data_6orc_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 6orc _Structure_validation_residue.Date_analyzed 2020-05-01 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 ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.527 0.089 0 CA-C-O 120.582 0.23 . . . . 78.719999999999999 111.055 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . . . -70.99 -3.04 17.39 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 113.119 0.785 . . . . 92.140000000000001 113.119 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -62.54 -45.24 93.85 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 118.64 0.654 . . . . 104.62 110.911 175.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.7 mp -79.63 -25.05 41.5 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.077 0.399 . . . . 68.269999999999996 112.077 177.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' MSE . . . . . . . . . . . . . 72.9 mtp -72.81 -41.13 65.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 117.861 0.301 . . . . 104.54000000000001 111.096 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -69.26 -36.02 76.7 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.176 -0.609 . . . . 91.849999999999994 111.202 176.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.16 -45.84 86.65 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.513 -0.475 . . . . 55.140000000000001 110.968 176.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -67.23 -34.84 78.32 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.58 -0.448 . . . . 60.810000000000002 111.385 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.6 t -71.14 -37.12 72.28 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.469 -0.492 . . . . 71.400000000000006 111.423 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 33.3 m-20 -69.26 -37.05 77.71 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.229 -0.589 . . . . 41.600000000000001 111.27 178.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.68 -36.41 84.18 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.363 -0.535 . . . . 36.799999999999997 111.202 178.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -70.09 -30.93 68.27 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.483 -0.487 . . . . 64.680000000000007 111.776 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.9 p -74.63 -20.12 60.03 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.491 0.552 . . . . 59.549999999999997 112.491 -179.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.03 14.59 4.55 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 121.049 -0.596 . . . . 39.490000000000002 114.344 177.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -75.71 107.41 7.85 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.45 -0.944 . . . . 44.850000000000001 108.45 177.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 26.8 m -67.49 -28.14 41.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 C-N-CA 120.294 -0.562 . . . . 28.050000000000001 111.138 -177.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' SER . . . . . 0.474 ' OG ' ' O ' ' B' ' 52' ' ' GLY . 74.2 m -71.16 -38.28 72.2 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.042 -0.663 . . . . 49.539999999999999 111.04 175.831 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.91 -36.11 77.64 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.409 -0.516 . . . . 29.710000000000001 111.163 176.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -64.75 -38.84 92.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.527 -0.469 . . . . 36.649999999999999 111.216 178.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -71.0 -44.23 66.33 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.325 -0.55 . . . . 40.119999999999997 111.224 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.4 tp10 -62.28 -40.62 96.86 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.43 -0.508 . . . . 86.459999999999994 111.042 176.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 18.6 tp -66.26 -32.14 73.37 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.355 -0.538 . . . . 37.759999999999998 111.38 176.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -65.9 -38.25 88.23 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.52 -0.472 . . . . 41.75 111.178 175.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 55.6 ttp85 -68.09 -36.32 79.6 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.569 -0.453 . . . . 67.879999999999995 111.301 179.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 90.5 mtt-85 -68.52 -39.11 81.31 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.294 -0.563 . . . . 59.280000000000001 111.395 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -65.77 -34.14 77.5 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.154 -0.619 . . . . 54.880000000000003 111.517 175.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 44.6 tp -76.05 -40.57 53.02 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.829 -0.348 . . . . 71.340000000000003 111.743 -176.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 23.1 m-20 -94.84 -3.24 49.25 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.074 0.768 . . . . 73.680000000000007 113.074 -177.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 66.36 21.11 70.13 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.435 -0.888 . . . . 51.890000000000001 114.439 -176.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -86.84 105.22 16.88 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.723 -0.843 . . . . 89.569999999999993 108.723 -178.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.25 -24.87 8.65 Favored Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 114.902 0.721 . . . . 44.670000000000002 114.902 -178.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 76.1 mt -128.98 169.58 14.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 118.133 0.966 . . . . 78.090000000000003 109.07 178.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -70.91 139.38 50.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.726 -0.67 . . . . 72.049999999999997 109.988 176.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 11.7 tm0? -63.24 105.64 0.76 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.984 -0.553 . . . . 70.650000000000006 110.403 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -126.94 112.53 15.39 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.182 -1.044 . . . . 53.810000000000002 108.182 -178.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -75.31 -36.86 61.05 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.68 -0.408 . . . . 92.390000000000001 111.722 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -64.93 -35.41 81.08 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.447 -0.501 . . . . 79.75 111.248 -179.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -79.05 -29.66 43.63 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 112.123 0.416 . . . . 57.229999999999997 112.123 178.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.91 -43.58 82.96 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.297 -0.561 . . . . 35.189999999999998 111.284 179.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.8 tp -72.65 -28.91 28.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.265 -0.574 . . . . 46.020000000000003 110.639 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 48.8 ttt-85 -64.87 -44.51 89.45 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.848 -0.533 . . . . 58.770000000000003 111.359 179.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -73.37 -30.19 63.13 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.12 -0.632 . . . . 38.259999999999998 111.725 178.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 40.2 tp -68.16 -39.55 82.57 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.057 -0.657 . . . . 51.170000000000002 111.062 176.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ARG . . . . . 0.629 ' NH2' ' OH ' ' A' ' 64' ' ' TYR . 31.6 mmt180 -59.59 -44.83 93.23 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.936 0.398 . . . . 65.75 110.865 173.135 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' MSE . . . . . . . . . . . . . 6.5 ttm -68.41 -33.86 74.98 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 122.545 0.338 . . . . 107.31999999999999 111.549 -176.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.45 -37.5 43.42 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.512 -0.475 . . . . 34.869999999999997 111.486 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -67.06 -54.24 23.39 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.539 -0.464 . . . . 32.93 110.925 177.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -65.77 -20.1 66.14 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.606 -0.438 . . . . 88.379999999999995 112.013 175.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -71.56 -21.17 78.78 Favored Glycine 0 C--N 1.336 0.555 0 CA-C-O 119.503 -0.609 . . . . 32.789999999999999 113.896 174.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 119.17 7.96 9.79 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 115.169 0.828 . . . . 38.420000000000002 115.169 174.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.2 tp -80.96 119.59 76.47 Favored Pre-proline 0 C--O 1.237 0.418 0 CA-C-N 117.394 0.597 . . . . 42.350000000000001 109.813 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -64.66 -38.73 30.21 Favored 'Trans proline' 0 C--O 1.237 0.466 0 CA-C-N 119.169 0.739 . . . . 48.859999999999999 113.41 -179.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -64.48 -31.76 73.1 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.303 -0.559 . . . . 81.569999999999993 111.485 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.41 -34.58 61.06 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.64 -0.424 . . . . 36.380000000000003 111.83 175.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -68.48 -35.39 77.48 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.446 -0.502 . . . . 43.590000000000003 111.164 177.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.69 -41.51 71.89 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.37 -0.532 . . . . 61.729999999999997 111.198 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -66.57 -38.47 93.37 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 120.023 -1.084 . . . . 55.530000000000001 112.502 177.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 29.5 tp -67.4 -31.47 71.71 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 122.263 -0.551 . . . . 47.57 111.392 176.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.84 -28.77 68.28 Favored Glycine 0 C--N 1.335 0.506 0 C-N-CA 120.228 -0.987 . . . . 56.450000000000003 113.053 176.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 87.5 t90 -69.37 -33.6 73.29 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.224 -0.59 . . . . 61.329999999999998 111.534 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' MSE . . . . . . . . . . . . . 54.3 mtt -65.02 -34.22 77.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.739 0.304 . . . . 104.19 111.364 -179.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' TYR . . . . . 0.629 ' OH ' ' NH2' ' A' ' 46' ' ' ARG . 54.4 m-85 -74.61 -23.01 58.65 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.356 -0.537 . . . . 62.920000000000002 112.168 173.427 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -83.06 -30.46 28.01 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.162 0.431 . . . . 60.390000000000001 112.162 179.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -104.62 -4.32 22.68 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 113.269 0.84 . . . . 63.479999999999997 113.269 -178.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.47 38.02 79.29 Favored Glycine 0 C--O 1.238 0.367 0 C-N-CA 120.562 -0.827 . . . . 53.509999999999998 113.399 -176.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -102.69 117.45 34.69 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.197 -0.668 . . . . 81.689999999999998 109.197 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 78.92 -28.85 2.14 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.447 -0.406 . . . . 49.729999999999997 113.398 179.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 29.0 m -133.82 165.11 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 N-CA-C 108.342 -0.984 . . . . 60.350000000000001 108.342 178.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -70.18 144.04 52.08 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.43 -0.804 . . . . 80.609999999999999 110.258 177.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -64.85 112.11 3.12 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.881 -0.599 . . . . 69.980000000000004 110.962 -177.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -129.04 109.07 10.89 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.184 -1.043 . . . . 69.609999999999999 108.184 177.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -67.05 -25.08 66.08 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.422 0.527 . . . . 82.400000000000006 112.422 179.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 93.6 m -74.54 -48.15 28.61 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.497 -0.481 . . . . 61.890000000000001 111.077 179.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 26.4 mt -67.71 -28.8 67.97 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.34 -0.544 . . . . 59.57 111.734 178.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 41.0 t -68.93 -36.72 78.31 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.103 -0.639 . . . . 53.549999999999997 111.128 175.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -69.0 -40.08 78.94 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.438 -0.505 . . . . 69.090000000000003 111.299 178.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 60.7 p -68.57 -37.3 79.77 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.413 -0.515 . . . . 57.340000000000003 111.498 -177.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 56.3 m95 -73.31 -39.9 64.92 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.029 -0.669 . . . . 42.689999999999998 111.369 178.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -65.94 -30.38 70.95 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 119.919 -0.713 . . . . 59.420000000000002 111.535 174.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -66.54 -43.32 85.45 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.611 -0.435 . . . . 66.519999999999996 111.32 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 -62.86 -41.65 99.45 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.429 -0.508 . . . . 68.840000000000003 111.252 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -72.34 -26.65 62.0 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.114 -0.634 . . . . 49.82 111.607 178.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -75.6 -40.51 56.37 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.525 -0.47 . . . . 55.649999999999999 111.479 177.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.69 -35.89 72.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-O 120.999 0.428 . . . . 57.770000000000003 110.354 175.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.73 -38.79 92.18 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 121.915 -0.491 . . . . 57.560000000000002 111.35 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 127.79 15.74 2.33 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 121.089 -0.576 . . . . 80.189999999999998 114.146 177.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -71.37 124.08 90.39 Favored Pre-proline 0 C--O 1.239 0.517 0 N-CA-C 109.303 -0.628 . . . . 73.170000000000002 109.303 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -68.25 -38.71 11.49 Favored 'Trans proline' 0 C--O 1.238 0.48 0 CA-C-N 119.347 0.803 . . . . 68.670000000000002 113.567 -173.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 40.2 t -68.2 -34.03 64.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 120.173 -0.611 . . . . 68.099999999999994 110.771 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.36 -32.42 64.5 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 121.813 -0.554 . . . . 66.959999999999994 111.772 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -68.38 -32.79 73.11 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.247 -0.581 . . . . 80.5 111.604 177.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -70.34 -43.75 69.59 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.335 -0.546 . . . . 103.93000000000001 111.2 175.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' MSE . . . . . . . . . . . . . 8.6 mmt -64.62 -28.23 69.48 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.866 0.321 . . . . 127.45 111.866 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 11.3 tp -76.38 -42.77 43.42 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.117 -0.633 . . . . 86.159999999999997 111.532 -178.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -62.48 -31.33 79.25 Favored Glycine 0 C--N 1.335 0.516 0 C-N-CA 120.118 -1.039 . . . . 75.689999999999998 112.745 175.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 53.3 ttt85 -66.18 -37.16 84.93 Favored 'General case' 0 C--O 1.237 0.396 0 O-C-N 122.323 -0.516 . . . . 102.58 111.102 174.