data_3qob_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 3qob _Structure_validation_residue.Date_analyzed 2020-05-29 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.808 0.337 . . . . 20.0 111.188 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . 0.275 2.3 p -57.75 -47.11 86.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 20.0 111.2 179.97 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' TYR . . . . . 0.619 ' CD2' ' N ' ' A' ' 4' ' ' TYR 0.575 0.1 OUTLIER -59.51 -33.99 72.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 20.0 111.17 179.941 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -71.95 -50.2 30.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.246 -0.433 . . . . 20.0 111.2 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.35 -47.9 82.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 20.0 111.179 179.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.56 -27.07 67.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 20.0 111.17 179.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.73 -6.95 45.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.185 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -88.9 -3.12 58.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.455 . . . . 20.0 111.213 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 32.9 mt -84.64 70.08 10.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 20.0 111.149 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.3 p -61.53 174.82 0.69 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 20.0 111.192 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.56 -42.11 95.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 20.0 111.173 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 -58.13 -52.17 66.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 20.0 111.191 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 41.4 t -61.96 -38.93 81.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 20.0 111.163 179.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 24.5 mtmt -60.6 -42.93 97.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.465 . . . . 20.0 111.162 179.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.6 tptp -65.97 -41.15 91.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 20.0 111.097 179.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -63.35 -40.19 96.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 20.0 111.146 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.0 mt -63.41 -41.41 98.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.153 179.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 31.0 mtt-85 -73.11 -43.08 62.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.458 . . . . 20.0 111.111 179.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -58.42 -39.69 80.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 20.0 111.266 -179.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 27.0 p -78.59 -44.63 23.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 20.0 111.228 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' TRP . . . . . 0.594 ' O ' ' N ' ' A' ' 26' ' ' GLY . 51.8 t-105 -53.61 -41.53 66.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.265 -0.425 . . . . 20.0 111.23 -179.905 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -49.38 -36.06 20.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.25 -0.432 . . . . 20.0 111.261 -179.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 70.9 t -83.31 -60.06 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.46 . . . . 20.0 111.245 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . 0.367 15.1 pt -65.88 -18.94 24.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 20.0 111.245 -179.982 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . 0.594 ' N ' ' O ' ' A' ' 22' ' ' TRP . . . -78.27 -22.08 68.76 Favored Glycine 0 N--CA 1.451 -0.32 0 CA-C-N 116.205 -0.452 . . . . 20.0 112.513 -179.99 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 96.6 p -65.51 -31.83 73.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.774 0.321 . . . . 20.0 111.214 -179.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -126.69 87.2 2.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 20.0 111.24 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LYS . . . . . 0.45 ' NZ ' ' O ' ' A' ' 26' ' ' GLY . 0.2 OUTLIER -78.3 -34.11 48.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 20.0 111.24 179.977 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -73.37 -52.64 13.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.035 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -65.98 -43.18 94.09 Favored Glycine 0 N--CA 1.451 -0.353 0 CA-C-N 116.218 -0.446 . . . . 20.0 112.212 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -76.8 -35.89 57.32 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.036 0.384 . . . . 20.0 112.036 179.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.76 -47.54 90.7 Favored Glycine 0 N--CA 1.451 -0.343 0 CA-C-N 116.147 -0.479 . . . . 20.0 112.305 179.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.6 t -64.81 -38.39 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.837 0.351 . . . . 20.0 110.98 179.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.11 -44.54 94.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 20.0 111.013 179.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . 0.774 ' CD2' ' CG2' ' A' ' 121' ' ' VAL 0.316 14.5 mt -61.68 -41.07 97.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 20.0 110.945 179.657 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 52.7 mmm -66.71 -46.19 76.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 20.0 111.041 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.4 p -60.32 -44.28 95.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 20.0 111.012 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 25.3 m -65.38 -34.03 77.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 20.0 110.975 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 13.8 tp -71.06 -33.16 69.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 20.0 111.284 -179.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -80.75 -21.04 41.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 20.0 111.263 -179.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -86.91 -36.08 18.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 20.0 111.251 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASP . . . . . 0.456 ' OD2' ' NZ ' ' A' ' 120' ' ' LYS . 21.0 m-20 -87.27 -25.29 24.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.464 . . . . 20.0 111.205 -179.938 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -133.5 86.18 2.27 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.218 0.451 . . . . 20.0 112.218 -179.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -70.37 -32.78 70.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 20.0 111.224 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLU . . . . . 0.419 ' OE2' ' NZ ' ' A' ' 113' ' ' LYS . 18.2 pm0 -66.78 13.14 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.207 179.976 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.7 p -125.44 12.91 8.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 20.0 111.251 -179.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 95.4 mt -82.92 -34.2 11.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 20.0 111.242 179.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -68.42 -11.43 61.98 Favored Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 116.164 -0.471 . . . . 20.0 112.475 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' TYR . . . . . 0.636 ' O ' ' CMD' ' A' ' 147' ' ' HEM . 6.3 m-85 -83.05 1.81 38.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.813 0.34 . . . . 20.0 111.168 179.82 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -134.69 43.16 2.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.472 . . . . 20.0 111.152 179.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.5 ttmt -53.32 -45.47 69.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.241 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 57.1 ttp85 -57.5 -30.33 65.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 20.0 111.192 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.0 mt -65.27 -19.1 65.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.242 -0.435 . . . . 20.0 111.226 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 75.97 -125.63 7.95 Favored Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 116.208 -0.451 . . . . 20.0 112.52 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASN . . . . . 0.441 ' O ' ' ND2' ' A' ' 63' ' ' ASN . 41.9 t30 -90.32 101.6 14.32 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.177 0.436 . . . . 20.0 112.177 179.96 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.4 m -75.64 -31.11 22.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 20.0 111.214 179.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 p -60.43 0.01 0.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 20.0 111.196 -179.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -83.01 -20.92 34.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 20.0 111.2 -179.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 71.71 -141.53 32.12 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 116.217 -0.447 . . . . 20.0 112.484 179.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' MET . . . . . 0.402 ' SD ' ' CD ' ' A' ' 67' ' ' ARG . 38.5 tpp -57.57 -30.46 65.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.795 0.331 . . . . 20.0 111.211 -179.974 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -51.89 -47.78 64.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 20.0 111.193 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASN . . . . . 0.441 ' ND2' ' O ' ' A' ' 56' ' ' ASN . 38.3 t-20 -59.24 117.24 4.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 20.0 112.211 -179.953 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -65.24 -44.64 87.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 20.0 111.154 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 28.1 mttp -60.47 -39.77 88.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 20.0 111.176 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.2 tp -64.29 -50.87 66.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.235 -0.439 . . . . 20.0 111.143 179.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ARG . . . . . 0.402 ' CD ' ' SD ' ' A' ' 61' ' ' MET . 19.9 ttp-105 -57.83 -45.26 86.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 20.0 111.125 179.864 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -54.74 -49.47 61.52 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 116.219 -0.446 . . . . 20.0 112.366 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -73.73 -24.19 59.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.783 0.325 . . . . 20.0 111.1 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 29.5 m -74.02 -46.39 43.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 20.0 110.674 179.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.3 mt -66.92 -41.13 87.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.5 . . . . 20.0 110.631 178.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 95.2 m -65.28 -41.84 93.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 20.0 110.644 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.7 tt -61.26 -42.17 98.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 20.0 110.687 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 13.7 mmm -58.16 -39.09 77.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 20.0 110.642 178.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' TYR . . . . . 0.533 ' OH ' ' CB ' ' B' ' 82' ' ' ASP . 13.6 m-85 -64.36 -37.19 86.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.104 -0.498 . . . . 20.0 110.689 179.047 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -53.6 -41.89 67.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.13 -0.486 . . . . 20.0 110.633 179.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.96 -38.06 87.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.158 -0.474 . . . . 20.0 110.654 178.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 47.3 tp60 -60.0 -45.15 93.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.092 -0.504 . . . . 20.0 110.638 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASN . . . . . 0.47 ' CG ' ' CE2' ' B' ' 75' ' ' TYR . 41.5 t-20 -59.81 -38.5 82.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.157 -0.474 . . . . 20.0 111.579 178.874 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 17.5 m-30 -67.89 -30.52 69.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 20.0 111.225 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 mm -78.16 -30.6 15.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 20.0 111.203 -179.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASP . . . . . 0.472 ' CB ' ' OH ' ' B' ' 75' ' ' TYR . 87.1 m-20 -79.41 -1.74 38.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 20.0 111.204 -179.93 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -114.29 -0.23 13.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 20.0 111.189 -179.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 73.4 mt -58.86 -24.91 62.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 20.0 111.188 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -70.83 -43.9 67.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 20.0 111.227 -179.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -110.8 110.63 57.11 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 20.0 112.196 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -59.21 -44.62 32.58 Favored 'Trans proline' 0 C--N 1.329 -0.479 0 C-N-CA 121.725 1.617 . . . . 20.0 111.794 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -54.83 -46.52 74.61 Favored 'General case' 0 C--N 1.33 -0.271 0 O-C-N 123.264 0.353 . . . . 20.0 111.166 179.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -69.19 -35.62 76.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 20.0 111.185 179.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.6 tp -60.42 -44.12 96.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 20.0 111.176 179.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 76.5 t -65.05 -48.05 85.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 20.0 111.146 179.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.53 -33.39 59.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 20.0 111.178 179.847 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . 0.673 14.1 m -76.51 -45.64 33.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 20.0 111.119 179.891 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.5 t -61.42 -49.68 83.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.123 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -54.47 -41.67 69.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 20.0 111.121 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . 0.426 ' C ' ' CD ' ' A' ' 96' ' ' LYS . 7.3 tmtm? -60.47 -46.83 88.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 20.0 111.143 179.828 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -70.99 -32.46 69.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 20.0 111.119 179.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.01 -36.48 81.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 20.0 111.128 179.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.1 t -59.15 -31.13 45.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 20.0 111.139 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -73.19 -31.58 64.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 20.0 112.157 179.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HIS . . . . . 0.546 ' CD2' ' CE1' ' A' ' 111' ' ' PHE . 17.7 m80 -82.4 -30.99 29.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 20.0 111.157 179.847 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 24.5 mt -67.13 -38.77 81.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 20.0 111.139 179.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 76.2 p -78.45 -10.37 59.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.453 . . . . 20.0 111.195 179.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ARG . . . . . 0.491 ' O ' ' CB ' ' A' ' 105' ' ' LYS . 4.3 mpt_? -95.17 -9.04 34.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 20.0 111.178 179.941 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LYS . . . . . 0.491 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 2.6 mmmt 83.61 27.26 0.1 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 20.0 111.199 179.997 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.9 mm -98.9 104.59 16.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.233 179.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 42.5 p -84.33 165.93 17.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 20.0 111.261 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -44.42 -44.67 8.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 20.0 111.242 179.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -54.16 -61.42 2.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 20.0 111.204 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLU . . . . . 0.518 ' OE1' ' CE2' ' A' ' 50' ' ' TYR . 6.0 mm-40 -47.66 -62.53 1.4 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 20.0 111.234 -179.926 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' PHE . . . . . 0.546 ' CE1' ' CD2' ' A' ' 101' ' ' HIS . 12.0 t80 -44.19 -51.85 7.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.172 -0.467 . . . . 20.0 111.276 -179.942 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -51.82 -4.49 0.11 Allowed Glycine 0 N--CA 1.451 -0.33 0 CA-C-N 116.182 -0.463 . . . . 20.0 112.529 -179.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LYS . . . . . 0.447 ' N ' ' C ' ' A' ' 111' ' ' PHE . 72.3 mttt -79.55 6.56 10.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.778 0.323 . . . . 20.0 111.223 179.998 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 7.6 tp -97.11 -13.06 8.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 20.0 111.212 -179.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -63.06 -36.3 83.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 20.0 112.196 -179.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -62.67 -59.75 8.79 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 116.204 -0.453 . . . . 20.0 112.539 179.