data_8lyz_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 8lyz _Structure_validation_residue.Date_analyzed 2016-10-13 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 ' 1' ' ' LYS . . . . . . . . . . . . . 52.6 tttt . . . . . 0 C--O 1.256 1.408 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.7 t -112.82 107.13 22.2 Favored 'Isoleucine or valine' 0 C--O 1.253 1.265 0 N-CA-C 105.387 -2.079 . . . . 0.0 105.387 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -72.04 155.54 40.19 Favored 'General case' 0 C--O 1.258 1.525 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.1 147.15 18.45 Favored Glycine 0 CA--C 1.532 1.122 1 N-CA-C 102.426 -4.27 . . . . 0.0 102.426 175.918 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ARG . . . . . 1.228 ' NH1' ' O ' ' A' ' 125' ' ' ARG . 44.4 ttp85 -34.15 -68.64 0.11 Allowed 'General case' 0 C--O 1.256 1.399 0 CA-C-N 113.428 -1.386 . . . . 0.0 111.901 171.329 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.38 65.8 m -52.1 -56.58 13.56 Favored 'General case' 0 C--O 1.254 1.326 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 178.517 -72.75 -47.293 -81.768 106.012 2.15 111.089 -57.023 -40.311 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 78.0 tt0 -52.26 -36.14 51.89 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 119.45 3.13 . . . . 0.0 119.45 -179.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 67.1 tp -73.85 -39.3 64.08 Favored 'General case' 0 C--O 1.255 1.366 0 O-C-N 125.149 1.53 . . . . 0.0 110.131 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.26 -58.21 9.21 Favored 'General case' 0 C--O 1.249 1.04 0 N-CA-C 104.539 -2.393 . . . . 0.0 104.539 179.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -50.54 -36.61 35.2 Favored 'General case' 0 C--O 1.252 1.194 0 O-C-N 124.938 1.399 . . . . 0.0 113.598 -178.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -82.75 -38.29 23.45 Favored 'General case' 0 C--O 1.249 1.048 0 CA-C-N 114.0 -1.455 . . . . 0.0 111.525 -170.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' MET . . . . . 0.633 ' CE ' ' CD1' ' A' ' 17' ' ' LEU . 75.2 mtp -67.22 -34.88 78.4 Favored 'General case' 0 C--O 1.249 1.04 0 O-C-N 124.899 1.374 . . . . 0.0 107.71 177.592 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -65.78 -50.57 64.24 Favored 'General case' 0 C--O 1.247 0.945 0 CA-C-N 114.037 -1.438 . . . . 0.0 110.71 177.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.32 -39.2 66.81 Favored 'General case' 0 C--O 1.247 0.958 0 O-C-N 125.277 1.611 . . . . 0.0 107.343 179.81 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -84.05 25.69 0.8 Allowed 'General case' 0 C--O 1.255 1.36 1 N-CA-C 125.569 5.396 . . . . 0.0 125.569 177.055 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.45 4.31 69.12 Favored Glycine 0 N--CA 1.471 0.988 1 N-CA-C 126.079 5.192 . . . . 0.0 126.079 177.943 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . 0.633 ' CD1' ' CE ' ' A' ' 12' ' ' MET . 16.0 mt -82.11 -13.82 56.69 Favored 'General case' 0 C--O 1.252 1.234 1 N-CA-C 128.033 6.308 . . . . 0.0 128.033 -177.926 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -68.83 121.5 16.68 Favored 'General case' 0 C--O 1.247 0.962 1 N-CA-C 98.71 -4.552 . . . . 0.0 98.71 177.299 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 30.8 m120 58.41 22.99 10.11 Favored 'General case' 0 C--O 1.246 0.892 1 N-CA-C 122.543 4.275 . . . . 0.0 122.543 -179.071 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -69.72 130.52 42.58 Favored 'General case' 0 C--O 1.25 1.082 1 N-CA-C 99.412 -4.292 . . . . 