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -70.16 -29.38 66.26 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.502 -0.479 . . . . 73.579999999999998 111.858 179.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' TYR . . . . . 0.405 ' O ' ' N ' ' A' ' 109' ' ' ASP . 14.3 m-85 -74.93 -36.75 62.13 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.202 -0.599 . . . . 118.52 111.69 -175.311 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -80.18 -27.13 38.98 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 119.808 -0.757 . . . . 124.48 112.142 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -90.11 -17.95 26.74 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.136 0.791 . . . . 92.560000000000002 113.136 -178.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 74.23 26.55 68.08 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.639 -0.791 . . . . 89.540000000000006 114.27 -178.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 2.3 pt -97.02 115.66 37.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 107.72 -1.215 . . . . 106.77 107.72 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 81.03 -5.41 66.34 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-O 119.064 -0.853 . . . . 72.049999999999997 115.15 -176.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 3.2 p -159.52 169.29 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-N 118.54 1.17 . . . . 83.319999999999993 108.166 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.41 138.22 55.15 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.067 0.461 . . . . 82.819999999999993 110.222 176.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . . . -64.0 136.37 57.26 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.965 -0.561 . . . . 98.799999999999997 110.476 -179.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ASP . . . . . 0.459 ' OD2' ' N ' ' A' ' 112' ' ' LEU . 17.5 t70 -156.34 138.81 14.9 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.323 -0.621 . . . . 107.84 109.323 -178.054 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 23.3 mmt180 -97.92 -30.33 12.8 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.898 0.703 . . . . 118.83 112.898 176.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 45.7 t -68.4 -39.3 80.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 120.89 0.376 . . . . 133.96000000000001 110.586 -179.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LEU . . . . . 0.459 ' N ' ' OD2' ' A' ' 109' ' ' ASP . 9.8 mp -82.03 -26.27 33.93 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 121.835 -0.541 . . . . 118.64 112.099 -179.792 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.47 -35.93 78.25 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.411 -0.516 . . . . 71.120000000000005 111.33 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -69.53 -30.07 67.81 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.303 -0.559 . . . . 100.2 111.658 179.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -63.37 -51.39 66.07 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.522 -0.471 . . . . 133.87 111.083 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -66.97 -29.71 69.64 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.111 -0.636 . . . . 89.810000000000002 111.646 178.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 13.8 m-30 -66.61 -34.92 78.96 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.116 -0.634 . . . . 88.719999999999999 110.798 169.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -73.44 -30.5 63.25 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.883 -0.327 . . . . 112.08 111.549 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -80.98 -40.89 23.64 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.931 -0.307 . . . . 97.430000000000007 111.649 179.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -69.26 -40.53 77.79 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.283 -0.567 . . . . 67.890000000000001 111.289 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.69 -24.83 64.54 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.053 0.39 . . . . 95.840000000000003 112.053 176.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -70.39 -26.99 63.96 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.116 -0.634 . . . . 94.629999999999995 111.573 177.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.9 mt-30 -88.68 -0.28 57.14 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 112.747 0.647 . . . . 100.55 112.747 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 100.25 12.03 40.35 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 116.159 1.224 . . . . 83.359999999999999 116.159 175.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -66.66 126.51 29.17 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.701 1.251 . . . . 93.299999999999997 110.01 179.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLU . . . . . 0.66 ' OE2' ' NZ ' ' B' ' 129' ' ' LYS . 59.6 mm-40 -73.99 -40.55 62.88 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.209 -0.45 . . . . 145.86000000000001 111.72 -173.645 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -77.34 -9.39 58.81 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 113.09 0.774 . . . . 110.2 113.09 179.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -85.64 -17.78 35.12 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 112.915 0.709 . . . . 117.14 112.915 -179.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -98.95 -10.22 23.05 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.279 0.844 . . . . 127.17 113.279 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -70.71 -47.13 61.38 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 118.474 0.579 . . . . 114.59999999999999 110.823 174.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 7.7 tpp180 -71.37 -29.47 64.99 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.7 -0.4 . . . . 123.48 111.493 175.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 21.0 tp -65.06 -30.58 71.55 Favored 'General case' 0 C--O 1.238 0.447 0 N-CA-C 112.042 0.386 . . . . 129.78999999999999 112.042 -175.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -94.78 -27.48 15.76 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.165 0.802 . . . . 126.39 113.165 177.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -85.31 51.64 2.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 122.085 0.945 . . . . 122.8 110.482 170.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' TRP . . . . . . . . . . . . . 69.0 t-105 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 115.538 -0.755 . . . . 127.95 111.833 -167.871 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 N--CA 1.46 0.028 0 CA-C-O 120.663 0.268 . . . . 113.34999999999999 111.197 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 96.5 t -84.34 -38.76 13.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 C-N-CA 120.557 -0.457 . . . . 106.20999999999999 110.77 178.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . . . -64.44 -45.27 88.22 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 121.886 -0.509 . . . . 98.719999999999999 111.071 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ARG . . . . . . . . . . . . . . . -65.2 -30.02 70.88 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.514 -0.475 . . . . 106.17 111.979 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -68.31 -40.99 81.53 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.182 -0.607 . . . . 90.420000000000002 111.367 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 67.1 mt -79.96 -29.98 39.73 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.481 -0.488 . . . . 68.930000000000007 112.058 178.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' MSE . . . . . . . . . . . . . 92.6 mtp -68.19 -36.78 80.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 117.949 0.341 . . . . 126.37 110.394 176.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -66.02 -34.19 77.51 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.107 -0.637 . . . . 93.840000000000003 111.325 173.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 50.9 tp -66.87 -41.89 86.51 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.245 -0.582 . . . . 60.890000000000001 111.063 177.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -72.15 -36.35 69.31 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.163 -0.615 . . . . 52.649999999999999 111.315 177.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 37.2 t -66.03 -38.13 87.62 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.24 -0.584 . . . . 82.599999999999994 111.147 179.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -74.65 -33.11 62.46 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.156 -0.618 . . . . 76.239999999999995 111.536 175.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.07 -43.26 79.0 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.371 -0.532 . . . . 43.060000000000002 111.138 177.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -67.79 -20.6 65.21 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 112.219 0.452 . . . . 73.260000000000005 112.219 176.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' SER . . . . . . . . . . . . . 37.5 m -72.35 -52.65 15.18 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.599 -0.441 . . . . 57.829999999999998 111.04 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 153.29 5.92 0.11 Allowed Glycine 0 N--CA 1.45 -0.417 0 O-C-N 122.172 -0.33 . . . . 53.689999999999998 112.709 -179.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -70.09 108.73 4.22 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 109.235 -0.654 . . . . 45.049999999999997 109.235 179.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 18.1 m -67.55 -26.01 34.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 C-N-CA 120.408 -0.517 . . . . 36.350000000000001 110.992 -178.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' SER . . . . . . . . . . . . . 61.9 m -71.72 -42.97 66.68 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.097 -0.641 . . . . 52.840000000000003 111.1 175.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.22 -33.95 76.91 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.369 -0.533 . . . . 37.649999999999999 111.425 175.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -65.48 -40.18 92.82 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.454 -0.498 . . . . 51.700000000000003 111.151 175.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -73.43 -40.77 63.98 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.276 -0.569 . . . . 44.409999999999997 111.277 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -62.12 -39.96 94.3 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.223 -0.591 . . . . 82.909999999999997 110.95 176.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 20.6 tp -69.21 -22.76 63.86 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.643 -0.423 . . . . 40.390000000000001 111.857 174.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 30.2 t -72.65 -46.54 53.46 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.674 -0.41 . . . . 49.920000000000002 111.229 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -69.45 -23.72 63.7 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.391 -0.524 . . . . 89.420000000000002 112.362 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -71.0 -40.9 71.57 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.127 -0.629 . . . . 64.859999999999999 111.139 176.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -66.76 -29.96 70.05 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.419 -0.512 . . . . 55.119999999999997 111.581 174.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 27.7 tp -79.58 -52.76 7.59 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 121.023 -0.271 . . . . 50.700000000000003 111.433 -177.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -83.2 -1.08 52.14 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 113.19 0.811 . . . . 64.609999999999999 113.19 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . 66.95 15.81 65.41 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.438 -0.886 . . . . 49.68 114.38 -175.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -74.67 104.04 5.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.74 0.77 . . . . 79.379999999999995 109.103 -176.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.5 -7.77 37.76 Favored Glycine 0 N--CA 1.447 -0.594 0 N-CA-C 115.472 0.949 . . . . 53.109999999999999 115.472 179.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 84.1 mt -139.19 160.32 40.07 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.661 1.231 . . . . 71.140000000000001 109.013 179.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -66.92 137.43 56.54 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.548 -0.751 . . . . 84.939999999999998 110.077 175.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? -63.19 120.68 11.97 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.893 -0.594 . . . . 67.840000000000003 110.479 -175.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 40.0 t-20 -140.66 105.56 4.96 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 107.862 -1.162 . . . . 55.890000000000001 107.862 -178.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -71.61 -31.37 66.84 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.333 -0.547 . . . . 78.579999999999998 111.882 -179.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -68.19 -38.31 81.88 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.249 -0.581 . . . . 88.829999999999998 111.281 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -78.42 -25.26 45.97 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.544 -0.462 . . . . 59.100000000000001 112.061 177.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.61 -45.92 70.66 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.475 -0.49 . . . . 35.229999999999997 111.101 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 10.0 tp -71.68 -27.67 28.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 C-N-CA 120.418 -0.513 . . . . 41.450000000000003 110.683 178.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 32.0 ttt180 -65.95 -49.19 68.77 Favored 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.761 -0.587 . . . . 55.939999999999998 111.095 179.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 89.7 m95 -71.98 -31.17 65.99 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.222 -0.591 . . . . 49.780000000000001 111.715 178.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 51.5 tp -65.12 -47.13 78.21 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.358 -0.537 . . . . 40.770000000000003 110.936 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 60.8 ttm-85 -65.6 -33.19 75.34 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.529 -0.468 . . . . 45.520000000000003 111.505 179.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' MSE . . . . . . . . . . . . . 25.8 ttm -70.0 -36.4 75.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.819 0.342 . . . . 77.390000000000001 110.595 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.16 -32.39 63.1 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.266 -0.574 . . . . 35.32 111.468 175.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -69.97 -42.23 73.43 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.457 -0.497 . . . . 31.449999999999999 111.112 176.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -66.38 -27.47 67.89 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.362 -0.535 . . . . 72.650000000000006 111.477 174.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . -72.43 -11.25 76.22 Favored Glycine 0 C--N 1.334 0.441 0 CA-C-O 119.027 -0.874 . . . . 32.18 114.629 178.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' GLY . . . . . 0.474 ' O ' ' OG ' ' A' ' 19' ' ' SER . . . 104.74 15.06 21.72 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 116.065 1.186 . . . . 39.009999999999998 116.065 177.599 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 49.7 tp -84.27 118.83 72.17 Favored Pre-proline 0 C--O 1.236 0.393 0 CA-C-N 118.683 1.241 . . . . 28.649999999999999 109.763 179.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -62.79 -40.42 36.24 Favored 'Trans proline' 0 C--O 1.238 0.484 0 CA-C-N 119.169 0.739 . . . . 39.469999999999999 113.537 -177.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -63.74 -36.63 84.5 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.199 -0.6 . . . . 82.260000000000005 111.173 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.71 -37.13 73.51 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.18 -0.608 . . . . 25.719999999999999 111.062 175.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -65.89 -37.79 87.06 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.438 -0.505 . . . . 35.130000000000003 111.114 175.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.62 -39.74 73.57 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.404 -0.518 . . . . 39.090000000000003 111.234 177.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . -67.82 -37.64 88.65 Favored Glycine 0 C--N 1.334 0.454 0 C-N-CA 119.983 -1.103 . . . . 