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -53.62 -53.09 7.12 Favored 'Trans proline' 0 C--N 1.33 -0.424 0 C-N-CA 121.699 1.599 . . . . 20.0 111.799 -179.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 71.7 mt -49.97 -47.94 23.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 O-C-N 123.256 0.348 . . . . 20.0 111.166 -179.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.41 -38.42 74.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 20.0 111.176 -179.918 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LYS . . . . . 0.456 ' NZ ' ' OD2' ' A' ' 43' ' ' ASP . 16.5 mttt -70.77 -46.05 63.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 20.0 111.13 179.885 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' VAL . . . . . 0.774 ' CG2' ' CD2' ' A' ' 36' ' ' LEU . 54.5 t -61.53 -36.08 70.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 20.0 111.163 179.892 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 18.6 mt -67.8 -43.04 80.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 20.0 111.167 179.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.94 -41.22 91.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 20.0 111.145 179.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 1.5 p -58.62 -22.36 56.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.153 -0.476 . . . . 20.0 111.129 -179.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LYS . . . . . 0.551 ' O ' ' CB ' ' A' ' 126' ' ' ASN . 1.5 mmmt -97.61 -3.17 40.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.181 179.924 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ASN . . . . . 0.551 ' CB ' ' O ' ' A' ' 125' ' ' LYS . 3.8 t-20 89.52 42.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.252 0.464 . . . . 20.0 112.252 179.987 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' PHE . . . . . 0.685 ' CD2' ' CD2' ' A' ' 131' ' ' TYR . 58.7 m-85 -124.39 99.16 6.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.45 . . . . 20.0 111.208 -179.987 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.77 -167.49 0.12 Allowed Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 116.204 -0.453 . . . . 20.0 112.515 179.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ASP . . . . . 0.878 ' O ' ' N ' ' A' ' 132' ' ' ALA . 3.7 m-20 -53.05 -62.25 1.77 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.816 0.341 . . . . 20.0 111.249 179.96 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' LYS . . . . . 0.613 ' C ' ' O ' ' A' ' 129' ' ' ASP . 31.2 tttt -17.04 -56.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 20.0 110.87 179.639 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' TYR . . . . . 0.685 ' CD2' ' CD2' ' A' ' 127' ' ' PHE . 79.5 m-85 -71.73 -37.21 70.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.475 . . . . 20.0 110.854 179.242 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ALA . . . . . 0.878 ' N ' ' O ' ' A' ' 129' ' ' ASP . . . -63.18 -38.18 90.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.101 -0.499 . . . . 20.0 110.76 179.268 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . 0.27 18.8 m120 -71.65 -42.39 67.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 20.0 111.765 179.277 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -55.83 -44.09 77.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 20.0 110.822 179.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' TRP . . . . . . . . . . . . . 69.2 m95 -64.39 -33.22 75.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 20.0 110.785 179.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.26 -40.97 83.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 20.0 110.835 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -60.0 -47.01 87.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.479 . . . . 20.0 110.773 179.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.8 tp -61.19 -44.63 96.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 20.0 110.724 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.86 -31.14 52.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 20.0 110.795 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.67 -40.08 90.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 20.0 111.155 179.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 34.5 t -51.62 -44.98 35.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 20.0 111.172 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 59.8 t -71.77 -32.59 45.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 20.0 111.138 179.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -65.53 -26.94 68.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 20.0 111.163 179.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -82.64 -15.43 52.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 20.0 111.16 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -94.63 2.26 55.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.209 -0.45 . . . . 20.0 111.213 179.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 67.0 mt . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 20.0 111.255 179.949 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.801 0.334 . . . . 20.0 111.211 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 38.6 t -47.43 -48.63 9.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 20.0 111.226 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -53.1 -45.2 68.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 20.0 111.185 -180.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -57.11 -45.71 83.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.184 -0.462 . . . . 20.0 111.213 179.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.55 -45.07 84.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 20.0 111.205 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.6 -52.67 64.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.458 . . . . 20.0 111.169 179.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.02 -13.99 14.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 20.0 111.185 179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' GLN . . . . . 0.756 ' CG ' ' N ' ' B' ' 10' ' ' LEU . 0.0 OUTLIER -63.27 -65.96 0.61 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.156 -0.475 . . . . 20.0 111.193 179.946 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' LEU . . . . . 0.756 ' N ' ' CG ' ' B' ' 9' ' ' GLN . 10.8 mt -26.64 118.05 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 20.0 111.118 179.982 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 43.5 p -94.11 173.13 7.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.462 . . . . 20.0 111.218 -179.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.06 -43.65 66.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 20.0 111.148 179.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ASP . . . . . . . . . . . . 0.472 15.5 m-20 -60.96 -51.41 69.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 20.0 111.138 179.886 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 24.6 t -60.98 -46.05 97.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 20.0 111.157 179.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . 0.26 98.0 mttt -60.26 -36.95 78.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.179 179.884 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 11.1 tptt -67.64 -46.23 73.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 20.0 111.104 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ASP . . . . . 0.473 ' OD1' ' NZ ' ' B' ' 130' ' ' LYS . 76.3 m-20 -64.44 -33.58 76.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 20.0 111.119 179.919 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 19.1 mt -65.95 -47.29 75.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 20.0 111.126 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ARG . . . . . . . . . . . . . 55.2 mtt180 -71.06 -33.2 70.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 20.0 111.118 179.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -63.73 -47.28 81.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 20.0 111.254 -179.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 4.3 p -70.07 -49.48 50.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.25 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' TRP . . . . . 0.408 ' O ' ' N ' ' B' ' 26' ' ' GLY . 57.1 t-105 -50.14 -39.32 42.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 20.0 111.252 -179.904 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 mttt -49.29 -23.6 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.463 . . . . 20.0 111.264 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' VAL . . . . . 0.487 ' O ' ' OG ' ' B' ' 27' ' ' SER . 47.8 t -100.37 -68.65 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 20.0 111.208 -179.951 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . 0.28 3.9 pt -56.07 -22.77 14.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 20.0 111.218 -179.953 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' B' ' 22' ' ' TRP . . . -82.28 -13.99 77.59 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 116.218 -0.446 . . . . 20.0 112.527 -179.996 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' SER . . . . . 0.487 ' OG ' ' O ' ' B' ' 24' ' ' VAL . 81.2 p -72.63 -24.69 61.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.781 0.324 . . . . 20.0 111.19 -179.998 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ASP . . . . . 0.433 ' O ' ' CB ' ' B' ' 32' ' ' ASN . 19.6 t0 -132.58 75.43 1.63 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 20.0 111.155 -179.951 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LYS . . . . . 0.473 ' CB ' ' CB ' ' B' ' 74' ' ' MET . 9.5 mttp -66.08 -33.82 76.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 20.0 111.183 179.962 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 10.0 ttpt -69.82 -53.75 16.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.457 . . . . 20.0 110.954 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . -70.63 -39.52 67.31 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 116.156 -0.475 . . . . 20.0 112.135 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ASN . . . . . 0.433 ' CB ' ' O ' ' B' ' 28' ' ' ASP . 48.0 m-20 -78.51 -40.51 34.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.861 0.363 . . . . 20.0 111.963 179.419 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.15 -42.89 99.93 Favored Glycine 0 N--CA 1.451 -0.362 0 CA-C-N 116.193 -0.458 . . . . 20.0 112.155 179.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 41.4 t -64.99 -38.82 83.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.809 0.337 . . . . 20.0 110.882 179.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.53 -43.59 98.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 20.0 110.979 179.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . 0.285 0.4 OUTLIER -62.46 -41.82 99.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 20.0 110.848 179.456 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' MET . . . . . . . . . . . . . 86.9 mmm -67.56 -41.76 83.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 20.0 110.913 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 24.3 p -66.09 -42.1 89.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 20.0 110.96 179.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 31.7 m -63.21 -41.37 99.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 20.0 110.894 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 22.1 tp -66.45 -26.31 67.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 20.0 111.26 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -82.34 -26.5 32.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 20.0 111.256 -179.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -83.84 -36.87 23.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 20.0 111.242 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -88.12 -35.12 17.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 20.0 111.22 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ASN . . . . . . . . . . . . . 25.5 m120 -121.59 78.24 1.42 Allowed 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.212 0.449 . . . . 20.0 112.212 179.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 7.7 mp0 -73.01 -5.96 42.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.169 -0.469 . . . . 20.0 111.22 179.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 -85.58 6.42 27.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 20.0 111.234 179.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 16.4 p -118.78 4.4 11.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 20.0 111.194 -179.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 57.2 mt -68.22 -37.82 78.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 20.0 111.165 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -66.63 -23.4 72.2 Favored Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 116.225 -0.443 . . . . 20.0 112.458 -179.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' TYR . . . . . 0.495 ' O ' ' CMD' ' B' ' 147' ' ' HEM . 15.6 m-85 -73.99 -6.25 46.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.807 0.337 . . . . 20.0 111.061 179.631 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -124.37 27.99 6.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 20.0 111.159 179.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.1 -11.31 0.25 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.434 . . . . 20.0 111.293 -179.874 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ARG . . . . . . . . . . . . . 27.7 ttp85 -79.3 -37.58 37.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.169 -0.468 . . . . 20.0 111.211 179.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 10.0 mt -72.41 5.25 3.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.446 . . . . 20.0 111.249 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 67.15 -129.88 29.4 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 116.173 -0.467 . . . . 20.0 112.528 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ASN . . . . . 0.488 ' ND2' ' OG ' ' B' ' 58' ' ' SER . 64.0 t30 -87.83 93.75 9.55 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.204 0.446 . . . . 20.0 112.204 179.997 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' VAL . . . . . . . . . . . . . 30.8 m -64.55 -3.8 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.177 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' SER . . . . . 0.488 ' OG ' ' ND2' ' B' ' 56' ' ' ASN . 1.4 p -75.43 -12.02 60.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.456 . . . . 20.0 111.227 179.981 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' GLN . . . . . . . . . . . . 0.347 0.3 OUTLIER -74.69 -40.28 61.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 20.0 111.259 179.959 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . 86.5 -124.76 7.08 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 116.172 -0.467 . . . . 20.0 112.488 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' MET . . . . . . . . . . . . . 3.6 tpp -70.01 -19.43 63.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.784 0.326 . . . . 20.0 111.193 -179.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.13 -19.68 60.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 20.0 111.221 -179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -81.68 110.9 17.46 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.241 0.46 . . . . 20.0 112.241 179.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.585 25.3 p-10 -52.99 -53.93 42.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 20.0 111.178 179.923 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 16.2 mttp -58.46 -45.27 88.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 20.0 111.13 179.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 14.8 tp -56.29 -48.3 76.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 20.0 111.111 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' ARG . . . . . . . . . . . . . 14.0 ttp-105 -59.25 -44.29 92.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 20.0 111.085 179.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -55.11 -44.98 83.68 Favored Glycine 0 N--CA 1.451 -0.346 0 CA-C-N 116.2 -0.454 . . . . 20.0 112.297 179.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' HIS . . . . . 0.419 ' O ' ' N ' ' B' ' 73' ' ' LEU . 81.7 t60 -69.1 -45.83 69.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.782 0.325 . . . . 20.0 111.074 179.738 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' SER . . . . . . . . . . . . . 50.0 m -57.3 -51.78 68.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 20.0 110.844 179.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 59.0 mt -62.49 -43.96 98.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 20.0 110.704 179.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 23.4 m -65.46 -41.78 93.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 20.0 110.768 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' LEU . . . . . 0.419 ' N ' ' O ' ' B' ' 69' ' ' HIS . 9.7 tt -62.78 -43.83 97.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 20.0 110.8 179.206 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' MET . . . . . 0.473 ' CB ' ' CB ' ' B' ' 29' ' ' LYS . 1.5 mmm -56.32 -39.37 72.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.484 . . . . 20.0 110.733 179.156 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' TYR . . . . . 0.472 ' OH ' ' CB ' ' A' ' 82' ' ' ASP . 13.7 m-85 -66.44 -37.98 86.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 20.0 110.748 179.186 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -51.63 -41.26 61.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 20.0 110.684 179.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 30.0 mt -66.93 -35.1 79.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.087 -0.506 . . . . 20.0 110.732 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -56.84 -45.5 82.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.112 -0.494 . . . . 20.0 110.777 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ASN . . . . . 0.502 ' CG ' ' CE2' ' A' ' 75' ' ' TYR . 13.1 t-20 -57.26 -40.0 76.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 20.0 111.684 179.022 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -72.08 -29.68 64.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 20.0 111.189 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ILE . . . . . 0.441 ' O ' ' CG2' ' B' ' 81' ' ' ILE . 32.7 mm -81.8 -8.91 11.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.447 . . . . 20.0 111.178 -179.939 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ASP . . . . . 