0.0 99.412 -179.446 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.0 mmt85 52.15 18.83 0.92 Allowed 'General case' 0 C--O 1.25 1.107 0 CA-C-N 113.772 -1.558 . . . . 0.0 112.189 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.47 14.51 61.64 Favored Glycine 0 CA--C 1.536 1.383 0 N-CA-C 121.548 3.379 . . . . 0.0 121.548 176.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -101.14 119.48 38.81 Favored 'General case' 0 C--O 1.25 1.114 0 CA-C-N 113.977 -1.112 . . . . 0.0 109.422 178.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -51.84 150.47 4.09 Favored 'General case' 0 C--O 1.251 1.139 0 O-C-N 125.045 1.466 . . . . 0.0 110.528 173.849 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -48.68 -41.39 31.41 Favored 'General case' 0 C--O 1.252 1.215 0 O-C-N 125.291 1.62 . . . . 0.0 111.303 175.558 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.81 -33.19 82.07 Favored Glycine 0 C--O 1.25 1.11 0 CA-C-N 114.429 -1.26 . . . . 0.0 114.364 -179.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -61.86 -36.63 81.79 Favored 'General case' 0 C--O 1.245 0.829 0 N-CA-C 106.599 -1.63 . . . . 0.0 106.599 -179.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TRP . . . . . 0.452 ' CB ' ' CE ' ' A' ' 12' ' ' MET . 92.2 m95 -76.52 -34.74 58.56 Favored 'General case' 0 C--O 1.254 1.311 1 N-CA-C 122.178 4.14 . . . . 0.0 122.178 177.89 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 52.0 t -74.13 -39.36 50.12 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 179.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 53.8 t -60.24 -53.36 58.56 Favored 'General case' 0 C--O 1.247 0.937 0 CA-C-N 113.884 -1.507 . . . . 0.0 111.879 -178.991 -179.603 -86.913 -100.054 105.807 1.992 106.53 -72.44 -67.399 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -58.88 -42.44 89.48 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 125.46 1.725 . . . . 0.0 110.554 -177.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.13 -34.1 75.73 Favored 'General case' 0 C--O 1.259 1.592 0 O-C-N 125.693 1.871 . . . . 0.0 115.367 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.5 tptt -63.45 -59.98 3.96 Favored 'General case' 0 C--O 1.245 0.837 0 CA-C-N 114.464 -1.243 . . . . 0.0 109.206 177.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -71.18 -8.93 56.88 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 119.522 3.156 . . . . 0.0 119.522 177.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . 0.551 ' OE1' ' C ' ' A' ' 56' ' ' LEU . 2.2 tt0 -96.01 -46.91 6.32 Favored 'General case' 0 C--O 1.25 1.126 0 O-C-N 125.314 1.634 . . . . 0.0 112.189 178.277 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 83.2 p -132.2 2.6 3.93 Favored 'General case' 0 C--O 1.252 1.227 1 N-CA-C 125.384 5.327 . . . . 0.0 125.384 178.504 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 52.55 41.1 30.95 Favored 'General case' 0 C--O 1.253 1.273 0 CA-C-N 113.892 -1.504 . . . . 0.0 114.416 -173.156 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 69.08 8.62 6.95 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 114.069 -1.423 . . . . 0.0 111.252 174.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASN . . . . . 0.401 ' C ' ' ND2' ' A' ' 39' ' ' ASN . 0.9 OUTLIER -97.35 106.26 18.55 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-N 113.904 -1.498 . . . . 0.0 113.598 179.942 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.5 p -64.07 -19.2 65.06 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 119.239 3.051 . . . . 0.0 119.239 178.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -88.74 -6.12 57.63 Favored 'General case' 0 C--O 1.256 1.397 0 N-CA-C 116.386 1.995 . . . . 