49.920000000000002 112.498 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 30.9 tp -67.43 -30.68 70.48 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 122.241 -0.564 . . . . 48.530000000000001 111.434 176.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.55 -26.95 66.38 Favored Glycine 0 C--N 1.334 0.454 0 C-N-CA 120.322 -0.942 . . . . 44.609999999999999 113.223 177.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' TRP . . . . . . . . . . . . . 88.1 t90 -70.46 -31.74 69.0 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.125 -0.63 . . . . 66.120000000000005 111.539 177.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' MSE . . . . . . . . . . . . . 49.3 mtt -70.79 -32.78 69.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.6 0.238 . . . . 52.75 111.137 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -74.17 -22.82 59.25 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.177 -0.609 . . . . 52.189999999999998 112.054 173.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -84.06 -45.0 13.53 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 112.26 0.467 . . . . 55.369999999999997 112.26 176.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.96 -27.61 26.39 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.269 -0.573 . . . . 44.469999999999999 112.279 -179.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.68 46.95 4.71 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.97 -0.633 . . . . 61.210000000000001 113.7 177.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -119.38 133.97 55.45 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 109.189 -0.671 . . . . 101.33 109.189 173.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 82.39 -36.12 2.61 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 116.291 -0.413 . . . . 66.25 112.419 -178.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 16.0 m -137.03 157.18 35.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 N-CA-C 108.173 -1.047 . . . . 69.620000000000005 108.173 176.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -64.65 148.81 50.2 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.533 -0.758 . . . . 68.0 110.27 176.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -63.66 117.77 7.3 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.69 -0.686 . . . . 48.259999999999998 110.492 -177.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -129.12 106.0 8.56 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 107.752 -1.203 . . . . 82.099999999999994 107.752 178.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -67.6 -28.77 68.03 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.456 -0.498 . . . . 81.879999999999995 111.817 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 89.1 m -73.66 -46.81 44.34 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.399 -0.52 . . . . 64.980000000000004 111.039 179.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 30.3 mt -67.74 -27.68 66.99 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.275 -0.57 . . . . 46.890000000000001 111.764 178.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 44.5 t -69.34 -32.53 71.68 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.274 -0.57 . . . . 49.539999999999999 111.615 177.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -70.63 -45.6 64.89 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.449 -0.5 . . . . 60.520000000000003 111.063 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' SER . . . . . . . . . . . . . 75.3 p -63.33 -36.69 84.53 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.62 -0.432 . . . . 61.049999999999997 111.492 -175.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -74.18 -38.65 63.58 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.9 -0.72 . . . . 46.719999999999999 111.285 178.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -69.17 -28.95 66.87 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 119.962 -0.695 . . . . 42.030000000000001 111.506 174.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -69.13 -47.37 65.26 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.552 -0.459 . . . . 81.239999999999995 111.078 179.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -60.32 -37.27 80.08 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.522 -0.471 . . . . 54.670000000000002 111.303 -179.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.31 -34.51 65.74 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.26 -0.576 . . . . 44.219999999999999 111.584 178.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -72.6 -30.01 63.99 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.294 -0.562 . . . . 53.340000000000003 111.765 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 64.9 t -66.57 -40.09 85.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 120.34 -0.544 . . . . 62.399999999999999 110.433 177.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.25 -14.59 63.1 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 113.074 0.768 . . . . 64.799999999999997 113.074 179.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' GLY . . . . . . . . . . . . . . . 105.39 22.63 8.06 Favored Glycine 0 N--CA 1.442 -0.928 0 N-CA-C 116.091 1.196 . . . . 84.280000000000001 116.091 177.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -74.21 124.28 89.85 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 118.766 1.283 . . . . 66.140000000000001 109.513 178.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -64.8 -43.99 11.36 Favored 'Trans proline' 0 C--O 1.237 0.458 0 CA-C-N 119.321 0.793 . . . . 54.369999999999997 113.651 -175.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 14.8 t -68.04 -32.68 57.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 120.387 -0.525 . . . . 45.890000000000001 110.92 -179.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.53 -35.21 70.61 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 121.792 -0.567 . . . . 39.060000000000002 111.423 179.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -66.87 -36.09 81.52 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.319 -0.552 . . . . 62.079999999999998 111.265 177.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -68.22 -42.04 80.39 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.337 -0.545 . . . . 72.719999999999999 111.26 176.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' MSE . . . . . . . . . . . . . 77.9 mmm -67.85 -27.04 66.35 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 122.197 -0.314 . . . . 52.950000000000003 111.417 179.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 10.8 tp -76.67 -39.87 50.79 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.139 -0.624 . . . . 56.649999999999999 111.4 -179.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' GLY . . . . . . . . . . . . . . . -64.83 -30.81 78.96 Favored Glycine 0 C--N 1.335 0.5 0 C-N-CA 120.024 -1.084 . . . . 76.140000000000001 112.618 173.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ARG . . . . . . . . . . . . . 65.0 ttt-85 -70.2 -27.6 64.62 Favored 'General case' 0 C--O 1.236 0.361 0 O-C-N 122.298 -0.531 . . . . 84.980000000000004 111.413 175.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 12.2 m-30 -75.94 -33.36 59.83 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.689 -0.405 . . . . 71.349999999999994 112.014 176.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -74.61 -21.98 59.18 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 112.327 0.492 . . . . 80.359999999999999 112.327 175.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' GLU . . . . . 0.424 ' OE2' ' NH2' ' B' ' 131' ' ' ARG . 18.1 tt0 -82.09 -63.4 1.39 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-N 118.018 0.372 . . . . 108.69 111.255 -179.879 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -78.88 -2.84 41.72 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 113.118 0.784 . . . . 79.370000000000005 113.118 -178.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' GLY . . . . . . . . . . . . . . . 68.44 44.11 74.85 Favored Glycine 0 C--O 1.238 0.361 0 CA-C-N 118.474 0.579 . . . . 83.010000000000005 114.446 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ILE . . . . . . . . . . . . . 50.9 mt -93.21 113.71 28.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 107.931 -1.136 . . . . 85.5 107.931 -179.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . 82.69 -21.89 7.13 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 115.487 0.955 . . . . 88.25 115.487 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 16.5 m -137.55 175.71 8.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 118.604 1.202 . . . . 90.069999999999993 108.671 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.71 148.92 44.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.69 -0.686 . . . . 96.980000000000004 110.364 176.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -64.87 136.6 57.05 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.606 -0.724 . . . . 101.14 110.648 -179.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -158.42 90.48 1.03 Allowed 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 107.284 -1.376 . . . . 94.069999999999993 107.284 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 55.5 ttm-85 -65.34 -23.92 67.13 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.771 -0.65 . . . . 86.370000000000005 112.16 178.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 41.0 t -64.46 -47.06 90.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.106 0.479 . . . . 108.39 110.383 -179.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 75.2 mt -74.74 -26.69 59.96 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.263 -0.575 . . . . 91.430000000000007 111.804 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.13 -29.37 70.21 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.486 -0.486 . . . . 73.209999999999994 111.688 179.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -67.55 -31.98 72.45 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.348 -0.541 . . . . 102.36 111.555 176.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -70.93 -49.41 45.96 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.696 -0.402 . . . . 91.680000000000007 111.213 -178.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -65.95 -35.62 81.1 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.342 -0.543 . . . . 85.310000000000002 111.3 -179.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -64.24 -35.47 80.93 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.263 -0.575 . . . . 84.650000000000006 111.08 173.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -74.11 -39.22 63.5 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.514 -0.474 . . . . 101.73 111.198 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -66.05 -39.77 90.41 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.501 -0.48 . . . . 80.719999999999999 111.341 178.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' ALA . . . . . . . . . . . . . . . -69.91 -41.71 74.31 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.295 -0.562 . . . . 70.670000000000002 111.283 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.23 -26.42 65.69 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.309 -0.556 . . . . 78.609999999999999 111.693 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' ALA . . . . . . . . . . . . . . . -66.24 -40.38 90.18 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.43 -0.508 . . . . 68.310000000000002 111.165 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -75.84 -7.32 54.2 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 112.838 0.681 . . . . 84.459999999999994 112.838 177.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 106.02 17.56 12.74 Favored Glycine 0 N--CA 1.442 -0.918 0 N-CA-C 116.453 1.341 . . . . 106.44 116.453 175.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -67.56 119.22 11.98 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.777 1.288 . . . . 91.379999999999995 109.487 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -74.0 -26.27 60.35 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.338 -0.545 . . . . 113.70999999999999 112.004 -174.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 45.2 mttp -74.19 -31.62 62.73 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.867 -0.733 . . . . 86.760000000000005 111.559 174.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.43 -29.65 62.71 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.345 -0.542 . . . . 87.170000000000002 111.635 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' LYS . . . . . 0.66 ' NZ ' ' OE2' ' A' ' 126' ' ' GLU . 98.6 mttt -71.8 -38.34 70.27 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.371 -0.532 . . . . 100.58 111.261 178.368 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -65.43 -36.17 83.12 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.495 -0.482 . . . . 107.75 111.211 178.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' ARG . . . . . 0.424 ' NH2' ' OE2' ' B' ' 101' ' ' GLU . 46.2 tpt85 -73.37 -32.59 64.58 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.367 -0.533 . . . . 100.95999999999999 111.643 179.528 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' LEU . . . . . . . . . . . . . 22.6 mt -70.13 -15.09 62.92 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 112.495 0.554 . . . . 104.68000000000001 112.495 178.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -83.53 49.84 1.66 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-N 118.291 0.496 . . . . 116.89 110.642 176.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 120.859 0.362 . . . . 122.97 111.194 179.181 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.527 0.089 0 CA-C-O 120.582 0.23 . . . . 78.72 111.055 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . . . -70.99 -3.04 17.39 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 113.119 0.785 . . . . 92.14 113.119 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -62.54 -45.24 93.85 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 118.64 0.654 . . . . 104.62 110.911 175.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.7 mp -79.63 -25.05 41.5 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.077 0.399 . . . . 68.27 112.077 177.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' MSE . . . . . . . . . . . . . 72.9 mtp -72.81 -41.13 65.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 117.861 0.301 . . . . 104.54 111.096 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -69.26 -36.02 76.7 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.176 -0.609 . . . . 91.85 111.202 176.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.16 -45.84 86.65 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.513 -0.475 . . . . 55.14 110.968 176.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -67.23 -34.84 78.32 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.58 -0.448 . . . . 60.81 111.385 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.6 t -71.14 -37.12 72.28 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.469 -0.492 . . . . 71.4 111.423 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 33.3 m-20 -69.26 -37.05 77.71 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.229 -0.589 . . . . 41.6 111.27 178.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.68 -36.41 84.18 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.363 -0.535 . . . . 36.8 111.202 178.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -70.09 -30.93 68.27 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.483 -0.487 . . . . 64.68 111.776 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.9 p -74.63 -20.12 60.03 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.491 0.552 . . . . 59.55 112.491 -179.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.03 14.59 4.55 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 121.049 -0.596 . . . . 39.49 114.344 177.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -75.71 107.41 7.85 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.45 -0.944 . . . . 44.85 108.45 177.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 26.8 m -67.49 -28.14 41.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 C-N-CA 120.294 -0.562 . . . . 28.05 111.138 -177.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 74.2 m -71.16 -38.28 72.2 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.042 -0.663 . . . . 49.54 111.04 175.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.91 -36.11 77.64 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.409 -0.516 . . . . 29.71 111.163 176.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -64.75 -38.84 92.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.527 -0.469 . . . . 36.65 111.216 178.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -71.0 -44.23 66.33 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.325 -0.55 . . . . 40.12 111.224 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.4 tp10 -62.28 -40.62 96.86 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.43 -0.508 . . . . 86.46 111.042 176.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 18.6 tp -66.26 -32.14 73.37 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.355 -0.538 . . . . 37.76 111.38 176.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -65.9 -38.25 88.23 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.52 -0.472 . . . . 41.75 111.178 175.