0.533 ' CB ' ' OH ' ' A' ' 75' ' ' TYR . 77.3 m-20 -100.51 -12.91 18.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 20.0 111.173 -179.932 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 5.7 mm-40 -117.6 36.96 4.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 20.0 111.214 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 27.4 mt -86.83 -26.7 23.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 20.0 111.205 -179.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -90.53 0.41 57.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 20.0 111.195 -179.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -138.24 88.97 14.6 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 20.0 112.193 179.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -49.7 -44.66 35.01 Favored 'Trans proline' 0 C--N 1.329 -0.453 0 C-N-CA 121.696 1.597 . . . . 20.0 111.829 179.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -52.44 -47.71 66.22 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 123.334 0.396 . . . . 20.0 111.194 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -71.19 -44.78 64.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 20.0 111.13 179.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 14.5 tp -53.6 -47.32 70.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.216 -0.447 . . . . 20.0 111.196 179.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 78.7 t -58.38 -50.56 78.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 20.0 111.187 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -56.12 -40.61 74.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 20.0 111.196 179.868 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.842 2.2 m -69.27 -42.81 81.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 20.0 111.178 179.887 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.41 -48.62 84.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.159 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -54.87 -41.72 71.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.198 -0.455 . . . . 20.0 111.125 179.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' LYS . . . . . 0.46 ' C ' ' CD ' ' B' ' 96' ' ' LYS . 5.9 tmtm? -58.27 -57.4 13.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 20.0 111.116 179.887 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -62.85 -24.3 67.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.447 . . . . 20.0 111.119 179.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.59 -36.04 82.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 20.0 111.141 179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' VAL . . . . . . . . . . . . . 5.6 t -56.84 -51.52 66.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.147 -0.479 . . . . 20.0 111.114 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -58.41 -30.61 66.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 20.0 112.226 179.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' HIS . . . . . . . . . . . . . 49.7 m80 -81.77 -33.9 30.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 20.0 111.187 179.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ILE . . . . . . . . . . . . . 67.2 mt -66.85 -35.03 73.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 20.0 111.223 179.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' THR . . . . . . . . . . . . . 26.7 p -77.59 -22.08 51.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 20.0 111.197 179.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ARG . . . . . 0.457 ' NH1' ' O2A' ' B' ' 147' ' ' HEM . 4.4 mpt_? -88.87 6.82 37.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 20.0 111.215 179.924 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' LYS . . . . . 0.64 ' CA ' ' CE ' ' B' ' 105' ' ' LYS . 7.7 mmmt 61.22 37.56 17.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.187 179.956 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 5.9 mm -93.93 85.96 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 20.0 111.247 179.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 37.2 p -58.77 159.1 7.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 20.0 111.202 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -51.71 -47.48 63.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 20.0 111.195 179.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -55.94 -48.57 75.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.445 . . . . 20.0 111.165 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . 0.392 9.2 mt-10 -58.12 -40.9 82.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 20.0 111.278 -179.895 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -65.71 -30.25 70.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 20.0 111.209 -179.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' GLY . . . . . . . . . . . . . . . -69.1 -2.0 29.45 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 116.255 -0.43 . . . . 20.0 112.518 -179.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 75.2 mttt -75.65 -14.11 60.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.779 0.323 . . . . 20.0 111.202 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' ILE . . . . . . . . . . . . . 8.4 tp -78.19 -6.33 9.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 20.0 111.197 -179.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' ASN . . . . . . . . . . . . . 40.2 m-20 -70.92 -38.06 72.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.222 0.453 . . . . 20.0 112.222 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . -60.72 -52.85 49.91 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 116.199 -0.455 . . . . 20.0 112.527 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -62.67 -49.78 5.09 Favored 'Trans proline' 0 C--N 1.329 -0.479 0 C-N-CA 121.686 1.59 . . . . 20.0 111.769 179.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' ILE . . . . . . . . . . . . . 8.5 mt -49.74 -48.45 21.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 O-C-N 123.303 0.377 . . . . 20.0 111.206 179.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 57.0 tttt -57.66 -38.35 74.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 20.0 111.164 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -67.31 -51.31 54.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 20.0 111.123 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 27.6 t -57.5 -32.31 41.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 20.0 111.168 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.42 -44.22 58.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 20.0 111.115 179.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -62.38 -34.74 77.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 20.0 111.18 179.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 54.7 p -63.27 -21.91 66.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 20.0 111.154 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' LYS . . . . . 0.609 ' O ' ' CB ' ' B' ' 126' ' ' ASN . 5.0 mmtm -97.0 -9.38 28.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 20.0 111.154 179.919 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' ASN . . . . . 0.609 ' CB ' ' O ' ' B' ' 125' ' ' LYS . 9.3 m120 95.74 31.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.207 0.447 . . . . 20.0 112.207 -179.979 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' PHE . . . . . 0.441 ' O ' ' O ' ' B' ' 128' ' ' GLY . 44.2 m-85 -106.42 96.65 6.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 20.0 111.191 179.998 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' GLY . . . . . 0.441 ' O ' ' O ' ' B' ' 127' ' ' PHE . . . -48.99 -174.65 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 116.189 -0.46 . . . . 20.0 112.505 179.989 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' ASP . . . . . 0.737 ' O ' ' N ' ' B' ' 132' ' ' ALA . 64.5 m-20 -57.58 -51.44 69.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.823 0.344 . . . . 20.0 111.22 -179.998 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' LYS . . . . . 0.516 ' C ' ' O ' ' B' ' 129' ' ' ASP . 1.9 tttt -27.73 -46.93 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 20.0 110.725 179.367 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' TYR . . . . . 0.411 ' N ' ' O ' ' B' ' 129' ' ' ASP . 96.6 m-85 -76.73 -36.11 57.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 20.0 110.715 179.055 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' ALA . . . . . 0.737 ' N ' ' O ' ' B' ' 129' ' ' ASP . . . -62.53 -42.16 99.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 20.0 110.696 179.152 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -65.96 -40.92 91.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.466 . . . . 20.0 111.753 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.79 -43.41 90.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 20.0 110.756 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -63.27 -35.61 80.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 20.0 110.682 179.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.43 -40.73 87.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 20.0 110.688 179.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 40.3 mttm -59.68 -45.33 92.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 20.0 110.685 179.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 53.2 tp -61.48 -40.46 94.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.153 -0.476 . . . . 20.0 110.613 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' VAL . . . . . . . . . . . . . 5.5 t -64.74 -36.88 78.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 20.0 110.69 179.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -55.65 -41.22 73.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 20.0 111.149 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' VAL . . . . . . . . . . . . . 94.1 t -51.77 -39.08 23.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 20.0 111.096 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 90.4 t -71.95 -38.72 65.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 20.0 111.153 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -64.74 -33.39 75.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.22 179.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.97 -21.28 66.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.18 179.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -97.26 1.54 49.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 20.0 111.202 179.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 58.8 mt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 20.0 111.185 179.997 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HEM . . . . . 0.77 ' C1C' ' C ' ' A' ' 501' ' ' CMO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' CMO . . . . . 0.77 ' C ' ' C1C' ' A' ' 147' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' HEM . . . . . 0.602 ' C1C' ' C ' ' B' ' 501' ' ' CMO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 501' ' ' CMO . . . . . 0.602 ' C ' ' C1C' ' B' ' 147' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.808 0.337 . . . . 20.0 111.188 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' VAL . . . . . 0.465 HG13 ' CE2' ' A' ' 4' ' ' TYR 0.275 2.3 p -57.75 -47.11 86.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 20.0 111.2 179.97 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 4' ' ' TYR . . . . . 0.619 ' CD2' ' N ' ' A' ' 4' ' ' TYR 0.575 0.1 OUTLIER -59.51 -33.99 72.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 20.0 111.17 179.941 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -71.95 -50.2 30.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.246 -0.433 . . . . 20.0 111.2 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.35 -47.9 82.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 20.0 111.179 179.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.56 -27.07 67.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 20.0 111.17 179.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.73 -6.95 45.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.185 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -88.9 -3.12 58.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.455 . . . . 20.0 111.213 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 32.9 mt -84.64 70.08 10.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 20.0 111.149 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.3 p -61.53 174.82 0.69 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 20.0 111.192 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.56 -42.11 95.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 20.0 111.173 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 -58.13 -52.17 66.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 20.0 111.191 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 41.4 t -61.96 -38.93 81.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 20.0 111.163 179.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 24.5 mtmt -60.6 -42.93 97.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.465 . . . . 20.0 111.162 179.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.6 tptp -65.97 -41.15 91.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 20.0 111.097 179.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -63.35 -40.19 96.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 20.0 111.146 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.0 mt -63.41 -41.41 98.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.153 179.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 31.0 mtt-85 -73.11 -43.08 62.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.458 . . . . 20.0 111.111 179.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -58.42 -39.69 80.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 20.0 111.266 -179.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 27.0 p -78.59 -44.63 23.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 20.0 111.228 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' TRP . . . . . 0.563 ' O ' ' N ' ' A' ' 26' ' ' GLY . 51.8 t-105 -53.61 -41.53 66.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.265 -0.425 . . . . 20.0 111.23 -179.905 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -49.38 -36.06 20.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.25 -0.432 . . . . 20.0 111.261 -179.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 70.9 t -83.31 -60.06 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.46 . . . . 20.0 111.245 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . 0.367 15.1 pt -65.88 -18.94 24.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 20.0 111.245 -179.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 22' ' ' TRP . . . -78.27 -22.08 68.76 Favored Glycine 0 N--CA 1.451 -0.32 0 CA-C-N 116.205 -0.452 . . . . 20.0 112.513 -179.99 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 96.6 p -65.51 -31.83 73.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.774 0.321 . . . . 20.0 111.214 -179.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ASP . . . . . 0.724 ' O ' ' HB2' ' A' ' 32' ' ' ASN . 15.5 t0 -126.69 87.2 2.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 20.0 111.24 -179.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LYS . . . . . 0.641 ' O ' ' HG3' ' A' ' 74' ' ' MET . 0.2 OUTLIER -78.3 -34.11 48.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 20.0 111.24 179.977 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LYS . . . . . 0.614 ' HD3' HD11 ' A' ' 71' ' ' ILE . 17.7 ttpt -73.37 -52.64 13.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.035 179.701 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLY . . . . . 0.536 ' HA3' ' OD2' ' A' ' 28' ' ' ASP . . . -65.98 -43.18 94.09 Favored Glycine 0 N--CA 1.451 -0.353 0 CA-C-N 116.218 -0.446 . . . . 20.0 112.212 179.626 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASN . . . . . 0.724 ' HB2' ' O ' ' A' ' 28' ' ' ASP . 87.5 m-20 -76.8 -35.89 57.32 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.036 0.384 . . . . 20.0 112.036 179.711 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.76 -47.54 90.7 Favored Glycine 0 N--CA 1.451 -0.343 0 CA-C-N 116.147 -0.479 . . . . 20.0 112.305 179.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.6 t -64.81 -38.39 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.837 0.351 . . . . 20.0 110.98 179.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.11 -44.54 94.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 20.0 111.013 179.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . 1.125 HD23 ' CG2' ' A' ' 121' ' ' VAL 0.316 14.5 mt -61.68 -41.07 97.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 20.0 110.945 179.657 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 52.7 mmm -66.71 -46.19 76.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 20.0 111.041 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.4 p -60.32 -44.28 95.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 20.0 111.012 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 25.3 m -65.38 -34.03 77.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 20.0 110.975 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 13.8 tp -71.06 -33.16 69.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 20.0 111.284 -179.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -80.75 -21.04 41.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 20.0 111.263 -179.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -86.91 -36.08 18.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 20.0 111.251 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -87.27 -25.29 24.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.464 . . . . 20.0 111.205 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . 0.445 ' HB3' HG23 ' A' ' 47' ' ' THR . 17.6 m120 -133.5 86.18 2.27 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.218 0.451 . . . . 20.0 112.218 -179.96 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLN . . . . . 0.486 ' C ' ' H ' ' A' ' 47' ' ' THR . 20.0 mt-30 -70.37 -32.78 70.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 20.0 111.224 179.945 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.2 pm0 -66.78 13.14 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.207 179.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . 0.486 ' H ' ' C ' ' A' ' 45' ' ' GLN . 3.7 p -125.44 12.91 8.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 20.0 111.251 -179.99 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 95.4 mt -82.92 -34.2 11.