0.0 116.386 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.69 138.33 41.95 Favored 'General case' 0 C--O 1.246 0.89 0 N-CA-C 116.689 2.107 . . . . 0.0 116.689 172.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 77.5 p -142.79 154.12 43.9 Favored 'General case' 0 C--O 1.245 0.867 0 N-CA-C 105.816 -1.92 . . . . 0.0 105.816 175.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -156.74 127.44 6.69 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 113.916 -1.493 . . . . 0.0 113.334 176.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . 1.4 ' NH2' ' NH2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -88.09 134.76 33.68 Favored 'General case' 0 C--O 1.246 0.89 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.939 -179.292 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -100.96 172.05 7.26 Favored 'General case' 0 C--O 1.248 0.981 1 N-CA-C 94.152 -6.24 . . . . 0.0 94.152 -176.531 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.9 p -69.77 -18.96 63.53 Favored 'General case' 0 C--O 1.247 0.928 0 N-CA-C 121.486 3.884 . . . . 0.0 121.486 177.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -94.64 7.41 45.84 Favored 'General case' 0 C--O 1.245 0.844 0 CA-C-N 114.045 -1.434 . . . . 0.0 110.265 -169.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.9 -23.54 34.36 Favored Glycine 0 C--O 1.252 1.265 0 CA-C-N 113.633 -1.621 . . . . 0.0 109.978 171.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.66 160.25 17.33 Favored 'General case' 0 C--O 1.249 1.055 0 C-N-CA 123.821 0.848 . . . . 0.0 109.794 177.138 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 16.7 m -138.19 149.73 46.1 Favored 'General case' 0 C--O 1.248 1.013 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 -179.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -106.9 137.69 44.49 Favored 'General case' 0 C--O 1.254 1.332 0 CA-C-N 113.975 -1.466 . . . . 0.0 107.112 -177.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -131.67 136.35 47.61 Favored 'General case' 0 C--O 1.246 0.878 1 N-CA-C 125.519 5.378 . . . . 0.0 125.519 -177.715 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 81.66 -169.89 51.22 Favored Glycine 0 C--O 1.245 0.827 0 N-CA-C 122.48 3.752 . . . . 0.0 122.48 -177.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . 0.737 ' CG2' ' N ' ' A' ' 56' ' ' LEU . 2.7 tp -51.82 -38.23 22.22 Favored 'Isoleucine or valine' 0 C--O 1.257 1.448 0 N-CA-C 116.902 2.186 . . . . 0.0 116.902 175.203 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . 0.828 ' O ' ' NE1' ' A' ' 108' ' ' TRP . 0.0 OUTLIER -106.23 8.16 31.82 Favored 'General case' 0 C--O 1.251 1.137 0 CA-C-N 114.094 -1.412 . . . . 0.0 114.67 -177.515 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 39.6 mm-40 41.97 56.44 3.5 Favored 'General case' 0 C--O 1.246 0.894 0 N-CA-C 119.404 3.112 . . . . 0.0 119.404 -179.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 54.4 mt -68.94 133.61 31.56 Favored 'Isoleucine or valine' 0 C--O 1.254 1.315 0 O-C-N 125.103 1.502 . . . . 0.0 111.953 175.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -79.74 147.77 31.76 Favored 'General case' 0 C--O 1.249 1.038 0 N-CA-C 115.826 1.788 . . . . 0.0 115.826 -178.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 83.1 p -88.55 -3.91 58.71 Favored 'General case' 0 C--O 1.253 1.267 1 N-CA-C 123.266 4.543 . . . . 0.0 123.266 176.332 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -80.73 -21.7 40.92 Favored 'General case' 0 C--O 1.251 1.177 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.071 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 3.0 m95 -133.16 -41.61 0.89 Allowed 'General case' 0 C--O 1.249 1.057 1 N-CA-C 127.001 5.926 . . . . 