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 55.6 ttp85 -68.09 -36.32 79.6 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.569 -0.453 . . . . 67.88 111.301 179.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 90.5 mtt-85 -68.52 -39.11 81.31 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.294 -0.563 . . . . 59.28 111.395 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -65.77 -34.14 77.5 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.154 -0.619 . . . . 54.88 111.517 175.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 44.6 tp -76.05 -40.57 53.02 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.829 -0.348 . . . . 71.34 111.743 -176.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 23.1 m-20 -94.84 -3.24 49.25 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.074 0.768 . . . . 73.68 113.074 -177.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 66.36 21.11 70.13 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.435 -0.888 . . . . 51.89 114.439 -176.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -86.84 105.22 16.88 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.723 -0.843 . . . . 89.57 108.723 -178.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.25 -24.87 8.65 Favored Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 114.902 0.721 . . . . 44.67 114.902 -178.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 76.1 mt -128.98 169.58 14.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 118.133 0.966 . . . . 78.09 109.07 178.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -70.91 139.38 50.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.726 -0.67 . . . . 72.05 109.988 176.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 11.7 tm0? -63.24 105.64 0.76 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.984 -0.553 . . . . 70.65 110.403 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -126.94 112.53 15.39 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.182 -1.044 . . . . 53.81 108.182 -178.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -75.31 -36.86 61.05 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.68 -0.408 . . . . 92.39 111.722 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -64.93 -35.41 81.08 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.447 -0.501 . . . . 79.75 111.248 -179.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -79.05 -29.66 43.63 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 112.123 0.416 . . . . 57.23 112.123 178.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.91 -43.58 82.96 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.297 -0.561 . . . . 35.19 111.284 179.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.8 tp -72.65 -28.91 28.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.265 -0.574 . . . . 46.02 110.639 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 48.8 ttt-85 -64.87 -44.51 89.45 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.848 -0.533 . . . . 58.77 111.359 179.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -73.37 -30.19 63.13 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.12 -0.632 . . . . 38.26 111.725 178.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 40.2 tp -68.16 -39.55 82.57 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.057 -0.657 . . . . 51.17 111.062 176.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ARG . . . . . 0.629 ' NH2' ' OH ' ' A' ' 64' ' ' TYR . 31.6 mmt180 -59.59 -44.83 93.23 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.936 0.398 . . . . 65.75 110.865 173.135 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' MSE . . . . . . . . . . . . . 6.5 ttm -68.41 -33.86 74.98 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 122.545 0.338 . . . . 107.32 111.549 -176.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.45 -37.5 43.42 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.512 -0.475 . . . . 34.87 111.486 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -67.06 -54.24 23.39 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.539 -0.464 . . . . 32.93 110.925 177.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -65.77 -20.1 66.14 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.606 -0.438 . . . . 88.38 112.013 175.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -71.56 -21.17 78.78 Favored Glycine 0 C--N 1.336 0.555 0 CA-C-O 119.503 -0.609 . . . . 32.79 113.896 174.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 119.17 7.96 9.79 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 115.169 0.828 . . . . 38.42 115.169 174.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.2 tp -80.96 119.59 76.47 Favored Pre-proline 0 C--O 1.237 0.418 0 CA-C-N 117.394 0.597 . . . . 42.35 109.813 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -64.66 -38.73 30.21 Favored 'Trans proline' 0 C--O 1.237 0.466 0 CA-C-N 119.169 0.739 . . . . 48.86 113.41 -179.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -64.48 -31.76 73.1 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.303 -0.559 . . . . 81.57 111.485 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.41 -34.58 61.06 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.64 -0.424 . . . . 36.38 111.83 175.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -68.48 -35.39 77.48 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.446 -0.502 . . . . 43.59 111.164 177.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.69 -41.51 71.89 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.37 -0.532 . . . . 61.73 111.198 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -66.57 -38.47 93.37 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 120.023 -1.084 . . . . 55.53 112.502 177.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 29.5 tp -67.4 -31.47 71.71 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 122.263 -0.551 . . . . 47.57 111.392 176.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.84 -28.77 68.28 Favored Glycine 0 C--N 1.335 0.506 0 C-N-CA 120.228 -0.987 . . . . 56.45 113.053 176.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 87.5 t90 -69.37 -33.6 73.29 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.224 -0.59 . . . . 61.33 111.534 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' MSE . . . . . . . . . . . . . 54.3 mtt -65.02 -34.22 77.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.739 0.304 . . . . 104.19 111.364 -179.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' TYR . . . . . 0.629 ' OH ' ' NH2' ' A' ' 46' ' ' ARG . 54.4 m-85 -74.61 -23.01 58.65 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.356 -0.537 . . . . 62.92 112.168 173.427 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -83.06 -30.46 28.01 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.162 0.431 . . . . 60.39 112.162 179.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -104.62 -4.32 22.68 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 113.269 0.84 . . . . 63.48 113.269 -178.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.47 38.02 79.29 Favored Glycine 0 C--O 1.238 0.367 0 C-N-CA 120.562 -0.827 . . . . 53.51 113.399 -176.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -102.69 117.45 34.69 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.197 -0.668 . . . . 81.69 109.197 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 78.92 -28.85 2.14 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.447 -0.406 . . . . 49.73 113.398 179.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 29.0 m -133.82 165.11 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 N-CA-C 108.342 -0.984 . . . . 60.35 108.342 178.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -70.18 144.04 52.08 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.43 -0.804 . . . . 80.61 110.258 177.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -64.85 112.11 3.12 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.881 -0.599 . . . . 69.98 110.962 -177.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -129.04 109.07 10.89 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.184 -1.043 . . . . 69.61 108.184 177.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -67.05 -25.08 66.08 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.422 0.527 . . . . 82.4 112.422 179.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 93.6 m -74.54 -48.15 28.61 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.497 -0.481 . . . . 61.89 111.077 179.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 26.4 mt -67.71 -28.8 67.97 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.34 -0.544 . . . . 59.57 111.734 178.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 41.0 t -68.93 -36.72 78.31 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.103 -0.639 . . . . 53.55 111.128 175.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -69.0 -40.08 78.94 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.438 -0.505 . . . . 69.09 111.299 178.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 60.7 p -68.57 -37.3 79.77 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.413 -0.515 . . . . 57.34 111.498 -177.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 56.3 m95 -73.31 -39.9 64.92 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.029 -0.669 . . . . 42.69 111.369 178.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -65.94 -30.38 70.95 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 119.919 -0.713 . . . . 59.42 111.535 174.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -66.54 -43.32 85.45 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.611 -0.435 . . . . 66.52 111.32 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 -62.86 -41.65 99.45 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.429 -0.508 . . . . 68.84 111.252 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -72.34 -26.65 62.0 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.114 -0.634 . . . . 49.82 111.607 178.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -75.6 -40.51 56.37 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.525 -0.47 . . . . 55.65 111.479 177.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.69 -35.89 72.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-O 120.999 0.428 . . . . 57.77 110.354 175.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.73 -38.79 92.18 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 121.915 -0.491 . . . . 57.56 111.35 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 127.79 15.74 2.33 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 121.089 -0.576 . . . . 80.19 114.146 177.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -71.37 124.08 90.39 Favored Pre-proline 0 C--O 1.239 0.517 0 N-CA-C 109.303 -0.628 . . . . 73.17 109.303 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -68.25 -38.71 11.49 Favored 'Trans proline' 0 C--O 1.238 0.48 0 CA-C-N 119.347 0.803 . . . . 68.67 113.567 -173.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 40.2 t -68.2 -34.03 64.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 120.173 -0.611 . . . . 68.1 110.771 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.36 -32.42 64.5 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 121.813 -0.554 . . . . 66.96 111.772 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -68.38 -32.79 73.11 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.247 -0.581 . . . . 80.5 111.604 177.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -70.34 -43.75 69.59 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.335 -0.546 . . . . 103.93 111.2 175.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' MSE . . . . . . . . . . . . . 8.6 mmt -64.62 -28.23 69.48 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.866 0.321 . . . . 127.45 111.866 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 11.3 tp -76.38 -42.77 43.42 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.117 -0.633 . . . . 86.16 111.532 -178.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -62.48 -31.33 79.25 Favored Glycine 0 C--N 1.335 0.516 0 C-N-CA 120.118 -1.039 . . . . 75.69 112.745 175.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 53.3 ttt85 -66.18 -37.16 84.93 Favored 'General case' 0 C--O 1.237 0.396 0 O-C-N 122.323 -0.516 . . . . 102.58 111.102 174.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -70.16 -29.38 66.26 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.502 -0.479 . . . . 73.58 111.858 179.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -74.93 -36.75 62.13 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.202 -0.599 . . . . 118.52 111.69 -175.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -80.18 -27.13 38.98 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 119.808 -0.757 . . . . 124.48 112.142 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -90.11 -17.95 26.74 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.136 0.791 . . . . 92.56 113.136 -178.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 74.23 26.55 68.08 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.639 -0.791 . . . . 89.54 114.27 -178.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 2.3 pt -97.02 115.66 37.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 107.72 -1.215 . . . . 106.77 107.72 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 81.03 -5.41 66.34 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-O 119.064 -0.853 . . . . 72.05 115.15 -176.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 3.2 p -159.52 169.29 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-N 118.54 1.17 . . . . 83.32 108.166 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.41 138.22 55.15 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.067 0.461 . . . . 82.82 110.222 176.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . . . -64.0 136.37 57.26 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.965 -0.561 . . . . 98.8 110.476 -179.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -156.34 138.81 14.9 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.323 -0.621 . . . . 107.84 109.323 -178.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 23.3 mmt180 -97.92 -30.33 12.8 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.898 0.703 . . . . 118.83 112.898 176.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 45.7 t -68.4 -39.3 80.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 120.89 0.376 . . . . 133.96 110.586 -179.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.8 mp -82.03 -26.27 33.93 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 121.835 -0.541 . . . . 118.64 112.099 -179.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.47 -35.93 78.25 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.411 -0.516 . . . . 71.12 111.33 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -69.53 -30.07 67.81 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.303 -0.559 . . . . 100.2 111.658 179.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -63.37 -51.39 66.07 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.522 -0.471 . . . . 133.87 111.083 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -66.97 -29.71 69.64 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.111 -0.636 . . . . 89.81 111.646 178.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 13.8 m-30 -66.61 -34.92 78.96 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.116 -0.634 . . . . 88.72 110.798 169.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -73.44 -30.5 63.25 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.883 -0.327 . . . . 112.08 111.549 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -80.98 -40.89 23.64 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.931 -0.307 . . . . 97.43 111.649 179.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -69.26 -40.53 77.79 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.283 -0.567 . . . . 67.89 111.289 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.69 -24.83 64.54 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.053 0.39 . . . . 95.84 112.053 176.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -70.39 -26.99 63.96 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.116 -0.634 . . . . 94.63 111.573 177.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.9 mt-30 -88.68 -0.28 57.14 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 112.747 0.647 . . . . 100.55 112.747 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 100.25 12.03 40.35 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 116.159 1.224 . . . . 83.36 116.159 175.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -66.66 126.51 29.17 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.701 1.251 . . . . 93.3 110.01 179.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLU . . . . . 0.66 ' OE2' ' NZ ' ' B' ' 129' ' ' LYS . 59.6 mm-40 -73.99 -40.55 62.88 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.209 -0.45 . . . . 145.86 111.72 -173.645 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -77.34 -9.39 58.81 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 113.09 0.774 . . . . 110.2 113.09 179.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -85.64 -17.78 35.12 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 112.915 0.709 . . . . 117.14 112.915 -179.