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 20.0 111.242 179.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -68.42 -11.43 61.98 Favored Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 116.164 -0.471 . . . . 20.0 112.475 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' TYR . . . . . 0.636 ' O ' ' CMD' ' A' ' 147' ' ' HEM . 6.3 m-85 -83.05 1.81 38.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.813 0.34 . . . . 20.0 111.168 179.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' PHE . . . . . 0.477 ' HB3' ' HG ' ' A' ' 54' ' ' LEU . 21.7 m-85 -134.69 43.16 2.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.472 . . . . 20.0 111.152 179.995 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.5 ttmt -53.32 -45.47 69.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.241 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 57.1 ttp85 -57.5 -30.33 65.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 20.0 111.192 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . 0.477 ' HG ' ' HB3' ' A' ' 51' ' ' PHE . 5.0 mt -65.27 -19.1 65.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.242 -0.435 . . . . 20.0 111.226 -179.967 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 75.97 -125.63 7.95 Favored Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 116.208 -0.451 . . . . 20.0 112.52 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -90.32 101.6 14.32 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.177 0.436 . . . . 20.0 112.177 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . 0.454 ' C ' ' H ' ' A' ' 59' ' ' GLN . 4.4 m -75.64 -31.11 22.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 20.0 111.214 179.935 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 p -60.43 0.01 0.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 20.0 111.196 -179.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLN . . . . . 0.454 ' H ' ' C ' ' A' ' 57' ' ' VAL . 5.4 mt-30 -83.01 -20.92 34.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 20.0 111.2 -179.958 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 71.71 -141.53 32.12 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 116.217 -0.447 . . . . 20.0 112.484 179.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' MET . . . . . 0.402 ' SD ' ' CD ' ' A' ' 67' ' ' ARG . 38.5 tpp -57.57 -30.46 65.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.795 0.331 . . . . 20.0 111.211 -179.974 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -51.89 -47.78 64.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 20.0 111.193 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 -59.24 117.24 4.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 20.0 112.211 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -65.24 -44.64 87.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 20.0 111.154 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 28.1 mttp -60.47 -39.77 88.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 20.0 111.176 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.2 tp -64.29 -50.87 66.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.235 -0.439 . . . . 20.0 111.143 179.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ARG . . . . . 0.431 ' HD2' ' HD2' ' A' ' 30' ' ' LYS . 19.9 ttp-105 -57.83 -45.26 86.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 20.0 111.125 179.864 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -54.74 -49.47 61.52 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 116.219 -0.446 . . . . 20.0 112.366 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -73.73 -24.19 59.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.783 0.325 . . . . 20.0 111.1 179.799 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 29.5 m -74.02 -46.39 43.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 20.0 110.674 179.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ILE . . . . . 0.614 HD11 ' HD3' ' A' ' 30' ' ' LYS . 20.3 mt -66.92 -41.13 87.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.5 . . . . 20.0 110.631 178.894 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 95.2 m -65.28 -41.84 93.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 20.0 110.644 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . 0.593 ' C ' HD23 ' A' ' 73' ' ' LEU . 6.7 tt -61.26 -42.17 98.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 20.0 110.687 179.003 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' MET . . . . . 0.641 ' HG3' ' O ' ' A' ' 29' ' ' LYS . 13.7 mmm -58.16 -39.09 77.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 20.0 110.642 178.992 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' TYR . . . . . 0.644 ' OH ' ' HB2' ' B' ' 82' ' ' ASP . 13.6 m-85 -64.36 -37.19 86.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.104 -0.498 . . . . 20.0 110.689 179.047 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -53.6 -41.89 67.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.13 -0.486 . . . . 20.0 110.633 179.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.96 -38.06 87.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.158 -0.474 . . . . 20.0 110.654 178.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 47.3 tp60 -60.0 -45.15 93.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.092 -0.504 . . . . 20.0 110.638 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASN . . . . . 0.838 ' HA ' ' CZ ' ' B' ' 75' ' ' TYR . 41.5 t-20 -59.81 -38.5 82.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.157 -0.474 . . . . 20.0 111.579 178.874 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 17.5 m-30 -67.89 -30.52 69.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 20.0 111.225 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 mm -78.16 -30.6 15.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 20.0 111.203 -179.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASP . . . . . 0.777 ' HB2' ' OH ' ' B' ' 75' ' ' TYR . 87.1 m-20 -79.41 -1.74 38.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 20.0 111.204 -179.93 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLN . . . . . 0.796 ' HG2' ' O ' ' A' ' 79' ' ' ASN . 31.1 mm-40 -114.29 -0.23 13.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 20.0 111.189 -179.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 73.4 mt -58.86 -24.91 62.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 20.0 111.188 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -70.83 -43.9 67.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 20.0 111.227 -179.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -110.8 110.63 57.11 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 20.0 112.196 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -59.21 -44.62 32.58 Favored 'Trans proline' 0 C--N 1.329 -0.479 0 C-N-CA 121.725 1.617 . . . . 20.0 111.794 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -54.83 -46.52 74.61 Favored 'General case' 0 C--N 1.33 -0.271 0 O-C-N 123.264 0.353 . . . . 20.0 111.166 179.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -69.19 -35.62 76.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 20.0 111.185 179.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.6 tp -60.42 -44.12 96.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 20.0 111.176 179.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 76.5 t -65.05 -48.05 85.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 20.0 111.146 179.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.53 -33.39 59.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 20.0 111.178 179.847 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . 0.673 14.1 m -76.51 -45.64 33.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 20.0 111.119 179.891 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.5 t -61.42 -49.68 83.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.123 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -54.47 -41.67 69.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 20.0 111.121 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . 0.648 ' C ' ' HD3' ' A' ' 96' ' ' LYS . 7.3 tmtm? -60.47 -46.83 88.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 20.0 111.143 179.828 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -70.99 -32.46 69.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 20.0 111.119 179.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.01 -36.48 81.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 20.0 111.128 179.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.1 t -59.15 -31.13 45.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 20.0 111.139 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASN . . . . . 0.553 ' O ' ' HD3' ' A' ' 104' ' ' ARG . 12.4 m120 -73.19 -31.58 64.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 20.0 112.157 179.755 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HIS . . . . . 0.606 ' NE2' ' HE1' ' A' ' 111' ' ' PHE . 17.7 m80 -82.4 -30.99 29.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 20.0 111.157 179.847 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 24.5 mt -67.13 -38.77 81.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 20.0 111.139 179.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 76.2 p -78.45 -10.37 59.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.453 . . . . 20.0 111.195 179.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ARG . . . . . 0.753 ' O ' ' HB2' ' A' ' 105' ' ' LYS . 4.3 mpt_? -95.17 -9.04 34.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 20.0 111.178 179.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LYS . . . . . 0.753 ' HB2' ' O ' ' A' ' 104' ' ' ARG . 2.6 mmmt 83.61 27.26 0.1 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 20.0 111.199 179.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.9 mm -98.9 104.59 16.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.233 179.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 42.5 p -84.33 165.93 17.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 20.0 111.261 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -44.42 -44.67 8.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 20.0 111.242 179.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -54.16 -61.42 2.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 20.0 111.204 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLU . . . . . 0.711 ' O ' ' HB2' ' A' ' 113' ' ' LYS . 6.0 mm-40 -47.66 -62.53 1.4 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 20.0 111.234 -179.926 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' PHE . . . . . 0.606 ' HE1' ' NE2' ' A' ' 101' ' ' HIS . 12.0 t80 -44.19 -51.85 7.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.172 -0.467 . . . . 20.0 111.276 -179.942 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -51.82 -4.49 0.11 Allowed Glycine 0 N--CA 1.451 -0.33 0 CA-C-N 116.182 -0.463 . . . . 20.0 112.529 -179.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LYS . . . . . 0.711 ' HB2' ' O ' ' A' ' 110' ' ' GLU . 72.3 mttt -79.55 6.56 10.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.778 0.323 . . . . 20.0 111.223 179.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 7.6 tp -97.11 -13.06 8.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 20.0 111.212 -179.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 45.5 m-20 -63.06 -36.3 83.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 20.0 112.196 -179.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -62.67 -59.75 8.79 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 116.204 -0.453 . . . . 20.0 112.539 179.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -53.62 -53.09 7.12 Favored 'Trans proline' 0 C--N 1.33 -0.424 0 C-N-CA 121.699 1.599 . . . . 20.0 111.799 -179.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 71.7 mt -49.97 -47.94 23.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 O-C-N 123.256 0.348 . . . . 20.0 111.166 -179.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.41 -38.42 74.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 20.0 111.176 -179.918 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -70.77 -46.05 63.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 20.0 111.13 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' VAL . . . . . 1.125 ' CG2' HD23 ' A' ' 36' ' ' LEU . 54.5 t -61.53 -36.08 70.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 20.0 111.163 179.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' LEU . . . . . 0.591 HD11 ' CD1' ' A' ' 135' ' ' TRP . 18.6 mt -67.8 -43.04 80.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 20.0 111.167 179.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.94 -41.22 91.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 20.0 111.145 179.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' SER . . . . . 0.507 ' OG ' ' HD3' ' A' ' 125' ' ' LYS . 1.5 p -58.62 -22.36 56.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.153 -0.476 . . . . 20.0 111.129 -179.992 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LYS . . . . . 0.551 ' O ' ' CB ' ' A' ' 126' ' ' ASN . 1.5 mmmt -97.61 -3.17 40.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.181 179.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ASN . . . . . 0.551 ' CB ' ' O ' ' A' ' 125' ' ' LYS . 3.8 t-20 89.52 42.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.252 0.464 . . . . 20.0 112.252 179.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' PHE . . . . . 0.836 ' HD2' ' CD2' ' A' ' 131' ' ' TYR . 58.7 m-85 -124.39 99.16 6.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.45 . . . . 20.0 111.208 -179.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.77 -167.49 0.12 Allowed Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 116.204 -0.453 . . . . 20.0 112.515 179.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ASP . . . . . 0.878 ' O ' ' N ' ' A' ' 132' ' ' ALA . 3.7 m-20 -53.05 -62.25 1.77 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.816 0.341 . . . . 20.0 111.249 179.96 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 130' ' ' LYS . . . . . 0.613 ' C ' ' O ' ' A' ' 129' ' ' ASP . 31.2 tttt -17.04 -56.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 20.0 110.87 179.639 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' TYR . . . . . 0.836 ' CD2' ' HD2' ' A' ' 127' ' ' PHE . 79.5 m-85 -71.73 -37.21 70.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.475 . . . . 20.0 110.854 179.242 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ALA . . . . . 0.878 ' N ' ' O ' ' A' ' 129' ' ' ASP . . . -63.18 -38.18 90.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.101 -0.499 . . . . 20.0 110.76 179.268 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . 0.27 86.0 m-20 -71.65 -42.39 67.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 20.0 111.765 179.277 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -55.83 -44.09 77.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 20.0 110.822 179.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' TRP . . . . . 0.591 ' CD1' HD11 ' A' ' 122' ' ' LEU . 69.2 m95 -64.39 -33.22 75.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 20.0 110.785 179.197 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.26 -40.97 83.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 20.0 110.835 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -60.0 -47.01 87.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.479 . . . . 20.0 110.773 179.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.8 tp -61.19 -44.63 96.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 20.0 110.724 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.86 -31.14 52.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 20.0 110.795 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.67 -40.08 90.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 20.0 111.155 179.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 34.5 t -51.62 -44.98 35.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 20.0 111.172 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 59.8 t -71.77 -32.59 45.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 20.0 111.138 179.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -65.53 -26.94 68.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 20.0 111.163 179.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -82.64 -15.43 52.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 20.0 111.16 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -94.63 2.26 55.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.209 -0.45 . . . . 20.0 111.213 179.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 67.0 mt . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 20.0 111.255 179.949 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.801 0.334 . . . . 20.0 111.211 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 38.6 t -47.43 -48.63 9.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 20.0 111.226 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -53.1 -45.2 68.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 20.0 111.185 -180.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -57.11 -45.71 83.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.184 -0.462 . . . . 20.0 111.213 179.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.55 -45.07 84.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 20.0 111.205 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.6 -52.67 64.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.458 . . . . 20.0 111.169 179.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.02 -13.99 14.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 20.0 111.185 179.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' GLN . . . . . 0.958 ' HG3' ' H ' ' B' ' 10' ' ' LEU . 0.0 OUTLIER -63.27 -65.96 0.61 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.156 -0.475 . . . . 20.0 111.193 179.946 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 10' ' ' LEU . . . . . 0.958 ' H ' ' HG3' ' B' ' 9' ' ' GLN . 10.8 mt -26.64 118.05 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 20.0 111.118 179.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 11' ' ' THR . . . . . 0.563 ' O ' ' HG3' ' B' ' 15' ' ' LYS . 43.5 p -94.11 173.13 7.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.462 . . . . 20.0 111.218 -179.979 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.06 -43.65 66.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 20.0 111.148 179.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ASP . . . . . . . . . . . . 0.472 15.5 m-20 -60.96 -51.41 69.