0.0 127.001 178.741 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TRP . . . . . 0.517 ' CH2' ' OD2' ' A' ' 101' ' ' ASP . 43.1 m95 -84.39 -37.89 20.94 Favored 'General case' 0 C--O 1.258 1.512 1 N-CA-C 124.848 5.129 . . . . 0.0 124.848 178.946 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.6 p -143.3 151.76 40.88 Favored 'General case' 0 C--O 1.255 1.349 0 O-C-N 124.995 1.434 . . . . 0.0 112.603 -178.359 62.47 83.685 95.787 104.149 2.056 103.394 -41.686 -69.979 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -94.66 128.93 41.66 Favored 'General case' 0 C--N 1.312 -1.048 0 O-C-N 125.077 1.486 . . . . 0.0 113.125 174.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 49.9 p-10 -122.19 15.77 10.65 Favored 'General case' 0 C--O 1.248 1.023 0 CA-C-N 113.276 -1.784 . . . . 0.0 113.613 170.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 61.93 6.3 9.27 Favored Glycine 0 C--O 1.254 1.375 1 N-CA-C 123.245 4.058 . . . . 0.0 123.245 176.987 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . 1.4 ' NH2' ' NH2' ' A' ' 45' ' ' ARG . 21.0 ptt180 -135.58 22.97 3.4 Favored 'General case' 0 C--O 1.253 1.261 1 N-CA-C 121.889 4.033 . . . . 0.0 121.889 171.351 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 3.1 m -120.08 102.01 46.74 Favored Pre-proline 0 C--O 1.255 1.385 0 CA-C-N 114.678 -1.146 . . . . 0.0 111.514 167.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . 0.287 21.4 Cg_exo -51.0 -46.21 32.12 Favored 'Trans proline' 0 C--N 1.316 -1.135 1 N-CA-C 127.394 5.882 . . . . 0.0 127.394 -179.661 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -54.51 -33.87 54.55 Favored Glycine 0 C--O 1.256 1.489 1 N-CA-C 102.183 -4.367 . . . . 0.0 102.183 -176.629 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . 0.282 0.5 OUTLIER -29.08 120.2 0.13 Allowed 'General case' 0 C--O 1.244 0.784 1 N-CA-C 144.975 12.583 . . . . 0.0 144.975 -165.892 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -116.92 143.77 45.32 Favored 'General case' 0 C--O 1.263 1.784 1 N-CA-C 83.03 -10.359 . . . . 0.0 83.03 -163.482 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -122.55 65.4 0.95 Allowed 'General case' 0 C--O 1.244 0.787 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 175.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.13 -21.47 61.63 Favored 'General case' 0 C--O 1.25 1.091 0 N-CA-C 117.284 2.327 . . . . 0.0 117.284 -176.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . 1.0 0.6 OUTLIER -88.99 -15.05 35.14 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-N 114.196 -1.366 . . . . 0.0 109.587 -179.853 -25.902 143.085 71.45 105.906 2.153 105.968 44.79 -177.476 3 3 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 44.05 59.65 3.09 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -171.179 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 4.9 tp -147.49 148.95 32.79 Favored Pre-proline 0 C--O 1.251 1.158 0 N-CA-C 104.124 -2.547 . . . . 0.0 104.124 177.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -71.87 134.26 23.33 Favored 'Trans proline' 0 C--O 1.262 1.723 0 N-CA-C 102.216 -3.801 . . . . 0.0 102.216 169.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 93.6 m -42.76 -40.1 2.69 Favored 'General case' 0 C--N 1.311 -1.084 0 O-C-N 124.9 1.375 . . . . 0.0 114.119 173.646 -69.979 -41.686 95.787 103.394 2.056 104.149 83.685 62.47 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 60.3 p -57.64 -35.48 70.56 Favored 'General case' 0 C--O 1.252 1.192 0 CA-C-N 113.564 -1.653 . . . . 