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -98.95 -10.22 23.05 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.279 0.844 . . . . 127.17 113.279 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -70.71 -47.13 61.38 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 118.474 0.579 . . . . 114.6 110.823 174.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 7.7 tpp180 -71.37 -29.47 64.99 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.7 -0.4 . . . . 123.48 111.493 175.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 21.0 tp -65.06 -30.58 71.55 Favored 'General case' 0 C--O 1.238 0.447 0 N-CA-C 112.042 0.386 . . . . 129.79 112.042 -175.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -94.78 -27.48 15.76 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.165 0.802 . . . . 126.39 113.165 177.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -85.31 51.64 2.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 122.085 0.945 . . . . 122.8 110.482 170.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' TRP . . . . . . . . . . . . . 69.0 t-105 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 115.538 -0.755 . . . . 127.95 111.833 -167.871 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 N--CA 1.46 0.028 0 CA-C-O 120.663 0.268 . . . . 113.35 111.197 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 96.5 t -84.34 -38.76 13.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 C-N-CA 120.557 -0.457 . . . . 106.21 110.77 178.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . . . -64.44 -45.27 88.22 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 121.886 -0.509 . . . . 98.72 111.071 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ARG . . . . . . . . . . . . . . . -65.2 -30.02 70.88 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.514 -0.475 . . . . 106.17 111.979 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -68.31 -40.99 81.53 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.182 -0.607 . . . . 90.42 111.367 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 67.1 mt -79.96 -29.98 39.73 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.481 -0.488 . . . . 68.93 112.058 178.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' MSE . . . . . . . . . . . . . 92.6 mtp -68.19 -36.78 80.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 117.949 0.341 . . . . 126.37 110.394 176.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -66.02 -34.19 77.51 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.107 -0.637 . . . . 93.84 111.325 173.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 50.9 tp -66.87 -41.89 86.51 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.245 -0.582 . . . . 60.89 111.063 177.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -72.15 -36.35 69.31 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.163 -0.615 . . . . 52.65 111.315 177.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 37.2 t -66.03 -38.13 87.62 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.24 -0.584 . . . . 82.6 111.147 179.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -74.65 -33.11 62.46 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.156 -0.618 . . . . 76.24 111.536 175.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.07 -43.26 79.0 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.371 -0.532 . . . . 43.06 111.138 177.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -67.79 -20.6 65.21 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 112.219 0.452 . . . . 73.26 112.219 176.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' SER . . . . . . . . . . . . . 37.5 m -72.35 -52.65 15.18 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.599 -0.441 . . . . 57.83 111.04 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 153.29 5.92 0.11 Allowed Glycine 0 N--CA 1.45 -0.417 0 O-C-N 122.172 -0.33 . . . . 53.69 112.709 -179.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -70.09 108.73 4.22 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 109.235 -0.654 . . . . 45.05 109.235 179.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 18.1 m -67.55 -26.01 34.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 C-N-CA 120.408 -0.517 . . . . 36.35 110.992 -178.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' SER . . . . . . . . . . . . . 61.9 m -71.72 -42.97 66.68 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.097 -0.641 . . . . 52.84 111.1 175.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.22 -33.95 76.91 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.369 -0.533 . . . . 37.65 111.425 175.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -65.48 -40.18 92.82 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.454 -0.498 . . . . 51.7 111.151 175.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -73.43 -40.77 63.98 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.276 -0.569 . . . . 44.41 111.277 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -62.12 -39.96 94.3 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.223 -0.591 . . . . 82.91 110.95 176.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 20.6 tp -69.21 -22.76 63.86 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.643 -0.423 . . . . 40.39 111.857 174.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 30.2 t -72.65 -46.54 53.46 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.674 -0.41 . . . . 49.92 111.229 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -69.45 -23.72 63.7 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.391 -0.524 . . . . 89.42 112.362 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -71.0 -40.9 71.57 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.127 -0.629 . . . . 64.86 111.139 176.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -66.76 -29.96 70.05 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.419 -0.512 . . . . 55.12 111.581 174.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 27.7 tp -79.58 -52.76 7.59 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 121.023 -0.271 . . . . 50.7 111.433 -177.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -83.2 -1.08 52.14 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 113.19 0.811 . . . . 64.61 113.19 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . 66.95 15.81 65.41 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.438 -0.886 . . . . 49.68 114.38 -175.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -74.67 104.04 5.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.74 0.77 . . . . 79.38 109.103 -176.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.5 -7.77 37.76 Favored Glycine 0 N--CA 1.447 -0.594 0 N-CA-C 115.472 0.949 . . . . 53.11 115.472 179.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 84.1 mt -139.19 160.32 40.07 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.661 1.231 . . . . 71.14 109.013 179.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -66.92 137.43 56.54 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.548 -0.751 . . . . 84.94 110.077 175.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? -63.19 120.68 11.97 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.893 -0.594 . . . . 67.84 110.479 -175.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 40.0 t-20 -140.66 105.56 4.96 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 107.862 -1.162 . . . . 55.89 107.862 -178.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -71.61 -31.37 66.84 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.333 -0.547 . . . . 78.58 111.882 -179.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -68.19 -38.31 81.88 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.249 -0.581 . . . . 88.83 111.281 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -78.42 -25.26 45.97 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.544 -0.462 . . . . 59.1 112.061 177.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.61 -45.92 70.66 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.475 -0.49 . . . . 35.23 111.101 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 10.0 tp -71.68 -27.67 28.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 C-N-CA 120.418 -0.513 . . . . 41.45 110.683 178.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 32.0 ttt180 -65.95 -49.19 68.77 Favored 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.761 -0.587 . . . . 55.94 111.095 179.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 89.7 m95 -71.98 -31.17 65.99 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.222 -0.591 . . . . 49.78 111.715 178.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 51.5 tp -65.12 -47.13 78.21 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.358 -0.537 . . . . 40.77 110.936 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 60.8 ttm-85 -65.6 -33.19 75.34 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.529 -0.468 . . . . 45.52 111.505 179.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' MSE . . . . . . . . . . . . . 25.8 ttm -70.0 -36.4 75.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.819 0.342 . . . . 77.39 110.595 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.16 -32.39 63.1 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.266 -0.574 . . . . 35.32 111.468 175.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -69.97 -42.23 73.43 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.457 -0.497 . . . . 31.45 111.112 176.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -66.38 -27.47 67.89 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.362 -0.535 . . . . 72.65 111.477 174.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . -72.43 -11.25 76.22 Favored Glycine 0 C--N 1.334 0.441 0 CA-C-O 119.027 -0.874 . . . . 32.18 114.629 178.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.74 15.06 21.72 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 116.065 1.186 . . . . 39.01 116.065 177.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 49.7 tp -84.27 118.83 72.17 Favored Pre-proline 0 C--O 1.236 0.393 0 CA-C-N 118.683 1.241 . . . . 28.65 109.763 179.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -62.79 -40.42 36.24 Favored 'Trans proline' 0 C--O 1.238 0.484 0 CA-C-N 119.169 0.739 . . . . 39.47 113.537 -177.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -63.74 -36.63 84.5 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.199 -0.6 . . . . 82.26 111.173 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.71 -37.13 73.51 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.18 -0.608 . . . . 25.72 111.062 175.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -65.89 -37.79 87.06 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.438 -0.505 . . . . 35.13 111.114 175.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.62 -39.74 73.57 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.404 -0.518 . . . . 39.09 111.234 177.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . -67.82 -37.64 88.65 Favored Glycine 0 C--N 1.334 0.454 0 C-N-CA 119.983 -1.103 . . . . 49.92 112.498 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 30.9 tp -67.43 -30.68 70.48 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 122.241 -0.564 . . . . 48.53 111.434 176.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.55 -26.95 66.38 Favored Glycine 0 C--N 1.334 0.454 0 C-N-CA 120.322 -0.942 . . . . 44.61 113.223 177.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' TRP . . . . . . . . . . . . . 88.1 t90 -70.46 -31.74 69.0 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.125 -0.63 . . . . 66.12 111.539 177.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' MSE . . . . . . . . . . . . . 49.3 mtt -70.79 -32.78 69.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.6 0.238 . . . . 52.75 111.137 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -74.17 -22.82 59.25 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.177 -0.609 . . . . 52.19 112.054 173.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -84.06 -45.0 13.53 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 112.26 0.467 . . . . 55.37 112.26 176.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.96 -27.61 26.39 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.269 -0.573 . . . . 44.47 112.279 -179.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.68 46.95 4.71 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.97 -0.633 . . . . 61.21 113.7 177.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -119.38 133.97 55.45 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 109.189 -0.671 . . . . 101.33 109.189 173.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 82.39 -36.12 2.61 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 116.291 -0.413 . . . . 66.25 112.419 -178.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 16.0 m -137.03 157.18 35.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 N-CA-C 108.173 -1.047 . . . . 69.62 108.173 176.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -64.65 148.81 50.2 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.533 -0.758 . . . . 68.0 110.27 176.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -63.66 117.77 7.3 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.69 -0.686 . . . . 48.26 110.492 -177.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -129.12 106.0 8.56 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 107.752 -1.203 . . . . 82.1 107.752 178.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -67.6 -28.77 68.03 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.456 -0.498 . . . . 81.88 111.817 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 89.1 m -73.66 -46.81 44.34 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.399 -0.52 . . . . 64.98 111.039 179.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 30.3 mt -67.74 -27.68 66.99 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.275 -0.57 . . . . 46.89 111.764 178.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 44.5 t -69.34 -32.53 71.68 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.274 -0.57 . . . . 49.54 111.615 177.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -70.63 -45.6 64.89 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.449 -0.5 . . . . 60.52 111.063 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' SER . . . . . . . . . . . . . 75.3 p -63.33 -36.69 84.53 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.62 -0.432 . . . . 61.05 111.492 -175.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -74.18 -38.65 63.58 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.9 -0.72 . . . . 46.72 111.285 178.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -69.17 -28.95 66.87 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 119.962 -0.695 . . . . 42.03 111.506 174.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -69.13 -47.37 65.26 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.552 -0.459 . . . . 81.24 111.078 179.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -60.32 -37.27 80.08 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.522 -0.471 . . . . 54.67 111.303 -179.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.31 -34.51 65.74 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.26 -0.576 . . . . 44.22 111.584 178.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -72.6 -30.01 63.99 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.294 -0.562 . . . . 53.34 111.765 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 64.9 t -66.57 -40.09 85.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 120.34 -0.544 . . . . 62.4 110.433 177.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.25 -14.59 63.1 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 113.074 0.768 . . . . 64.8 113.074 179.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' GLY . . . . . . . . . . . . . . . 105.39 22.63 8.06 Favored Glycine 0 N--CA 1.442 -0.928 0 N-CA-C 116.091 1.196 . . . . 84.28 116.091 177.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -74.21 124.28 89.85 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 118.766 1.283 . . . . 66.14 109.513 178.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -64.8 -43.99 11.36 Favored 'Trans proline' 0 C--O 1.237 0.458 0 CA-C-N 119.321 0.793 . . . . 54.37 113.651 -175.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 14.8 t -68.04 -32.68 57.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 120.387 -0.525 . . . . 45.89 110.92 -179.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.53 -35.21 70.61 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 121.792 -0.567 . . . . 39.06 111.423 179.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -66.87 -36.09 81.52 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.319 -0.552 . . . . 62.08 111.265 177.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -68.22 -42.04 80.39 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.337 -0.545 . . . . 72.72 111.26 176.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' MSE . . . . . . . . . . . . . 77.9 mmm -67.85 -27.04 66.35 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 122.197 -0.314 . . . . 52.95 111.417 179.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' LEU . . . . . 0.421 HD23 ' CE2' ' B' ' 116' ' ' TRP . 10.8 tp -76.67 -39.87 50.79 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.139 -0.624 . . . . 