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 20.0 111.138 179.886 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 14' ' ' VAL . . . . . 0.474 HG21 ' HD3' ' B' ' 137' ' ' LYS . 24.6 t -60.98 -46.05 97.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 20.0 111.157 179.935 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LYS . . . . . 0.59 ' HE3' ' O ' ' B' ' 10' ' ' LEU 0.26 98.0 mttt -60.26 -36.95 78.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.179 179.884 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 11.1 tptt -67.64 -46.23 73.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 20.0 111.104 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ASP . . . . . 0.445 ' OD1' ' NZ ' ' B' ' 130' ' ' LYS . 76.3 m-20 -64.44 -33.58 76.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 20.0 111.119 179.919 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 19.1 mt -65.95 -47.29 75.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 20.0 111.126 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ARG . . . . . . . . . . . . . 55.2 mtt180 -71.06 -33.2 70.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 20.0 111.118 179.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -63.73 -47.28 81.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 20.0 111.254 -179.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 4.3 p -70.07 -49.48 50.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.25 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' TRP . . . . . . . . . . . . . 57.1 t-105 -50.14 -39.32 42.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 20.0 111.252 -179.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 mttt -49.29 -23.6 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.463 . . . . 20.0 111.264 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' VAL . . . . . 0.424 ' O ' ' OG ' ' B' ' 27' ' ' SER . 47.8 t -100.37 -68.65 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 20.0 111.208 -179.951 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ILE . . . . . 0.602 ' HA ' ' ND2' ' B' ' 32' ' ' ASN 0.28 3.9 pt -56.07 -22.77 14.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 20.0 111.218 -179.953 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.28 -13.99 77.59 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 116.218 -0.446 . . . . 20.0 112.527 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' B' ' 24' ' ' VAL . 81.2 p -72.63 -24.69 61.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.781 0.324 . . . . 20.0 111.19 -179.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ASP . . . . . 0.794 ' O ' ' HB2' ' B' ' 32' ' ' ASN . 19.6 t0 -132.58 75.43 1.63 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 20.0 111.155 -179.951 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LYS . . . . . 1.022 ' HB3' ' HB3' ' B' ' 74' ' ' MET . 9.5 mttp -66.08 -33.82 76.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 20.0 111.183 179.962 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 10.0 ttpt -69.82 -53.75 16.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.457 . . . . 20.0 110.954 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . -70.63 -39.52 67.31 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 116.156 -0.475 . . . . 20.0 112.135 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ASN . . . . . 0.794 ' HB2' ' O ' ' B' ' 28' ' ' ASP . 48.0 m-20 -78.51 -40.51 34.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.861 0.363 . . . . 20.0 111.963 179.419 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' GLY . . . . . 0.453 ' HA3' ' HG2' ' B' ' 74' ' ' MET . . . -61.15 -42.89 99.93 Favored Glycine 0 N--CA 1.451 -0.362 0 CA-C-N 116.193 -0.458 . . . . 20.0 112.155 179.545 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 34' ' ' VAL . . . . . 0.603 HG21 ' CE ' ' B' ' 61' ' ' MET . 41.4 t -64.99 -38.82 83.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.809 0.337 . . . . 20.0 110.882 179.514 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.53 -43.59 98.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 20.0 110.979 179.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' LEU . . . . . 0.457 HD23 ' HB2' ' B' ' 117' ' ' PRO 0.285 0.4 OUTLIER -62.46 -41.82 99.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 20.0 110.848 179.456 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 37' ' ' MET . . . . . . . . . . . . . 86.9 mmm -67.56 -41.76 83.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 20.0 110.913 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 24.3 p -66.09 -42.1 89.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 20.0 110.96 179.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' THR . . . . . 0.408 HG21 ' HD2' ' B' ' 120' ' ' LYS . 31.7 m -63.21 -41.37 99.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 20.0 110.894 179.491 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 22.1 tp -66.45 -26.31 67.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 20.0 111.26 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' PHE . . . . . 0.409 ' CE2' ' HB ' ' B' ' 57' ' ' VAL . 12.7 m-85 -82.34 -26.5 32.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 20.0 111.256 -179.919 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -83.84 -36.87 23.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 20.0 111.242 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -88.12 -35.12 17.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 20.0 111.22 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ASN . . . . . . . . . . . . . 25.5 m120 -121.59 78.24 1.42 Allowed 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.212 0.449 . . . . 20.0 112.212 179.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 7.7 mp0 -73.01 -5.96 42.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.169 -0.469 . . . . 20.0 111.22 179.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 -85.58 6.42 27.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 20.0 111.234 179.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 16.4 p -118.78 4.4 11.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 20.0 111.194 -179.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 57.2 mt -68.22 -37.82 78.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 20.0 111.165 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -66.63 -23.4 72.2 Favored Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 116.225 -0.443 . . . . 20.0 112.458 -179.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' TYR . . . . . 0.495 ' O ' ' CMD' ' B' ' 147' ' ' HEM . 15.6 m-85 -73.99 -6.25 46.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.807 0.337 . . . . 20.0 111.061 179.631 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -124.37 27.99 6.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 20.0 111.159 179.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.1 -11.31 0.25 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.434 . . . . 20.0 111.293 -179.874 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ARG . . . . . 0.491 ' HE ' ' CGD' ' B' ' 147' ' ' HEM . 27.7 ttp85 -79.3 -37.58 37.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.169 -0.468 . . . . 20.0 111.211 179.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' LEU . . . . . 0.831 HD13 ' HA ' ' B' ' 66' ' ' LEU . 10.0 mt -72.41 5.25 3.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.446 . . . . 20.0 111.249 -179.996 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 67.15 -129.88 29.4 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 116.173 -0.467 . . . . 20.0 112.528 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -87.83 93.75 9.55 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.204 0.446 . . . . 20.0 112.204 179.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' VAL . . . . . 0.409 ' HB ' ' CE2' ' B' ' 41' ' ' PHE . 30.8 m -64.55 -3.8 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.177 179.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 1.4 p -75.43 -12.02 60.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.456 . . . . 20.0 111.227 179.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' GLN . . . . . . . . . . . . 0.347 15.2 mm-40 -74.69 -40.28 61.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 20.0 111.259 179.959 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 60' ' ' GLY . . . . . 0.499 ' O ' HD23 ' B' ' 66' ' ' LEU . . . 86.5 -124.76 7.08 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 116.172 -0.467 . . . . 20.0 112.488 179.942 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 61' ' ' MET . . . . . 0.603 ' CE ' HG21 ' B' ' 34' ' ' VAL . 3.6 tpp -70.01 -19.43 63.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.784 0.326 . . . . 20.0 111.193 -179.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.13 -19.68 60.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 20.0 111.221 -179.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' ASN . . . . . 0.525 ' HB3' ' HB3' ' B' ' 66' ' ' LEU . 40.4 t-20 -81.68 110.9 17.46 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.241 0.46 . . . . 20.0 112.241 179.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.585 25.3 p-10 -52.99 -53.93 42.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 20.0 111.178 179.923 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' LYS . . . . . 0.755 ' C ' HD22 ' B' ' 54' ' ' LEU . 16.2 mttp -58.46 -45.27 88.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 20.0 111.13 179.899 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 66' ' ' LEU . . . . . 0.831 ' HA ' HD13 ' B' ' 54' ' ' LEU . 14.8 tp -56.29 -48.3 76.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 20.0 111.111 179.893 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' ARG . . . . . . . . . . . . . 14.0 ttp-105 -59.25 -44.29 92.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 20.0 111.085 179.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -55.11 -44.98 83.68 Favored Glycine 0 N--CA 1.451 -0.346 0 CA-C-N 116.2 -0.454 . . . . 20.0 112.297 179.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -69.1 -45.83 69.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.782 0.325 . . . . 20.0 111.074 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' SER . . . . . . . . . . . . . 50.0 m -57.3 -51.78 68.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 20.0 110.844 179.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 59.0 mt -62.49 -43.96 98.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 20.0 110.704 179.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 23.4 m -65.46 -41.78 93.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 20.0 110.768 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' LEU . . . . . 0.466 HD23 ' C ' ' B' ' 73' ' ' LEU . 9.7 tt -62.78 -43.83 97.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 20.0 110.8 179.206 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 74' ' ' MET . . . . . 1.022 ' HB3' ' HB3' ' B' ' 29' ' ' LYS . 1.5 mmm -56.32 -39.37 72.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.484 . . . . 20.0 110.733 179.156 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 75' ' ' TYR . . . . . 0.838 ' CZ ' ' HA ' ' A' ' 79' ' ' ASN . 13.7 m-85 -66.44 -37.98 86.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 20.0 110.748 179.186 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -51.63 -41.26 61.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 20.0 110.684 179.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 30.0 mt -66.93 -35.1 79.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.087 -0.506 . . . . 20.0 110.732 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -56.84 -45.5 82.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.112 -0.494 . . . . 20.0 110.777 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ASN . . . . . 0.804 ' O ' ' HG2' ' B' ' 83' ' ' GLN . 13.1 t-20 -57.26 -40.0 76.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 20.0 111.684 179.022 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -72.08 -29.68 64.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 20.0 111.189 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ILE . . . . . 0.533 HG22 ' O ' ' B' ' 81' ' ' ILE . 32.7 mm -81.8 -8.91 11.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.447 . . . . 20.0 111.178 -179.939 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ASP . . . . . 0.644 ' HB2' ' OH ' ' A' ' 75' ' ' TYR . 77.3 m-20 -100.51 -12.91 18.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 20.0 111.173 -179.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLN . . . . . 0.804 ' HG2' ' O ' ' B' ' 79' ' ' ASN . 5.7 mm-40 -117.6 36.96 4.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 20.0 111.214 179.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 27.4 mt -86.83 -26.7 23.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 20.0 111.205 -179.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -90.53 0.41 57.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 20.0 111.195 -179.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -138.24 88.97 14.6 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 20.0 112.193 179.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' PRO . . . . . 0.404 ' O ' HG23 ' B' ' 91' ' ' VAL . 73.3 Cg_exo -49.7 -44.66 35.01 Favored 'Trans proline' 0 C--N 1.329 -0.453 0 C-N-CA 121.696 1.597 . . . . 20.0 111.829 179.914 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -52.44 -47.71 66.22 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 123.334 0.396 . . . . 20.0 111.194 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -71.19 -44.78 64.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 20.0 111.13 179.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' LEU . . . . . 0.646 ' HB2' ' O ' ' B' ' 83' ' ' GLN . 14.5 tp -53.6 -47.32 70.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.216 -0.447 . . . . 20.0 111.196 179.933 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' VAL . . . . . 0.404 HG23 ' O ' ' B' ' 87' ' ' PRO . 78.7 t -58.38 -50.56 78.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 20.0 111.187 179.909 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 92' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -56.12 -40.61 74.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 20.0 111.196 179.868 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.842 2.2 m -69.27 -42.81 81.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 20.0 111.178 179.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.41 -48.62 84.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.159 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -54.87 -41.72 71.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.198 -0.455 . . . . 20.0 111.125 179.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' LYS . . . . . 0.617 ' C ' ' HD3' ' B' ' 96' ' ' LYS . 5.9 tmtm? -58.27 -57.4 13.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 20.0 111.116 179.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -62.85 -24.3 67.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.447 . . . . 20.0 111.119 179.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.59 -36.04 82.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 20.0 111.141 179.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' VAL . . . . . 0.46 ' O ' HG23 ' B' ' 103' ' ' THR . 5.6 t -56.84 -51.52 66.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.147 -0.479 . . . . 20.0 111.114 179.819 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -58.41 -30.61 66.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 20.0 112.226 179.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' HIS . . . . . . . . . . . . . 49.7 m80 -81.77 -33.9 30.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 20.0 111.187 179.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ILE . . . . . . . . . . . . . 67.2 mt -66.85 -35.03 73.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 20.0 111.223 179.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' THR . . . . . 0.46 HG23 ' O ' ' B' ' 99' ' ' VAL . 26.7 p -77.59 -22.08 51.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 20.0 111.197 179.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ARG . . . . . 0.487 ' HB3' HD11 ' B' ' 106' ' ' ILE . 4.4 mpt_? -88.87 6.82 37.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 20.0 111.215 179.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 105' ' ' LYS . . . . . 1.084 ' HA ' ' HE3' ' B' ' 105' ' ' LYS . 7.7 mmmt 61.22 37.56 17.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.187 179.956 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 106' ' ' ILE . . . . . 0.487 HD11 ' HB3' ' B' ' 104' ' ' ARG . 5.9 mm -93.93 85.96 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 20.0 111.247 179.951 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 37.2 p -58.77 159.1 7.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 20.0 111.202 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -51.71 -47.48 63.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 20.0 111.195 179.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -55.94 -48.57 75.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.445 . . . . 20.0 111.165 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . 0.392 9.2 mt-10 -58.12 -40.9 82.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 20.0 111.278 -179.895 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 111' ' ' PHE . . . . . 0.461 ' CZ ' HG11 ' B' ' 142' ' ' VAL . 49.2 t80 -65.71 -30.25 70.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 20.0 111.209 -179.867 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 112' ' ' GLY . . . . . . . . . . . . . . . -69.1 -2.0 29.45 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 116.255 -0.43 . . . . 20.0 112.518 -179.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 75.2 mttt -75.65 -14.11 60.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.779 0.323 . . . . 20.0 111.202 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' ILE . . . . . 0.636 ' O ' HG13 ' B' ' 118' ' ' ILE . 8.4 tp -78.19 -6.33 9.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 20.0 111.197 -179.974 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 115' ' ' ASN . . . . . . . . . . . . . 40.2 m-20 -70.92 -38.06 72.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.222 0.453 . . . . 20.0 112.222 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . -60.72 -52.85 49.91 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 116.199 -0.455 . . . . 