109.609 -0.515 . . . . 54.46 109.609 176.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 136' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -78.99 129.68 9.06 Favored 'Trans proline' 0 C--N 1.332 -0.314 0 CA-C-N 119.266 0.774 . . . . 60.05 110.388 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 137' ' ' LEU . . . . . . . . . . . . . 24.1 mt -118.64 102.39 49.84 Favored Pre-proline 0 C--O 1.243 0.72 0 N-CA-C 109.407 -0.59 . . . . 60.94 109.407 -179.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 138' ' ' PRO . . . . . 0.659 ' HA ' ' HG2' ' C' ' 117' ' ' LYS . 75.8 Cg_exo -56.97 146.92 77.52 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 120.25 0.633 . . . . 63.25 112.305 177.31 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 139' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -69.83 137.0 51.42 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.025 -0.989 . . . . 77.06 110.857 179.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 140' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 -110.89 14.95 22.05 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.661 0.615 . . . . 74.7 112.661 -177.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 141' ' ' GLY . . . . . . . . . . . . . . . 75.96 -147.98 35.73 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.434 -0.889 . . . . 83.99 111.229 -174.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 142' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -124.54 76.75 63.26 Favored Pre-proline 0 C--O 1.242 0.674 0 N-CA-C 108.683 -0.858 . . . . 100.35 108.683 177.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 143' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo . . . . . 0 C--N 1.342 0.231 0 C-N-CA 120.874 1.049 . . . . 112.87 112.49 177.78 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . 0.501 ' O ' ' N ' ' A' ' 6' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_