56.65 111.4 -179.843 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 97' ' ' GLY . . . . . . . . . . . . . . . -64.83 -30.81 78.96 Favored Glycine 0 C--N 1.335 0.5 0 C-N-CA 120.024 -1.084 . . . . 76.14 112.618 173.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ARG . . . . . . . . . . . . . 65.0 ttt-85 -70.2 -27.6 64.62 Favored 'General case' 0 C--O 1.236 0.361 0 O-C-N 122.298 -0.531 . . . . 84.98 111.413 175.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 12.2 m-30 -75.94 -33.36 59.83 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.689 -0.405 . . . . 71.35 112.014 176.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -74.61 -21.98 59.18 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 112.327 0.492 . . . . 80.36 112.327 175.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' GLU . . . . . 0.424 ' OE2' ' NH2' ' B' ' 131' ' ' ARG . 18.1 tt0 -82.09 -63.4 1.39 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-N 118.018 0.372 . . . . 108.69 111.255 -179.879 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -78.88 -2.84 41.72 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 113.118 0.784 . . . . 79.37 113.118 -178.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' GLY . . . . . . . . . . . . . . . 68.44 44.11 74.85 Favored Glycine 0 C--O 1.238 0.361 0 CA-C-N 118.474 0.579 . . . . 83.01 114.446 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ILE . . . . . . . . . . . . . 50.9 mt -93.21 113.71 28.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 107.931 -1.136 . . . . 85.5 107.931 -179.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . 82.69 -21.89 7.13 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 115.487 0.955 . . . . 88.25 115.487 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 16.5 m -137.55 175.71 8.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 118.604 1.202 . . . . 90.07 108.671 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.71 148.92 44.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.69 -0.686 . . . . 96.98 110.364 176.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -64.87 136.6 57.05 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.606 -0.724 . . . . 101.14 110.648 -179.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -158.42 90.48 1.03 Allowed 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 107.284 -1.376 . . . . 94.07 107.284 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 55.5 ttm-85 -65.34 -23.92 67.13 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.771 -0.65 . . . . 86.37 112.16 178.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 41.0 t -64.46 -47.06 90.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.106 0.479 . . . . 108.39 110.383 -179.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 75.2 mt -74.74 -26.69 59.96 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.263 -0.575 . . . . 91.43 111.804 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.13 -29.37 70.21 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.486 -0.486 . . . . 73.21 111.688 179.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -67.55 -31.98 72.45 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.348 -0.541 . . . . 102.36 111.555 176.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -70.93 -49.41 45.96 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.696 -0.402 . . . . 91.68 111.213 -178.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' TRP . . . . . 0.421 ' CE2' HD23 ' B' ' 96' ' ' LEU . 89.4 m95 -65.95 -35.62 81.1 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.342 -0.543 . . . . 85.31 111.3 -179.495 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 117' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -64.24 -35.47 80.93 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.263 -0.575 . . . . 84.65 111.08 173.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -74.11 -39.22 63.5 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.514 -0.474 . . . . 101.73 111.198 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -66.05 -39.77 90.41 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.501 -0.48 . . . . 80.72 111.341 178.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' ALA . . . . . . . . . . . . . . . -69.91 -41.71 74.31 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.295 -0.562 . . . . 70.67 111.283 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.23 -26.42 65.69 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.309 -0.556 . . . . 78.61 111.693 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' ALA . . . . . . . . . . . . . . . -66.24 -40.38 90.18 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.43 -0.508 . . . . 68.31 111.165 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -75.84 -7.32 54.2 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 112.838 0.681 . . . . 84.46 112.838 177.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 106.02 17.56 12.74 Favored Glycine 0 N--CA 1.442 -0.918 0 N-CA-C 116.453 1.341 . . . . 106.44 116.453 175.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -67.56 119.22 11.98 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.777 1.288 . . . . 91.38 109.487 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -74.0 -26.27 60.35 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.338 -0.545 . . . . 113.71 112.004 -174.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 45.2 mttp -74.19 -31.62 62.73 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.867 -0.733 . . . . 86.76 111.559 174.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.43 -29.65 62.71 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.345 -0.542 . . . . 87.17 111.635 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' LYS . . . . . 0.66 ' NZ ' ' OE2' ' A' ' 126' ' ' GLU . 98.6 mttt -71.8 -38.34 70.27 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.371 -0.532 . . . . 100.58 111.261 178.368 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -65.43 -36.17 83.12 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.495 -0.482 . . . . 107.75 111.211 178.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' ARG . . . . . 0.424 ' NH2' ' OE2' ' B' ' 101' ' ' GLU . 46.2 tpt85 -73.37 -32.59 64.58 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.367 -0.533 . . . . 100.96 111.643 179.528 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 132' ' ' LEU . . . . . . . . . . . . . 22.6 mt -70.13 -15.09 62.92 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 112.495 0.554 . . . . 104.68 112.495 178.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -83.53 49.84 1.66 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-N 118.291 0.496 . . . . 116.89 110.642 176.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 120.859 0.362 . . . . 122.97 111.194 179.181 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' 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 nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.527 0.089 0 CA-C-O 120.582 0.23 . . . . 78.72 111.055 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . . . -70.99 -3.04 17.39 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 113.119 0.785 . . . . 92.14 113.119 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -62.54 -45.24 93.85 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 118.64 0.654 . . . . 104.62 110.911 175.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.7 mp -79.63 -25.05 41.5 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.077 0.399 . . . . 68.27 112.077 177.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' MSE . . . . . . . . . . . . . 72.9 mtp -72.81 -41.13 65.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 117.861 0.301 . . . . 104.54 111.096 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -69.26 -36.02 76.7 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.176 -0.609 . . . . 91.85 111.202 176.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.16 -45.84 86.65 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.513 -0.475 . . . . 55.14 110.968 176.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -67.23 -34.84 78.32 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.58 -0.448 . . . . 60.81 111.385 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.6 t -71.14 -37.12 72.28 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.469 -0.492 . . . . 71.4 111.423 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 33.3 m-20 -69.26 -37.05 77.71 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.229 -0.589 . . . . 41.6 111.27 178.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.68 -36.41 84.18 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.363 -0.535 . . . . 36.8 111.202 178.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -70.09 -30.93 68.27 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.483 -0.487 . . . . 64.68 111.776 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.9 p -74.63 -20.12 60.03 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.491 0.552 . . . . 59.55 112.491 -179.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.03 14.59 4.55 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 121.049 -0.596 . . . . 39.49 114.344 177.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -75.71 107.41 7.85 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.45 -0.944 . . . . 44.85 108.45 177.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 26.8 m -67.49 -28.14 41.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 C-N-CA 120.294 -0.562 . . . . 28.05 111.138 -177.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 74.2 m -71.16 -38.28 72.2 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.042 -0.663 . . . . 49.54 111.04 175.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.91 -36.11 77.64 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.409 -0.516 . . . . 29.71 111.163 176.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -64.75 -38.84 92.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.527 -0.469 . . . . 36.65 111.216 178.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -71.0 -44.23 66.33 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.325 -0.55 . . . . 40.12 111.224 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.4 tp10 -62.28 -40.62 96.86 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.43 -0.508 . . . . 86.46 111.042 176.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 18.6 tp -66.26 -32.14 73.37 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.355 -0.538 . . . . 37.76 111.38 176.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -65.9 -38.25 88.23 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.52 -0.472 . . . . 41.75 111.178 175.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 55.6 ttp85 -68.09 -36.32 79.6 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.569 -0.453 . . . . 67.88 111.301 179.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 90.5 mtt-85 -68.52 -39.11 81.31 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.294 -0.563 . . . . 59.28 111.395 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -65.77 -34.14 77.5 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.154 -0.619 . . . . 54.88 111.517 175.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 44.6 tp -76.05 -40.57 53.02 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.829 -0.348 . . . . 71.34 111.743 -176.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 23.1 m-20 -94.84 -3.24 49.25 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.074 0.768 . . . . 73.68 113.074 -177.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 66.36 21.11 70.13 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.435 -0.888 . . . . 51.89 114.439 -176.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -86.84 105.22 16.88 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.723 -0.843 . . . . 89.57 108.723 -178.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.25 -24.87 8.65 Favored Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 114.902 0.721 . . . . 44.67 114.902 -178.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 76.1 mt -128.98 169.58 14.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 118.133 0.966 . . . . 78.09 109.07 178.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -70.91 139.38 50.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.726 -0.67 . . . . 72.05 109.988 176.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 11.7 tm0? -63.24 105.64 0.76 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.984 -0.553 . . . . 70.65 110.403 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -126.94 112.53 15.39 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.182 -1.044 . . . . 53.81 108.182 -178.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -75.31 -36.86 61.05 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.68 -0.408 . . . . 92.39 111.722 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -64.93 -35.41 81.08 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.447 -0.501 . . . . 79.75 111.248 -179.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -79.05 -29.66 43.63 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 112.123 0.416 . . . . 57.23 112.123 178.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.91 -43.58 82.96 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.297 -0.561 . . . . 35.19 111.284 179.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.8 tp -72.65 -28.91 28.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.265 -0.574 . . . . 46.02 110.639 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 48.8 ttt-85 -64.87 -44.51 89.45 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.848 -0.533 . . . . 58.77 111.359 179.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -73.37 -30.19 63.13 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.12 -0.632 . . . . 38.26 111.725 178.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 40.2 tp -68.16 -39.55 82.57 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.057 -0.657 . . . . 51.17 111.062 176.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.629 ' NH2' ' OH ' ' A' ' 64' ' ' TYR . 31.6 mmt180 -59.59 -44.83 93.23 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.936 0.398 . . . . 65.75 110.865 173.135 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' MSE . . . . . . . . . . . . . 6.5 ttm -68.41 -33.86 74.98 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 122.545 0.338 . . . . 107.32 111.549 -176.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.45 -37.5 43.42 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.512 -0.475 . . . . 34.87 111.486 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -67.06 -54.24 23.39 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.539 -0.464 . . . . 32.93 110.925 177.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -65.77 -20.1 66.14 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.606 -0.438 . . . . 88.38 112.013 175.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -71.56 -21.17 78.78 Favored Glycine 0 C--N 1.336 0.555 0 CA-C-O 119.503 -0.609 . . . . 32.79 113.896 174.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 119.17 7.96 9.79 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 115.169 0.828 . . . . 38.42 115.169 174.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.2 tp -80.96 119.59 76.47 Favored Pre-proline 0 C--O 1.237 0.418 0 CA-C-N 117.394 0.597 . . . . 42.35 109.813 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -64.66 -38.73 30.21 Favored 'Trans proline' 0 C--O 1.237 0.466 0 CA-C-N 119.169 0.739 . . . . 48.86 113.41 -179.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -64.48 -31.76 73.1 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.303 -0.559 . . . . 81.57 111.485 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.41 -34.58 61.06 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.64 -0.424 . . . . 36.38 111.83 175.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -68.48 -35.39 77.48 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.446 -0.502 . . . . 43.59 111.164 177.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.69 -41.51 71.89 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.37 -0.532 . . . . 61.73 111.198 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -66.57 -38.47 93.37 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 120.023 -1.084 . . . . 55.53 112.502 177.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 29.5 tp -67.4 -31.47 71.71 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 122.263 -0.551 . . . . 47.57 111.392 176.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.84 -28.77 68.28 Favored Glycine 0 C--N 1.335 0.506 0 C-N-CA 120.228 -0.987 . . . . 56.45 113.053 176.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 87.5 t90 -69.37 -33.6 73.29 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.224 -0.59 . . . . 61.33 111.534 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' MSE . . . . . . . . . . . . . 54.3 mtt -65.02 -34.22 77.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.739 0.304 . . . . 104.19 111.364 -179.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.629 ' OH ' ' NH2' ' A' ' 46' ' ' ARG . 54.4 m-85 -74.61 -23.01 58.65 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.356 -0.537 . . . . 62.92 112.168 173.427 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -83.06 -30.46 28.01 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.162 0.431 . . . . 