20.0 112.527 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' PRO . . . . . 0.457 ' HB2' HD23 ' B' ' 36' ' ' LEU . 74.0 Cg_exo -62.67 -49.78 5.09 Favored 'Trans proline' 0 C--N 1.329 -0.479 0 C-N-CA 121.686 1.59 . . . . 20.0 111.769 179.976 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 118' ' ' ILE . . . . . 0.636 HG13 ' O ' ' B' ' 114' ' ' ILE . 8.5 mt -49.74 -48.45 21.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 O-C-N 123.303 0.377 . . . . 20.0 111.206 179.953 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 57.0 tttt -57.66 -38.35 74.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 20.0 111.164 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' LYS . . . . . 0.408 ' HD2' HG21 ' B' ' 39' ' ' THR . 24.7 mttt -67.31 -51.31 54.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 20.0 111.123 179.844 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 27.6 t -57.5 -32.31 41.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 20.0 111.168 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' LEU . . . . . 0.74 HD11 ' CD1' ' B' ' 135' ' ' TRP . 24.7 mt -73.42 -44.22 58.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 20.0 111.115 179.839 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -62.38 -34.74 77.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 20.0 111.18 179.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 54.7 p -63.27 -21.91 66.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 20.0 111.154 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' LYS . . . . . 0.884 ' O ' ' HB2' ' B' ' 126' ' ' ASN . 5.0 mmtm -97.0 -9.38 28.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 20.0 111.154 179.919 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 126' ' ' ASN . . . . . 0.884 ' HB2' ' O ' ' B' ' 125' ' ' LYS . 71.0 m-20 95.74 31.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.207 0.447 . . . . 20.0 112.207 -179.979 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 127' ' ' PHE . . . . . 0.441 ' O ' ' O ' ' B' ' 128' ' ' GLY . 44.2 m-85 -106.42 96.65 6.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 20.0 111.191 179.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 128' ' ' GLY . . . . . 0.441 ' O ' ' O ' ' B' ' 127' ' ' PHE . . . -48.99 -174.65 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 116.189 -0.46 . . . . 20.0 112.505 179.989 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 129' ' ' ASP . . . . . 0.737 ' O ' ' N ' ' B' ' 132' ' ' ALA . 64.5 m-20 -57.58 -51.44 69.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.823 0.344 . . . . 20.0 111.22 -179.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 130' ' ' LYS . . . . . 0.516 ' C ' ' O ' ' B' ' 129' ' ' ASP . 1.9 tttt -27.73 -46.93 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 20.0 110.725 179.367 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 131' ' ' TYR . . . . . 0.411 ' N ' ' O ' ' B' ' 129' ' ' ASP . 96.6 m-85 -76.73 -36.11 57.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 20.0 110.715 179.055 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 132' ' ' ALA . . . . . 0.737 ' N ' ' O ' ' B' ' 129' ' ' ASP . . . -62.53 -42.16 99.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 20.0 110.696 179.152 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 133' ' ' ASN . . . . . . . . . . . . . 63.4 m-20 -65.96 -40.92 91.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.466 . . . . 20.0 111.753 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.79 -43.41 90.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 20.0 110.756 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 135' ' ' TRP . . . . . 0.74 ' CD1' HD11 ' B' ' 122' ' ' LEU . 40.9 m95 -63.27 -35.61 80.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 20.0 110.682 179.06 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.43 -40.73 87.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 20.0 110.688 179.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' LYS . . . . . 0.474 ' HD3' HG21 ' B' ' 14' ' ' VAL . 40.3 mttm -59.68 -45.33 92.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 20.0 110.685 179.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 53.2 tp -61.48 -40.46 94.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.153 -0.476 . . . . 20.0 110.613 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' VAL . . . . . . . . . . . . . 5.5 t -64.74 -36.88 78.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 20.0 110.69 179.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -55.65 -41.22 73.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 20.0 111.149 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' VAL . . . . . . . . . . . . . 94.1 t -51.77 -39.08 23.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 20.0 111.096 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 142' ' ' VAL . . . . . 0.461 HG11 ' CZ ' ' B' ' 111' ' ' PHE . 90.4 t -71.95 -38.72 65.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 20.0 111.153 179.895 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 143' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -64.74 -33.39 75.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.22 179.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.97 -21.28 66.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.18 179.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -97.26 1.54 49.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 20.0 111.202 179.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 58.8 mt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 20.0 111.185 179.997 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HEM . . . . . 0.77 ' C1C' ' C ' ' A' ' 501' ' ' CMO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 501' ' ' CMO . . . . . 0.77 ' C ' ' C1C' ' A' ' 147' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 147' ' ' HEM . . . . . 0.602 ' C1C' ' C ' ' B' ' 501' ' ' CMO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 501' ' ' CMO . . . . . 0.602 ' C ' ' C1C' ' B' ' 147' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.808 0.337 . . . . 20.0 111.188 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.465 HG13 ' CE2' ' A' ' 4' ' ' TYR 0.275 2.3 p -57.75 -47.11 86.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 20.0 111.2 179.97 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.619 ' CD2' ' N ' ' A' ' 4' ' ' TYR 0.575 0.1 OUTLIER -59.51 -33.99 72.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 20.0 111.17 179.941 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -71.95 -50.2 30.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.246 -0.433 . . . . 20.0 111.2 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.35 -47.9 82.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 20.0 111.179 179.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.56 -27.07 67.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 20.0 111.17 179.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.73 -6.95 45.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.185 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -88.9 -3.12 58.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.455 . . . . 20.0 111.213 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 32.9 mt -84.64 70.08 10.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 20.0 111.149 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.3 p -61.53 174.82 0.69 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 20.0 111.192 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.56 -42.11 95.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 20.0 111.173 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 -58.13 -52.17 66.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 20.0 111.191 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 41.4 t -61.96 -38.93 81.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 20.0 111.163 179.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 24.5 mtmt -60.6 -42.93 97.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.465 . . . . 20.0 111.162 179.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.6 tptp -65.97 -41.15 91.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 20.0 111.097 179.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -63.35 -40.19 96.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 20.0 111.146 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.0 mt -63.41 -41.41 98.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.153 179.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 31.0 mtt-85 -73.11 -43.08 62.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.458 . . . . 20.0 111.111 179.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -58.42 -39.69 80.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 20.0 111.266 -179.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 27.0 p -78.59 -44.63 23.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 20.0 111.228 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.563 ' O ' ' N ' ' A' ' 26' ' ' GLY . 51.8 t-105 -53.61 -41.53 66.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.265 -0.425 . . . . 20.0 111.23 -179.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -49.38 -36.06 20.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.25 -0.432 . . . . 20.0 111.261 -179.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 70.9 t -83.31 -60.06 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.46 . . . . 20.0 111.245 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . 0.367 15.1 pt -65.88 -18.94 24.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 20.0 111.245 -179.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 22' ' ' TRP . . . -78.27 -22.08 68.76 Favored Glycine 0 N--CA 1.451 -0.32 0 CA-C-N 116.205 -0.452 . . . . 20.0 112.513 -179.99 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 96.6 p -65.51 -31.83 73.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.774 0.321 . . . . 20.0 111.214 -179.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.724 ' O ' ' HB2' ' A' ' 32' ' ' ASN . 15.5 t0 -126.69 87.2 2.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 20.0 111.24 -179.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.641 ' O ' ' HG3' ' A' ' 74' ' ' MET . 0.2 OUTLIER -78.3 -34.11 48.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 20.0 111.24 179.977 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.614 ' HD3' HD11 ' A' ' 71' ' ' ILE . 17.7 ttpt -73.37 -52.64 13.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.035 179.701 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.536 ' HA3' ' OD2' ' A' ' 28' ' ' ASP . . . -65.98 -43.18 94.09 Favored Glycine 0 N--CA 1.451 -0.353 0 CA-C-N 116.218 -0.446 . . . . 20.0 112.212 179.626 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.724 ' HB2' ' O ' ' A' ' 28' ' ' ASP . 87.5 m-20 -76.8 -35.89 57.32 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.036 0.384 . . . . 20.0 112.036 179.711 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.76 -47.54 90.7 Favored Glycine 0 N--CA 1.451 -0.343 0 CA-C-N 116.147 -0.479 . . . . 20.0 112.305 179.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.6 t -64.81 -38.39 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.837 0.351 . . . . 20.0 110.98 179.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.11 -44.54 94.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 20.0 111.013 179.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . 1.125 HD23 ' CG2' ' A' ' 121' ' ' VAL 0.316 14.5 mt -61.68 -41.07 97.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 20.0 110.945 179.657 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 52.7 mmm -66.71 -46.19 76.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 20.0 111.041 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.4 p -60.32 -44.28 95.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 20.0 111.012 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 25.3 m -65.38 -34.03 77.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 20.0 110.975 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 13.8 tp -71.06 -33.16 69.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 20.0 111.284 -179.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -80.75 -21.04 41.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 20.0 111.263 -179.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -86.91 -36.08 18.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 20.0 111.251 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -87.27 -25.29 24.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.464 . . . . 20.0 111.205 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.445 ' HB3' HG23 ' A' ' 47' ' ' THR . 17.6 m120 -133.5 86.18 2.27 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.218 0.451 . . . . 20.0 112.218 -179.96 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.486 ' C ' ' H ' ' A' ' 47' ' ' THR . 6.3 mt-30 -70.37 -32.78 70.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 20.0 111.224 179.945 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.2 pm0 -66.78 13.14 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.207 179.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . 0.486 ' H ' ' C ' ' A' ' 45' ' ' GLN . 3.7 p -125.44 12.91 8.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 20.0 111.251 -179.99 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 95.4 mt -82.92 -34.2 11.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 20.0 111.242 179.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -68.42 -11.43 61.98 Favored Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 116.164 -0.471 . . . . 20.0 112.475 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.636 ' O ' ' CMD' ' A' ' 147' ' ' HEM . 6.3 m-85 -83.05 1.81 38.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.813 0.34 . . . . 20.0 111.168 179.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.477 ' HB3' ' HG ' ' A' ' 54' ' ' LEU . 21.7 m-85 -134.69 43.16 2.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.472 . . . . 20.0 111.152 179.995 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.5 ttmt -53.32 -45.47 69.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.241 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 57.1 ttp85 -57.5 -30.33 65.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 20.0 111.192 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.477 ' HG ' ' HB3' ' A' ' 51' ' ' PHE . 5.0 mt -65.27 -19.1 65.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.242 -0.435 . . . . 20.0 111.226 -179.967 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 75.97 -125.63 7.95 Favored Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 116.208 -0.451 . . . . 20.0 112.52 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -90.32 101.6 14.32 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.177 0.436 . . . . 20.0 112.177 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.454 ' C ' ' H ' ' A' ' 59' ' ' GLN . 4.4 m -75.64 -31.11 22.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 20.0 111.214 179.935 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 p -60.43 0.01 0.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 20.0 111.196 -179.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.454 ' H ' ' C ' ' A' ' 57' ' ' VAL . 5.4 mt-30 -83.01 -20.92 34.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 20.0 111.2 -179.958 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 71.71 -141.53 32.12 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 116.217 -0.447 . . . . 20.0 112.484 179.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' MET . . . . . 0.402 ' SD ' ' CD ' ' A' ' 67' ' ' ARG . 38.5 tpp -57.57 -30.46 65.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.795 0.331 . . . . 20.0 111.211 -179.974 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -51.89 -47.78 64.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 20.0 111.193 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 -59.24 117.24 4.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 20.0 112.211 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -65.24 -44.64 87.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 20.0 111.154 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 28.1 mttp -60.47 -39.77 88.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 20.0 111.176 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.2 tp -64.29 -50.87 66.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.235 -0.439 . . . . 20.0 111.143 179.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.431 ' HD2' ' HD2' ' A' ' 30' ' ' LYS . 19.9 ttp-105 -57.83 -45.26 86.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 20.0 111.125 179.864 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -54.74 -49.47 61.52 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 116.219 -0.446 . . . . 20.0 112.366 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -73.73 -24.19 59.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.783 0.325 . . . . 20.0 111.1 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 29.5 m -74.02 -46.39 43.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 20.0 110.674 179.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.614 HD11 ' HD3' ' A' ' 30' ' ' LYS . 20.3 mt -66.92 -41.13 87.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.5 . . . . 20.0 110.631 178.894 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 95.2 m -65.28 -41.84 93.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 20.0 110.644 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.593 ' C ' HD23 ' A' ' 73' ' ' LEU . 6.7 tt -61.26 -42.17 98.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 20.0 110.687 179.003 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' MET . . . . . 0.641 ' HG3' ' O ' ' A' ' 29' ' ' LYS . 13.7 mmm -58.16 -39.09 77.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 20.0 110.642 178.992 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.644 ' OH ' ' HB2' ' B' ' 82' ' ' ASP . 13.6 m-85 -64.36 -37.19 86.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.104 -0.498 . . . . 20.0 110.689 179.047 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -53.6 -41.89 67.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.13 -0.486 . . . . 20.0 110.633 179.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.96 -38.06 87.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.158 -0.474 . . . . 20.0 110.654 178.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 47.3 tp60 -60.0 -45.15 93.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.092 -0.504 . . . . 