0.0 111.66 -175.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -54.77 -25.3 27.05 Favored 'General case' 0 C--O 1.253 1.271 0 O-C-N 125.668 1.855 . . . . 0.0 113.51 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 68.9 mt -86.15 -6.54 58.98 Favored 'General case' 0 C--O 1.251 1.149 0 O-C-N 125.386 1.679 . . . . 0.0 110.066 -170.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 42.7 mt -99.64 -2.53 35.27 Favored 'General case' 0 C--O 1.254 1.318 0 N-CA-C 117.438 2.384 . . . . 0.0 117.438 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.93 159.24 35.05 Favored 'General case' 0 C--O 1.258 1.55 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 -176.129 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 24.8 m -66.64 -16.21 64.03 Favored 'General case' 0 C--O 1.256 1.441 0 N-CA-C 117.744 2.498 . . . . 0.0 117.744 177.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . 0.681 ' OD1' ' OG1' ' A' ' 89' ' ' THR . 8.6 t70 -96.05 127.36 41.99 Favored 'General case' 0 C--O 1.246 0.869 0 N-CA-C 104.597 -2.371 . . . . 0.0 104.597 170.979 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 31.5 pt -90.79 6.32 5.04 Favored 'Isoleucine or valine' 0 C--O 1.241 0.623 0 N-CA-C 115.75 1.759 . . . . 0.0 115.75 -175.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' THR . . . . . 0.681 ' OG1' ' OD1' ' A' ' 87' ' ' ASP . 75.2 m -54.71 -51.07 66.73 Favored 'General case' 0 C--O 1.259 1.579 0 CA-C-N 113.813 -1.54 . . . . 0.0 111.779 -173.236 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.0 85.69 Favored 'General case' 0 C--O 1.253 1.271 0 CA-C-N 114.214 -1.357 . . . . 0.0 113.396 178.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 57.9 m -69.38 -41.53 76.39 Favored 'General case' 0 C--N 1.312 -1.031 0 O-C-N 125.279 1.612 . . . . 0.0 114.933 -179.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.85 -58.28 8.28 Favored 'Isoleucine or valine' 0 C--O 1.257 1.45 0 CA-C-N 114.217 -1.356 . . . . 0.0 109.049 172.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -44.02 -43.93 7.04 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.748 -179.526 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 48.5 t -79.65 -37.11 36.71 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-N 114.016 -1.447 . . . . 0.0 111.099 -175.134 -177.476 44.79 71.45 105.968 2.153 105.906 143.085 -25.902 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.66 -27.53 69.28 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-N 114.127 -1.397 . . . . 0.0 113.494 177.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.1 mttp -67.02 -43.88 81.71 Favored 'General case' 0 C--O 1.25 1.116 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 -179.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . 0.731 ' O ' ' OD1' ' A' ' 101' ' ' ASP . 1.3 mttt -61.52 -38.74 88.49 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-N 113.667 -1.606 . . . . 0.0 113.861 178.683 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.5 mt -71.83 -54.48 16.76 Favored 'Isoleucine or valine' 0 C--O 1.251 1.141 0 N-CA-C 102.594 -3.113 . . . . 0.0 102.594 -168.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.6 p -61.12 -26.21 38.51 Favored 'Isoleucine or valine' 0 C--O 1.252 1.192 0 N-CA-C 119.7 3.222 . . . . 0.0 119.7 -177.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 50.6 m -82.6 -17.26 45.39 Favored 'General case' 0 C--O 1.248 0.977 1 N-CA-C 122.799 4.37 . . . . 0.0 122.799 172.848 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASP . . . . . 0.731 ' OD1' ' O ' ' A' ' 97' ' ' LYS . 