60.39 112.162 179.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -104.62 -4.32 22.68 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 113.269 0.84 . . . . 63.48 113.269 -178.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.47 38.02 79.29 Favored Glycine 0 C--O 1.238 0.367 0 C-N-CA 120.562 -0.827 . . . . 53.51 113.399 -176.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -102.69 117.45 34.69 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.197 -0.668 . . . . 81.69 109.197 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 78.92 -28.85 2.14 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.447 -0.406 . . . . 49.73 113.398 179.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 29.0 m -133.82 165.11 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 N-CA-C 108.342 -0.984 . . . . 60.35 108.342 178.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -70.18 144.04 52.08 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.43 -0.804 . . . . 80.61 110.258 177.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -64.85 112.11 3.12 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.881 -0.599 . . . . 69.98 110.962 -177.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -129.04 109.07 10.89 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.184 -1.043 . . . . 69.61 108.184 177.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -67.05 -25.08 66.08 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.422 0.527 . . . . 82.4 112.422 179.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 93.6 m -74.54 -48.15 28.61 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.497 -0.481 . . . . 61.89 111.077 179.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 26.4 mt -67.71 -28.8 67.97 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.34 -0.544 . . . . 59.57 111.734 178.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 41.0 t -68.93 -36.72 78.31 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.103 -0.639 . . . . 53.55 111.128 175.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -69.0 -40.08 78.94 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.438 -0.505 . . . . 69.09 111.299 178.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 60.7 p -68.57 -37.3 79.77 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.413 -0.515 . . . . 57.34 111.498 -177.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 56.3 m95 -73.31 -39.9 64.92 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.029 -0.669 . . . . 42.69 111.369 178.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -65.94 -30.38 70.95 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 119.919 -0.713 . . . . 59.42 111.535 174.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -66.54 -43.32 85.45 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.611 -0.435 . . . . 66.52 111.32 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 -62.86 -41.65 99.45 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.429 -0.508 . . . . 68.84 111.252 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -72.34 -26.65 62.0 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.114 -0.634 . . . . 49.82 111.607 178.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -75.6 -40.51 56.37 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.525 -0.47 . . . . 55.65 111.479 177.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.69 -35.89 72.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-O 120.999 0.428 . . . . 57.77 110.354 175.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.73 -38.79 92.18 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 121.915 -0.491 . . . . 57.56 111.35 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 127.79 15.74 2.33 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 121.089 -0.576 . . . . 80.19 114.146 177.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -71.37 124.08 90.39 Favored Pre-proline 0 C--O 1.239 0.517 0 N-CA-C 109.303 -0.628 . . . . 73.17 109.303 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -68.25 -38.71 11.49 Favored 'Trans proline' 0 C--O 1.238 0.48 0 CA-C-N 119.347 0.803 . . . . 68.67 113.567 -173.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 40.2 t -68.2 -34.03 64.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 120.173 -0.611 . . . . 68.1 110.771 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.36 -32.42 64.5 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 121.813 -0.554 . . . . 66.96 111.772 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -68.38 -32.79 73.11 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.247 -0.581 . . . . 80.5 111.604 177.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -70.34 -43.75 69.59 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.335 -0.546 . . . . 103.93 111.2 175.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' MSE . . . . . . . . . . . . . 8.6 mmt -64.62 -28.23 69.48 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.866 0.321 . . . . 127.45 111.866 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 11.3 tp -76.38 -42.77 43.42 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.117 -0.633 . . . . 86.16 111.532 -178.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -62.48 -31.33 79.25 Favored Glycine 0 C--N 1.335 0.516 0 C-N-CA 120.118 -1.039 . . . . 75.69 112.745 175.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 53.3 ttt85 -66.18 -37.16 84.93 Favored 'General case' 0 C--O 1.237 0.396 0 O-C-N 122.323 -0.516 . . . . 102.58 111.102 174.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -70.16 -29.38 66.26 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.502 -0.479 . . . . 73.58 111.858 179.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -74.93 -36.75 62.13 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.202 -0.599 . . . . 118.52 111.69 -175.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.2 pt-20 -80.18 -27.13 38.98 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 119.808 -0.757 . . . . 124.48 112.142 -178.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -90.11 -17.95 26.74 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.136 0.791 . . . . 92.56 113.136 -178.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 74.23 26.55 68.08 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.639 -0.791 . . . . 89.54 114.27 -178.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 2.3 pt -97.02 115.66 37.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 107.72 -1.215 . . . . 106.77 107.72 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 81.03 -5.41 66.34 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-O 119.064 -0.853 . . . . 72.05 115.15 -176.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 3.2 p -159.52 169.29 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-N 118.54 1.17 . . . . 83.32 108.166 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.41 138.22 55.15 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.067 0.461 . . . . 82.82 110.222 176.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . . . -64.0 136.37 57.26 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.965 -0.561 . . . . 98.8 110.476 -179.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -156.34 138.81 14.9 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.323 -0.621 . . . . 107.84 109.323 -178.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 23.3 mmt180 -97.92 -30.33 12.8 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.898 0.703 . . . . 118.83 112.898 176.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 45.7 t -68.4 -39.3 80.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 120.89 0.376 . . . . 133.96 110.586 -179.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.8 mp -82.03 -26.27 33.93 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 121.835 -0.541 . . . . 118.64 112.099 -179.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.47 -35.93 78.25 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.411 -0.516 . . . . 71.12 111.33 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -69.53 -30.07 67.81 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.303 -0.559 . . . . 100.2 111.658 179.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -63.37 -51.39 66.07 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.522 -0.471 . . . . 133.87 111.083 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -66.97 -29.71 69.64 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.111 -0.636 . . . . 89.81 111.646 178.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 13.8 m-30 -66.61 -34.92 78.96 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.116 -0.634 . . . . 88.72 110.798 169.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -73.44 -30.5 63.25 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.883 -0.327 . . . . 112.08 111.549 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -80.98 -40.89 23.64 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.931 -0.307 . . . . 97.43 111.649 179.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -69.26 -40.53 77.79 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.283 -0.567 . . . . 67.89 111.289 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.69 -24.83 64.54 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.053 0.39 . . . . 95.84 112.053 176.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -70.39 -26.99 63.96 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.116 -0.634 . . . . 94.63 111.573 177.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.9 mt-30 -88.68 -0.28 57.14 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 112.747 0.647 . . . . 100.55 112.747 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 100.25 12.03 40.35 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 116.159 1.224 . . . . 83.36 116.159 175.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -66.66 126.51 29.17 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.701 1.251 . . . . 93.3 110.01 179.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.66 ' OE2' ' NZ ' ' B' ' 129' ' ' LYS . 59.6 mm-40 -73.99 -40.55 62.88 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.209 -0.45 . . . . 145.86 111.72 -173.645 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -77.34 -9.39 58.81 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 113.09 0.774 . . . . 110.2 113.09 179.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -85.64 -17.78 35.12 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 112.915 0.709 . . . . 117.14 112.915 -179.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -98.95 -10.22 23.05 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.279 0.844 . . . . 127.17 113.279 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -70.71 -47.13 61.38 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 118.474 0.579 . . . . 114.6 110.823 174.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 7.7 tpp180 -71.37 -29.47 64.99 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.7 -0.4 . . . . 123.48 111.493 175.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 21.0 tp -65.06 -30.58 71.55 Favored 'General case' 0 C--O 1.238 0.447 0 N-CA-C 112.042 0.386 . . . . 129.79 112.042 -175.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -94.78 -27.48 15.76 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.165 0.802 . . . . 126.39 113.165 177.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -85.31 51.64 2.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 122.085 0.945 . . . . 122.8 110.482 170.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' TRP . . . . . . . . . . . . . 69.0 t-105 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 115.538 -0.755 . . . . 127.95 111.833 -167.871 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 N--CA 1.46 0.028 0 CA-C-O 120.663 0.268 . . . . 113.35 111.197 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 96.5 t -84.34 -38.76 13.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 C-N-CA 120.557 -0.457 . . . . 106.21 110.77 178.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . . . -64.44 -45.27 88.22 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 121.886 -0.509 . . . . 98.72 111.071 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ARG . . . . . . . . . . . . . . . -65.2 -30.02 70.88 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.514 -0.475 . . . . 106.17 111.979 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -68.31 -40.99 81.53 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.182 -0.607 . . . . 90.42 111.367 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 67.1 mt -79.96 -29.98 39.73 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.481 -0.488 . . . . 68.93 112.058 178.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' MSE . . . . . . . . . . . . . 92.6 mtp -68.19 -36.78 80.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 117.949 0.341 . . . . 126.37 110.394 176.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -66.02 -34.19 77.51 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.107 -0.637 . . . . 93.84 111.325 173.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 50.9 tp -66.87 -41.89 86.51 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.245 -0.582 . . . . 60.89 111.063 177.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -72.15 -36.35 69.31 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.163 -0.615 . . . . 52.65 111.315 177.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 37.2 t -66.03 -38.13 87.62 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.24 -0.584 . . . . 82.6 111.147 179.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -74.65 -33.11 62.46 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.156 -0.618 . . . . 76.24 111.536 175.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.07 -43.26 79.0 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.371 -0.532 . . . . 43.06 111.138 177.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -67.79 -20.6 65.21 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 112.219 0.452 . . . . 73.26 112.219 176.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' SER . . . . . . . . . . . . . 37.5 m -72.35 -52.65 15.18 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.599 -0.441 . . . . 57.83 111.04 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 153.29 5.92 0.11 Allowed Glycine 0 N--CA 1.45 -0.417 0 O-C-N 122.172 -0.33 . . . . 53.69 112.709 -179.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -70.09 108.73 4.22 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 109.235 -0.654 . . . . 45.05 109.235 179.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 18.1 m -67.55 -26.01 34.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 C-N-CA 120.408 -0.517 . . . . 36.35 110.992 -178.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' SER . . . . . . . . . . . . . 61.9 m -71.72 -42.97 66.68 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.097 -0.641 . . . . 52.84 111.1 175.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.22 -33.95 76.91 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.369 -0.533 . . . . 37.65 111.425 175.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -65.48 -40.18 92.82 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.454 -0.498 . . . . 51.7 111.151 175.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -73.43 -40.77 63.98 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.276 -0.569 . . . . 44.41 111.277 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -62.12 -39.96 94.3 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.223 -0.591 . . . . 82.91 110.95 176.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 20.6 tp -69.21 -22.76 63.86 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.643 -0.423 . . . . 40.39 111.857 174.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 30.2 t -72.65 -46.54 53.46 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.674 -0.41 . . . . 49.92 111.229 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -69.45 -23.72 63.7 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.391 -0.524 . . . . 89.42 112.362 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -71.0 -40.9 71.57 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.127 -0.629 . . . . 64.86 111.139 176.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -66.76 -29.96 70.05 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.419 -0.512 . . . . 55.12 111.581 174.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 27.7 tp -79.58 -52.76 7.59 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 121.023 -0.271 . . . . 50.7 111.433 -177.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -83.2 -1.08 52.14 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 113.19 0.811 . . . . 64.61 113.19 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . 66.95 15.81 65.41 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.438 -0.886 . . . . 49.68 114.38 -175.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -74.67 104.04 5.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.74 0.77 . . . . 79.38 109.103 -176.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.5 -7.77 37.76 Favored Glycine 0 N--CA 1.447 -0.594 0 N-CA-C 115.472 0.949 . . . . 53.11 115.472 179.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 84.1 mt -139.19 160.32 40.07 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.661 1.231 . . . . 