20.0 110.638 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.838 ' HA ' ' CZ ' ' B' ' 75' ' ' TYR . 41.5 t-20 -59.81 -38.5 82.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.157 -0.474 . . . . 20.0 111.579 178.874 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 17.5 m-30 -67.89 -30.52 69.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 20.0 111.225 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 mm -78.16 -30.6 15.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 20.0 111.203 -179.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.777 ' HB2' ' OH ' ' B' ' 75' ' ' TYR . 87.1 m-20 -79.41 -1.74 38.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 20.0 111.204 -179.93 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.796 ' HG2' ' O ' ' A' ' 79' ' ' ASN . 31.1 mm-40 -114.29 -0.23 13.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 20.0 111.189 -179.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 73.4 mt -58.86 -24.91 62.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 20.0 111.188 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -70.83 -43.9 67.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 20.0 111.227 -179.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -110.8 110.63 57.11 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 20.0 112.196 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -59.21 -44.62 32.58 Favored 'Trans proline' 0 C--N 1.329 -0.479 0 C-N-CA 121.725 1.617 . . . . 20.0 111.794 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -54.83 -46.52 74.61 Favored 'General case' 0 C--N 1.33 -0.271 0 O-C-N 123.264 0.353 . . . . 20.0 111.166 179.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -69.19 -35.62 76.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 20.0 111.185 179.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.6 tp -60.42 -44.12 96.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 20.0 111.176 179.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 76.5 t -65.05 -48.05 85.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 20.0 111.146 179.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.53 -33.39 59.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 20.0 111.178 179.847 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . 0.673 14.1 m -76.51 -45.64 33.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 20.0 111.119 179.891 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.5 t -61.42 -49.68 83.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.123 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -54.47 -41.67 69.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 20.0 111.121 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.648 ' C ' ' HD3' ' A' ' 96' ' ' LYS . 7.3 tmtm? -60.47 -46.83 88.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 20.0 111.143 179.828 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -70.99 -32.46 69.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 20.0 111.119 179.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.01 -36.48 81.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 20.0 111.128 179.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.1 t -59.15 -31.13 45.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 20.0 111.139 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.553 ' O ' ' HD3' ' A' ' 104' ' ' ARG . 12.4 m120 -73.19 -31.58 64.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 20.0 112.157 179.755 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.606 ' NE2' ' HE1' ' A' ' 111' ' ' PHE . 17.7 m80 -82.4 -30.99 29.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 20.0 111.157 179.847 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 24.5 mt -67.13 -38.77 81.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 20.0 111.139 179.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 76.2 p -78.45 -10.37 59.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.453 . . . . 20.0 111.195 179.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.753 ' O ' ' HB2' ' A' ' 105' ' ' LYS . 4.3 mpt_? -95.17 -9.04 34.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 20.0 111.178 179.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.753 ' HB2' ' O ' ' A' ' 104' ' ' ARG . 2.6 mmmt 83.61 27.26 0.1 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 20.0 111.199 179.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.9 mm -98.9 104.59 16.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.233 179.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 42.5 p -84.33 165.93 17.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 20.0 111.261 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -44.42 -44.67 8.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 20.0 111.242 179.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -54.16 -61.42 2.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 20.0 111.204 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.711 ' O ' ' HB2' ' A' ' 113' ' ' LYS . 6.0 mm-40 -47.66 -62.53 1.4 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 20.0 111.234 -179.926 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.606 ' HE1' ' NE2' ' A' ' 101' ' ' HIS . 12.0 t80 -44.19 -51.85 7.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.172 -0.467 . . . . 20.0 111.276 -179.942 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -51.82 -4.49 0.11 Allowed Glycine 0 N--CA 1.451 -0.33 0 CA-C-N 116.182 -0.463 . . . . 20.0 112.529 -179.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.711 ' HB2' ' O ' ' A' ' 110' ' ' GLU . 72.3 mttt -79.55 6.56 10.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.778 0.323 . . . . 20.0 111.223 179.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 7.6 tp -97.11 -13.06 8.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 20.0 111.212 -179.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -63.06 -36.3 83.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 20.0 112.196 -179.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -62.67 -59.75 8.79 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 116.204 -0.453 . . . . 20.0 112.539 179.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -53.62 -53.09 7.12 Favored 'Trans proline' 0 C--N 1.33 -0.424 0 C-N-CA 121.699 1.599 . . . . 20.0 111.799 -179.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 71.7 mt -49.97 -47.94 23.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 O-C-N 123.256 0.348 . . . . 20.0 111.166 -179.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.41 -38.42 74.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 20.0 111.176 -179.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -70.77 -46.05 63.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 20.0 111.13 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' VAL . . . . . 1.125 ' CG2' HD23 ' A' ' 36' ' ' LEU . 54.5 t -61.53 -36.08 70.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 20.0 111.163 179.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.591 HD11 ' CD1' ' A' ' 135' ' ' TRP . 18.6 mt -67.8 -43.04 80.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 20.0 111.167 179.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.94 -41.22 91.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 20.0 111.145 179.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' SER . . . . . 0.507 ' OG ' ' HD3' ' A' ' 125' ' ' LYS . 1.5 p -58.62 -22.36 56.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.153 -0.476 . . . . 20.0 111.129 -179.992 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.551 ' O ' ' CB ' ' A' ' 126' ' ' ASN . 1.5 mmmt -97.61 -3.17 40.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.181 179.924 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ASN . . . . . 0.551 ' CB ' ' O ' ' A' ' 125' ' ' LYS . 3.8 t-20 89.52 42.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.252 0.464 . . . . 20.0 112.252 179.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.836 ' HD2' ' CD2' ' A' ' 131' ' ' TYR . 58.7 m-85 -124.39 99.16 6.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.45 . . . . 20.0 111.208 -179.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.77 -167.49 0.12 Allowed Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 116.204 -0.453 . . . . 20.0 112.515 179.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.878 ' O ' ' N ' ' A' ' 132' ' ' ALA . 3.7 m-20 -53.05 -62.25 1.77 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.816 0.341 . . . . 20.0 111.249 179.96 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.613 ' C ' ' O ' ' A' ' 129' ' ' ASP . 31.2 tttt -17.04 -56.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 20.0 110.87 179.639 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' TYR . . . . . 0.836 ' CD2' ' HD2' ' A' ' 127' ' ' PHE . 79.5 m-85 -71.73 -37.21 70.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.475 . . . . 20.0 110.854 179.242 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.878 ' N ' ' O ' ' A' ' 129' ' ' ASP . . . -63.18 -38.18 90.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.101 -0.499 . . . . 20.0 110.76 179.268 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . 0.27 18.8 m120 -71.65 -42.39 67.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 20.0 111.765 179.277 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -55.83 -44.09 77.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 20.0 110.822 179.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' TRP . . . . . 0.591 ' CD1' HD11 ' A' ' 122' ' ' LEU . 69.2 m95 -64.39 -33.22 75.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 20.0 110.785 179.197 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.26 -40.97 83.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 20.0 110.835 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -60.0 -47.01 87.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.479 . . . . 20.0 110.773 179.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.8 tp -61.19 -44.63 96.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 20.0 110.724 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.86 -31.14 52.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 20.0 110.795 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.67 -40.08 90.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 20.0 111.155 179.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 34.5 t -51.62 -44.98 35.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 20.0 111.172 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 59.8 t -71.77 -32.59 45.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 20.0 111.138 179.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -65.53 -26.94 68.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 20.0 111.163 179.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -82.64 -15.43 52.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 20.0 111.16 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -94.63 2.26 55.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.209 -0.45 . . . . 20.0 111.213 179.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 67.0 mt . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 20.0 111.255 179.949 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.801 0.334 . . . . 20.0 111.211 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 38.6 t -47.43 -48.63 9.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 20.0 111.226 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -53.1 -45.2 68.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 20.0 111.185 -180.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -57.11 -45.71 83.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.184 -0.462 . . . . 20.0 111.213 179.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.55 -45.07 84.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 20.0 111.205 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.6 -52.67 64.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.458 . . . . 20.0 111.169 179.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.02 -13.99 14.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 20.0 111.185 179.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' GLN . . . . . 0.958 ' HG3' ' H ' ' B' ' 10' ' ' LEU . 0.0 OUTLIER -63.27 -65.96 0.61 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.156 -0.475 . . . . 20.0 111.193 179.946 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.958 ' H ' ' HG3' ' B' ' 9' ' ' GLN . 10.8 mt -26.64 118.05 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 20.0 111.118 179.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' THR . . . . . 0.563 ' O ' ' HG3' ' B' ' 15' ' ' LYS . 43.5 p -94.11 173.13 7.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.462 . . . . 20.0 111.218 -179.979 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.06 -43.65 66.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 20.0 111.148 179.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ASP . . . . . . . . . . . . 0.472 15.5 m-20 -60.96 -51.41 69.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 20.0 111.138 179.886 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.474 HG21 ' HD3' ' B' ' 137' ' ' LYS . 24.6 t -60.98 -46.05 97.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 20.0 111.157 179.935 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LYS . . . . . 0.59 ' HE3' ' O ' ' B' ' 10' ' ' LEU 0.26 98.0 mttt -60.26 -36.95 78.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.179 179.884 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 11.1 tptt -67.64 -46.23 73.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 20.0 111.104 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ASP . . . . . 0.445 ' OD1' ' NZ ' ' B' ' 130' ' ' LYS . 76.3 m-20 -64.44 -33.58 76.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 20.0 111.119 179.919 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 19.1 mt -65.95 -47.29 75.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 20.0 111.126 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ARG . . . . . . . . . . . . . 55.2 mtt180 -71.06 -33.2 70.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 20.0 111.118 179.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -63.73 -47.28 81.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 20.0 111.254 -179.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 4.3 p -70.07 -49.48 50.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.25 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' TRP . . . . . . . . . . . . . 57.1 t-105 -50.14 -39.32 42.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 20.0 111.252 -179.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 mttt -49.29 -23.6 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.463 . . . . 20.0 111.264 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.424 ' O ' ' OG ' ' B' ' 27' ' ' SER . 47.8 t -100.37 -68.65 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 20.0 111.208 -179.951 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ILE . . . . . 0.602 ' HA ' ' ND2' ' B' ' 32' ' ' ASN 0.28 3.9 pt -56.07 -22.77 14.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 20.0 111.218 -179.953 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.28 -13.99 77.59 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 116.218 -0.446 . . . . 20.0 112.527 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' B' ' 24' ' ' VAL . 81.2 p -72.63 -24.69 61.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.781 0.324 . . . . 20.0 111.19 -179.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ASP . . . . . 0.794 ' O ' ' HB2' ' B' ' 32' ' ' ASN . 19.6 t0 -132.58 75.43 1.63 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 20.0 111.155 -179.951 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LYS . . . . . 1.022 ' HB3' ' HB3' ' B' ' 74' ' ' MET . 9.5 mttp -66.08 -33.82 76.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 20.0 111.183 179.962 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 10.0 ttpt -69.82 -53.75 16.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.457 . . . . 20.0 110.954 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . -70.63 -39.52 67.31 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 116.156 -0.475 . . . . 20.0 112.135 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ASN . . . . . 0.794 ' HB2' ' O ' ' B' ' 28' ' ' ASP . 48.0 m-20 -78.51 -40.51 34.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.861 0.363 . . . . 20.0 111.963 179.419 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' GLY . . . . . 0.453 ' HA3' ' HG2' ' B' ' 74' ' ' MET . . . -61.15 -42.89 99.93 Favored Glycine 0 N--CA 1.451 -0.362 0 CA-C-N 116.193 -0.458 . . . . 20.0 112.155 179.545 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.603 HG21 ' CE ' ' B' ' 61' ' ' MET . 41.4 t -64.99 -38.82 83.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.809 0.337 . . . . 20.0 110.882 179.514 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.53 -43.59 98.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 20.0 110.979 179.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.457 HD23 ' HB2' ' B' ' 117' ' ' PRO 0.285 0.4 OUTLIER -62.46 -41.82 99.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 20.0 110.848 179.456 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' MET . . . . . . . . . . . . . 86.9 mmm -67.56 -41.76 83.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 20.0 110.913 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 24.3 p -66.09 -42.1 89.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 20.0 110.96 179.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' THR . . . . . 0.408 HG21 ' HD2' ' B' ' 120' ' ' LYS . 31.7 m -63.21 -41.37 99.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 20.0 110.894 179.491 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 22.1 tp -66.45 -26.31 67.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 20.0 111.26 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.409 ' CE2' ' HB ' ' B' ' 57' ' ' VAL . 12.7 m-85 -82.34 -26.5 32.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 20.0 111.256 -179.919 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -83.84 -36.87 23.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 20.0 111.242 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -88.12 -35.12 17.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 20.0 111.22 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ASN . . . . . . . . . . . . . 25.5 m120 -121.59 78.24 1.42 Allowed 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.212 0.449 . . . . 20.0 112.212 179.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 7.7 mp0 -73.01 -5.96 42.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.169 -0.469 . . . . 20.0 111.22 179.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 -85.58 6.42 27.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 20.0 111.234 179.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 16.4 p -118.78 4.4 11.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 20.0 111.194 -179.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 57.2 mt -68.22 -37.82 78.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 20.0 111.165 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -66.63 -23.4 72.2 Favored Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 116.225 -0.443 . . . . 20.0 112.458 -179.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.495 ' O ' ' CMD' ' B' ' 147' ' ' HEM . 15.6 m-85 -73.99 -6.25 46.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.807 0.337 . . . . 20.0 111.061 179.631 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -124.37 27.99 6.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 20.0 111.159 179.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.1 -11.31 0.25 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.434 . . . . 20.0 111.293 -179.874 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ARG . . . . . 0.491 ' HE ' ' CGD' ' B' ' 147' ' ' HEM . 27.7 ttp85 -79.3 -37.58 37.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.169 -0.468 . . . . 20.0 111.211 179.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.831 HD13 ' HA ' ' B' ' 66' ' ' LEU . 10.0 mt -72.41 5.25 3.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.446 . . . . 20.0 111.249 -179.996 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 67.15 -129.88 29.4 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 116.173 -0.467 . . . . 20.0 112.528 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ASN . . . . . 0.488 ' ND2' ' OG ' ' B' ' 58' ' ' SER . 64.0 t30 -87.83 93.75 9.55 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.204 0.446 . . . . 20.0 112.204 179.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.409 ' HB ' ' CE2' ' B' ' 41' ' ' PHE . 30.8 m -64.55 -3.8 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.177 179.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' SER . . . . . 0.488 ' OG ' ' ND2' ' B' ' 56' ' ' ASN . 1.4 p -75.43 -12.02 60.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.456 . . . . 20.0 111.227 179.981 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' GLN . . . . . . . . . . . . 0.347 0.3 OUTLIER -74.69 -40.28 61.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 20.0 111.259 179.959 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' GLY . . . . . 0.499 ' O ' HD23 ' B' ' 66' ' ' LEU . . . 86.5 -124.76 7.08 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 116.172 -0.467 . . . . 20.0 112.488 179.942 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' MET . . . . . 0.603 ' CE ' HG21 ' B' ' 34' ' ' VAL . 3.6 tpp -70.01 -19.43 63.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.784 0.326 . . . . 20.0 111.193 -179.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.13 -19.68 60.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 20.0 111.221 -179.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' ASN . . . . . 0.525 ' HB3' ' HB3' ' B' ' 66' ' ' LEU . 40.4 t-20 -81.68 110.9 17.46 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.241 0.46 . . . . 20.0 112.241 179.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.585 25.3 p-10 -52.99 -53.93 42.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 20.0 111.178 179.923 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' LYS . . . . . 0.755 ' C ' HD22 ' B' ' 54' ' ' LEU . 16.2 mttp -58.46 -45.27 88.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 20.0 111.13 179.899 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.831 ' HA ' HD13 ' B' ' 54' ' ' LEU . 14.8 tp -56.29 -48.3 76.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 20.0 111.111 179.893 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' ARG . . . . . . . . . . . . . 14.0 ttp-105 -59.25 -44.29 92.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 20.0 111.085 179.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -55.11 -44.98 83.68 Favored Glycine 0 N--CA 1.451 -0.346 0 CA-C-N 116.2 -0.454 . . . . 20.0 112.297 179.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -69.1 -45.83 69.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.782 0.325 . . . . 20.0 111.074 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' SER . . . . . . . . . . . . . 50.0 m -57.3 -51.78 68.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 20.0 110.844 179.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 59.0 mt -62.49 -43.96 98.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 20.0 110.704 179.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 23.4 m -65.46 -41.78 93.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 20.0 110.768 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.466 HD23 ' C ' ' B' ' 73' ' ' LEU . 9.7 tt -62.78 -43.83 97.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 20.0 110.8 179.206 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' MET . . . . . 1.022 ' HB3' ' HB3' ' B' ' 29' ' ' LYS . 1.5 mmm -56.32 -39.37 72.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.484 . . . . 20.0 110.733 179.156 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.838 ' CZ ' ' HA ' ' A' ' 79' ' ' ASN . 13.7 m-85 -66.44 -37.98 86.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 20.0 110.748 179.186 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -51.63 -41.26 61.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 20.0 110.684 179.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 30.0 mt -66.93 -35.1 79.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.087 -0.506 . . . . 20.0 110.732 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -56.84 -45.5 82.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.112 -0.494 . . . . 20.0 110.777 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ASN . . . . . 0.804 ' O ' ' HG2' ' B' ' 83' ' ' GLN . 13.1 t-20 -57.26 -40.0 76.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 20.0 111.684 179.022 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -72.08 -29.68 64.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 20.0 111.189 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ILE . . . . . 0.533 HG22 ' O ' ' B' ' 81' ' ' ILE . 32.7 mm -81.8 -8.91 11.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.447 . . . . 20.0 111.178 -179.939 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ASP . . . . . 0.644 ' HB2' ' OH ' ' A' ' 75' ' ' TYR . 77.3 m-20 -100.51 -12.91 18.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 20.0 111.173 -179.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLN . . . . . 0.804 ' HG2' ' O ' ' B' ' 79' ' ' ASN . 5.7 mm-40 -117.6 36.96 4.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 20.0 111.214 179.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 27.4 mt -86.83 -26.7 23.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 20.0 111.205 -179.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -90.53 0.41 57.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 20.0 111.195 -179.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -138.24 88.97 14.6 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 20.0 112.193 179.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' PRO . . . . . 0.404 ' O ' HG23 ' B' ' 91' ' ' VAL . 73.3 Cg_exo -49.7 -44.66 35.01 Favored 'Trans proline' 0 C--N 1.329 -0.453 0 C-N-CA 121.696 1.597 . . . . 20.0 111.829 179.914 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -52.44 -47.71 66.22 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 123.334 0.396 . . . . 20.0 111.194 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -71.19 -44.78 64.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 20.0 111.13 179.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.646 ' HB2' ' O ' ' B' ' 83' ' ' GLN . 14.5 tp -53.6 -47.32 70.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.216 -0.447 . . . . 20.0 111.196 179.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' VAL . . . . . 0.404 HG23 ' O ' ' B' ' 87' ' ' PRO . 78.7 t -58.38 -50.56 78.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 20.0 111.187 179.909 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -56.12 -40.61 74.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 20.0 111.196 179.868 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.842 2.2 m -69.27 -42.81 81.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 20.0 111.178 179.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.41 -48.62 84.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.159 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -54.87 -41.72 71.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.198 -0.455 . . . . 20.0 111.125 179.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' LYS . . . . . 0.617 ' C ' ' HD3' ' B' ' 96' ' ' LYS . 5.9 tmtm? -58.27 -57.4 13.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 20.0 111.116 179.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -62.85 -24.3 67.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.447 . . . . 20.0 111.119 179.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.59 -36.04 82.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 20.0 111.141 179.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' VAL . . . . . 0.46 ' O ' HG23 ' B' ' 103' ' ' THR . 5.6 t -56.84 -51.52 66.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.147 -0.479 . . . . 20.0 111.114 179.819 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -58.41 -30.61 66.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 20.0 112.226 179.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' HIS . . . . . . . . . . . . . 49.7 m80 -81.77 -33.9 30.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 20.0 111.187 179.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ILE . . . . . . . . . . . . . 67.2 mt -66.85 -35.03 73.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 20.0 111.223 179.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' THR . . . . . 0.46 HG23 ' O ' ' B' ' 99' ' ' VAL . 26.7 p -77.59 -22.08 51.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 20.0 111.197 179.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.487 ' HB3' HD11 ' B' ' 106' ' ' ILE . 4.4 mpt_? -88.87 6.82 37.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 20.0 111.215 179.924 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' LYS . . . . . 1.084 ' HA ' ' HE3' ' B' ' 105' ' ' LYS . 7.7 mmmt 61.22 37.56 17.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.187 179.956 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' ILE . . . . . 0.487 HD11 ' HB3' ' B' ' 104' ' ' ARG . 5.9 mm -93.93 85.96 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 20.0 111.247 179.951 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 37.2 p -58.77 159.1 7.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 20.0 111.202 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ALA . . . . . . . . . . . . . . . -51.71 -47.48 63.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 20.0 111.195 179.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -55.94 -48.57 75.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.445 . . . . 20.0 111.165 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . 0.392 9.2 mt-10 -58.12 -40.9 82.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 20.0 111.278 -179.895 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' PHE . . . . . 0.461 ' CZ ' HG11 ' B' ' 142' ' ' VAL . 49.2 t80 -65.71 -30.25 70.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 20.0 111.209 -179.867 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' GLY . . . . . . . . . . . . . . . -69.1 -2.0 29.45 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 116.255 -0.43 . . . . 20.0 112.518 -179.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 75.2 mttt -75.65 -14.11 60.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.779 0.323 . . . . 20.0 111.202 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' ILE . . . . . 0.636 ' O ' HG13 ' B' ' 118' ' ' ILE . 8.4 tp -78.19 -6.33 9.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 20.0 111.197 -179.974 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' ASN . . . . . . . . . . . . . 40.2 m-20 -70.92 -38.06 72.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.222 0.453 . . . . 20.0 112.222 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . -60.72 -52.85 49.91 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 116.199 -0.455 . . . . 20.0 112.527 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' PRO . . . . . 0.457 ' HB2' HD23 ' B' ' 36' ' ' LEU . 74.0 Cg_exo -62.67 -49.78 5.09 Favored 'Trans proline' 0 C--N 1.329 -0.479 0 C-N-CA 121.686 1.59 . . . . 20.0 111.769 179.976 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' ILE . . . . . 0.636 HG13 ' O ' ' B' ' 114' ' ' ILE . 8.5 mt -49.74 -48.45 21.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 O-C-N 123.303 0.377 . . . . 20.0 111.206 179.953 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 57.0 tttt -57.66 -38.35 74.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 20.0 111.164 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' LYS . . . . . 0.408 ' HD2' HG21 ' B' ' 39' ' ' THR . 24.7 mttt -67.31 -51.31 54.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 20.0 111.123 179.844 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 27.6 t -57.5 -32.31 41.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 20.0 111.168 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.74 HD11 ' CD1' ' B' ' 135' ' ' TRP . 24.7 mt -73.42 -44.22 58.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 20.0 111.115 179.839 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -62.38 -34.74 77.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 20.0 111.18 179.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 54.7 p -63.27 -21.91 66.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 20.0 111.154 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.884 ' O ' ' HB2' ' B' ' 126' ' ' ASN . 5.0 mmtm -97.0 -9.38 28.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 20.0 111.154 179.919 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' ASN . . . . . 0.884 ' HB2' ' O ' ' B' ' 125' ' ' LYS . 9.3 m120 95.74 31.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.207 0.447 . . . . 20.0 112.207 -179.979 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' PHE . . . . . 0.441 ' O ' ' O ' ' B' ' 128' ' ' GLY . 44.2 m-85 -106.42 96.65 6.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 20.0 111.191 179.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' GLY . . . . . 0.441 ' O ' ' O ' ' B' ' 127' ' ' PHE . . . -48.99 -174.65 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 116.189 -0.46 . . . . 20.0 112.505 179.989 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' ASP . . . . . 0.737 ' O ' ' N ' ' B' ' 132' ' ' ALA . 64.5 m-20 -57.58 -51.44 69.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.823 0.344 . . . . 20.0 111.22 -179.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' LYS . . . . . 0.516 ' C ' ' O ' ' B' ' 129' ' ' ASP . 1.9 tttt -27.73 -46.93 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 20.0 110.725 179.367 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' TYR . . . . . 0.411 ' N ' ' O ' ' B' ' 129' ' ' ASP . 96.6 m-85 -76.73 -36.11 57.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 20.0 110.715 179.055 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' ALA . . . . . 0.737 ' N ' ' O ' ' B' ' 129' ' ' ASP . . . -62.53 -42.16 99.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 20.0 110.696 179.152 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -65.96 -40.92 91.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.466 . . . . 20.0 111.753 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.79 -43.41 90.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 20.0 110.756 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' TRP . . . . . 0.74 ' CD1' HD11 ' B' ' 122' ' ' LEU . 40.9 m95 -63.27 -35.61 80.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 20.0 110.682 179.06 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.43 -40.73 87.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 20.0 110.688 179.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' LYS . . . . . 0.474 ' HD3' HG21 ' B' ' 14' ' ' VAL . 40.3 mttm -59.68 -45.33 92.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 20.0 110.685 179.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 53.2 tp -61.48 -40.46 94.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.153 -0.476 . . . . 20.0 110.613 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' VAL . . . . . . . . . . . . . 5.5 t -64.74 -36.88 78.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 20.0 110.69 179.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -55.65 -41.22 73.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 20.0 111.149 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' VAL . . . . . . . . . . . . . 94.1 t -51.77 -39.08 23.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 20.0 111.096 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.461 HG11 ' CZ ' ' B' ' 111' ' ' PHE . 90.4 t -71.95 -38.72 65.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 20.0 111.153 179.895 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -64.74 -33.39 75.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.22 179.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.97 -21.28 66.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.182 -0.463 . . . . 20.0 111.18 179.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -97.26 1.54 49.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 20.0 111.202 179.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 58.8 mt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 20.0 111.185 179.997 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HEM . . . . . 0.77 ' C1C' ' C ' ' A' ' 501' ' ' CMO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' CMO . . . . . 0.77 ' C ' ' C1C' ' A' ' 147' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' HEM . . . . . 0.602 ' C1C' ' C ' ' B' ' 501' ' ' CMO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 501' ' ' CMO . . . . . 0.602 ' C ' ' C1C' ' B' ' 147' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_