71.14 109.013 179.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -66.92 137.43 56.54 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.548 -0.751 . . . . 84.94 110.077 175.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? -63.19 120.68 11.97 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.893 -0.594 . . . . 67.84 110.479 -175.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 40.0 t-20 -140.66 105.56 4.96 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 107.862 -1.162 . . . . 55.89 107.862 -178.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -71.61 -31.37 66.84 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.333 -0.547 . . . . 78.58 111.882 -179.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -68.19 -38.31 81.88 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.249 -0.581 . . . . 88.83 111.281 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -78.42 -25.26 45.97 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.544 -0.462 . . . . 59.1 112.061 177.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.61 -45.92 70.66 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.475 -0.49 . . . . 35.23 111.101 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 10.0 tp -71.68 -27.67 28.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 C-N-CA 120.418 -0.513 . . . . 41.45 110.683 178.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 32.0 ttt180 -65.95 -49.19 68.77 Favored 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.761 -0.587 . . . . 55.94 111.095 179.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' TRP . . . . . . . . . . . . . 89.7 m95 -71.98 -31.17 65.99 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.222 -0.591 . . . . 49.78 111.715 178.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 51.5 tp -65.12 -47.13 78.21 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.358 -0.537 . . . . 40.77 110.936 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 60.8 ttm-85 -65.6 -33.19 75.34 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.529 -0.468 . . . . 45.52 111.505 179.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' MSE . . . . . . . . . . . . . 25.8 ttm -70.0 -36.4 75.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.819 0.342 . . . . 77.39 110.595 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.16 -32.39 63.1 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.266 -0.574 . . . . 35.32 111.468 175.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -69.97 -42.23 73.43 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.457 -0.497 . . . . 31.45 111.112 176.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -66.38 -27.47 67.89 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.362 -0.535 . . . . 72.65 111.477 174.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . -72.43 -11.25 76.22 Favored Glycine 0 C--N 1.334 0.441 0 CA-C-O 119.027 -0.874 . . . . 32.18 114.629 178.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.74 15.06 21.72 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 116.065 1.186 . . . . 39.01 116.065 177.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 49.7 tp -84.27 118.83 72.17 Favored Pre-proline 0 C--O 1.236 0.393 0 CA-C-N 118.683 1.241 . . . . 28.65 109.763 179.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -62.79 -40.42 36.24 Favored 'Trans proline' 0 C--O 1.238 0.484 0 CA-C-N 119.169 0.739 . . . . 39.47 113.537 -177.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -63.74 -36.63 84.5 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.199 -0.6 . . . . 82.26 111.173 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.71 -37.13 73.51 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.18 -0.608 . . . . 25.72 111.062 175.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -65.89 -37.79 87.06 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.438 -0.505 . . . . 35.13 111.114 175.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.62 -39.74 73.57 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.404 -0.518 . . . . 39.09 111.234 177.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . -67.82 -37.64 88.65 Favored Glycine 0 C--N 1.334 0.454 0 C-N-CA 119.983 -1.103 . . . . 49.92 112.498 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 30.9 tp -67.43 -30.68 70.48 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 122.241 -0.564 . . . . 48.53 111.434 176.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.55 -26.95 66.38 Favored Glycine 0 C--N 1.334 0.454 0 C-N-CA 120.322 -0.942 . . . . 44.61 113.223 177.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' TRP . . . . . . . . . . . . . 88.1 t90 -70.46 -31.74 69.0 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.125 -0.63 . . . . 66.12 111.539 177.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' MSE . . . . . . . . . . . . . 49.3 mtt -70.79 -32.78 69.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.6 0.238 . . . . 52.75 111.137 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -74.17 -22.82 59.25 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.177 -0.609 . . . . 52.19 112.054 173.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -84.06 -45.0 13.53 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 112.26 0.467 . . . . 55.37 112.26 176.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.96 -27.61 26.39 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.269 -0.573 . . . . 44.47 112.279 -179.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.68 46.95 4.71 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.97 -0.633 . . . . 61.21 113.7 177.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -119.38 133.97 55.45 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 109.189 -0.671 . . . . 101.33 109.189 173.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 82.39 -36.12 2.61 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 116.291 -0.413 . . . . 66.25 112.419 -178.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 16.0 m -137.03 157.18 35.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 N-CA-C 108.173 -1.047 . . . . 69.62 108.173 176.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -64.65 148.81 50.2 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.533 -0.758 . . . . 68.0 110.27 176.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -63.66 117.77 7.3 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.69 -0.686 . . . . 48.26 110.492 -177.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -129.12 106.0 8.56 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 107.752 -1.203 . . . . 82.1 107.752 178.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -67.6 -28.77 68.03 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.456 -0.498 . . . . 81.88 111.817 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 89.1 m -73.66 -46.81 44.34 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.399 -0.52 . . . . 64.98 111.039 179.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 30.3 mt -67.74 -27.68 66.99 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.275 -0.57 . . . . 46.89 111.764 178.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 44.5 t -69.34 -32.53 71.68 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.274 -0.57 . . . . 49.54 111.615 177.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -70.63 -45.6 64.89 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.449 -0.5 . . . . 60.52 111.063 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' SER . . . . . . . . . . . . . 75.3 p -63.33 -36.69 84.53 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.62 -0.432 . . . . 61.05 111.492 -175.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -74.18 -38.65 63.58 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.9 -0.72 . . . . 46.72 111.285 178.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -69.17 -28.95 66.87 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 119.962 -0.695 . . . . 42.03 111.506 174.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -69.13 -47.37 65.26 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.552 -0.459 . . . . 81.24 111.078 179.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -60.32 -37.27 80.08 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.522 -0.471 . . . . 54.67 111.303 -179.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.31 -34.51 65.74 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.26 -0.576 . . . . 44.22 111.584 178.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -72.6 -30.01 63.99 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.294 -0.562 . . . . 53.34 111.765 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 64.9 t -66.57 -40.09 85.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 120.34 -0.544 . . . . 62.4 110.433 177.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.25 -14.59 63.1 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 113.074 0.768 . . . . 64.8 113.074 179.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' GLY . . . . . . . . . . . . . . . 105.39 22.63 8.06 Favored Glycine 0 N--CA 1.442 -0.928 0 N-CA-C 116.091 1.196 . . . . 84.28 116.091 177.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -74.21 124.28 89.85 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 118.766 1.283 . . . . 66.14 109.513 178.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -64.8 -43.99 11.36 Favored 'Trans proline' 0 C--O 1.237 0.458 0 CA-C-N 119.321 0.793 . . . . 54.37 113.651 -175.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 14.8 t -68.04 -32.68 57.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 120.387 -0.525 . . . . 45.89 110.92 -179.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.53 -35.21 70.61 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 121.792 -0.567 . . . . 39.06 111.423 179.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -66.87 -36.09 81.52 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.319 -0.552 . . . . 62.08 111.265 177.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -68.22 -42.04 80.39 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.337 -0.545 . . . . 72.72 111.26 176.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' MSE . . . . . . . . . . . . . 77.9 mmm -67.85 -27.04 66.35 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 122.197 -0.314 . . . . 52.95 111.417 179.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.421 HD23 ' CE2' ' B' ' 116' ' ' TRP . 10.8 tp -76.67 -39.87 50.79 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.139 -0.624 . . . . 56.65 111.4 -179.843 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' GLY . . . . . . . . . . . . . . . -64.83 -30.81 78.96 Favored Glycine 0 C--N 1.335 0.5 0 C-N-CA 120.024 -1.084 . . . . 76.14 112.618 173.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ARG . . . . . . . . . . . . . 65.0 ttt-85 -70.2 -27.6 64.62 Favored 'General case' 0 C--O 1.236 0.361 0 O-C-N 122.298 -0.531 . . . . 84.98 111.413 175.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 12.2 m-30 -75.94 -33.36 59.83 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.689 -0.405 . . . . 71.35 112.014 176.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -74.61 -21.98 59.18 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 112.327 0.492 . . . . 80.36 112.327 175.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' GLU . . . . . 0.424 ' OE2' ' NH2' ' B' ' 131' ' ' ARG . 18.1 tt0 -82.09 -63.4 1.39 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-N 118.018 0.372 . . . . 108.69 111.255 -179.879 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -78.88 -2.84 41.72 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 113.118 0.784 . . . . 79.37 113.118 -178.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' GLY . . . . . . . . . . . . . . . 68.44 44.11 74.85 Favored Glycine 0 C--O 1.238 0.361 0 CA-C-N 118.474 0.579 . . . . 83.01 114.446 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ILE . . . . . . . . . . . . . 50.9 mt -93.21 113.71 28.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 107.931 -1.136 . . . . 85.5 107.931 -179.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . 82.69 -21.89 7.13 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 115.487 0.955 . . . . 88.25 115.487 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' VAL . . . . . . . . . . . . . 16.5 m -137.55 175.71 8.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 118.604 1.202 . . . . 90.07 108.671 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.71 148.92 44.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.69 -0.686 . . . . 96.98 110.364 176.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -64.87 136.6 57.05 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.606 -0.724 . . . . 101.14 110.648 -179.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -158.42 90.48 1.03 Allowed 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 107.284 -1.376 . . . . 94.07 107.284 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 55.5 ttm-85 -65.34 -23.92 67.13 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.771 -0.65 . . . . 86.37 112.16 178.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 41.0 t -64.46 -47.06 90.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 121.106 0.479 . . . . 108.39 110.383 -179.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 75.2 mt -74.74 -26.69 59.96 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.263 -0.575 . . . . 91.43 111.804 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.13 -29.37 70.21 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.486 -0.486 . . . . 73.21 111.688 179.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -67.55 -31.98 72.45 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.348 -0.541 . . . . 102.36 111.555 176.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -70.93 -49.41 45.96 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.696 -0.402 . . . . 91.68 111.213 -178.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' TRP . . . . . 0.421 ' CE2' HD23 ' B' ' 96' ' ' LEU . 89.4 m95 -65.95 -35.62 81.1 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.342 -0.543 . . . . 85.31 111.3 -179.495 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -64.24 -35.47 80.93 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.263 -0.575 . . . . 84.65 111.08 173.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -74.11 -39.22 63.5 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.514 -0.474 . . . . 101.73 111.198 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -66.05 -39.77 90.41 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.501 -0.48 . . . . 80.72 111.341 178.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' ALA . . . . . . . . . . . . . . . -69.91 -41.71 74.31 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.295 -0.562 . . . . 70.67 111.283 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.23 -26.42 65.69 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.309 -0.556 . . . . 78.61 111.693 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' ALA . . . . . . . . . . . . . . . -66.24 -40.38 90.18 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.43 -0.508 . . . . 68.31 111.165 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -75.84 -7.32 54.2 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 112.838 0.681 . . . . 84.46 112.838 177.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 106.02 17.56 12.74 Favored Glycine 0 N--CA 1.442 -0.918 0 N-CA-C 116.453 1.341 . . . . 106.44 116.453 175.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -67.56 119.22 11.98 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.777 1.288 . . . . 91.38 109.487 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -74.0 -26.27 60.35 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.338 -0.545 . . . . 113.71 112.004 -174.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . 45.2 mttp -74.19 -31.62 62.73 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.867 -0.733 . . . . 86.76 111.559 174.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.43 -29.65 62.71 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.345 -0.542 . . . . 87.17 111.635 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.66 ' NZ ' ' OE2' ' A' ' 126' ' ' GLU . 98.6 mttt -71.8 -38.34 70.27 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.371 -0.532 . . . . 100.58 111.261 178.368 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -65.43 -36.17 83.12 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.495 -0.482 . . . . 107.75 111.211 178.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' ARG . . . . . 0.424 ' NH2' ' OE2' ' B' ' 101' ' ' GLU . 46.2 tpt85 -73.37 -32.59 64.58 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.367 -0.533 . . . . 100.96 111.643 179.528 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' LEU . . . . . . . . . . . . . 22.6 mt -70.13 -15.09 62.92 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 112.495 0.554 . . . . 104.68 112.495 178.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -83.53 49.84 1.66 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-N 118.291 0.496 . . . . 116.89 110.642 176.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 120.859 0.362 . . . . 122.97 111.194 179.181 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' 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 stop_ save_