67.5 m-20 -61.59 -52.2 65.39 Favored 'General case' 0 C--O 1.25 1.091 0 CA-C-N 113.803 -1.544 . . . . 0.0 109.919 -171.524 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -176.99 -29.67 0.04 OUTLIER Glycine 0 N--CA 1.477 1.413 1 N-CA-C 128.779 6.272 . . . . 0.0 128.779 177.026 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -100.01 5.92 45.09 Favored 'General case' 0 C--O 1.252 1.227 0 N-CA-C 120.214 3.413 . . . . 0.0 120.214 -179.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 58.79 -148.35 39.15 Favored Glycine 0 CA--C 1.539 1.564 0 N-CA-C 104.177 -3.569 . . . . 0.0 104.177 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 17.1 mtp -78.16 11.57 2.27 Favored 'General case' 0 C--O 1.247 0.945 0 O-C-N 125.307 1.239 . . . . 0.0 113.599 -176.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -73.38 -19.6 60.96 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 104.239 -2.504 . . . . 0.0 104.239 177.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.79 -14.41 59.0 Favored 'General case' 0 C--O 1.257 1.448 0 CA-C-N 114.28 -1.327 . . . . 0.0 107.889 -177.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' TRP . . . . . 0.828 ' NE1' ' O ' ' A' ' 56' ' ' LEU . 1.9 m-90 -112.51 100.43 8.74 Favored 'General case' 0 C--O 1.251 1.158 0 CA-C-N 113.937 -1.483 . . . . 0.0 111.428 -179.256 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . 0.453 ' CG1' ' N ' ' A' ' 110' ' ' ALA . 14.9 p -37.11 -56.16 0.23 Allowed 'Isoleucine or valine' 0 C--O 1.25 1.131 0 CA-C-N 114.11 -1.404 . . . . 0.0 112.851 -178.514 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . 0.453 ' N ' ' CG1' ' A' ' 109' ' ' VAL . . . -60.33 -32.03 70.86 Favored 'General case' 0 C--O 1.251 1.164 1 N-CA-C 122.429 4.233 . . . . 0.0 122.429 -178.566 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 71.7 t90 -69.56 -50.03 48.67 Favored 'General case' 0 C--O 1.26 1.613 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 176.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -55.28 -47.68 75.17 Favored 'General case' 0 C--O 1.254 1.33 0 N-CA-C 115.965 1.839 . . . . 0.0 115.965 -179.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -83.98 -25.52 29.95 Favored 'General case' 0 C--O 1.257 1.479 1 N-CA-C 122.268 4.173 . . . . 0.0 122.268 178.026 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -125.09 2.03 7.93 Favored 'General case' 0 C--O 1.253 1.25 1 N-CA-C 123.089 4.478 . . . . 0.0 123.089 -179.229 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 84.7 m -130.88 -57.62 1.03 Allowed 'General case' 0 C--O 1.257 1.494 0 CA-C-N 113.866 -1.515 . . . . 0.0 109.298 -171.974 -67.399 -72.44 -100.054 106.53 1.992 105.807 -86.913 -179.603 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 34.7 tttt -40.43 114.06 0.42 Allowed 'General case' 0 C--O 1.254 1.315 0 O-C-N 125.396 1.685 . . . . 0.0 114.551 172.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 81.47 31.8 32.67 Favored Glycine 0 N--CA 1.472 1.06 0 N-CA-C 119.173 2.429 . . . . 0.0 119.173 173.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . 0.273 13.7 p -130.27 172.61 11.63 Favored 'General case' 0 C--O 1.259 1.592 1 N-CA-C 89.752 -7.87 . . . . 0.0 89.752 -171.427 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . 1.333 ' OD2' ' NH1' ' A' ' 125' ' ' ARG . 0.0 OUTLIER -94.75 95.16 8.54 Favored 'General case' 0 C--N 1.319 -0.752 1 N-CA-C 98.207 -4.738 . . . . 0.0 98.207 -173.746 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 21.2 m -78.08 -17.62 13.85 Favored 'Isoleucine or valine' 0 C--O 1.253 1.273 0 N-CA-C 115.783 1.771 . . . . 0.0 115.783 -176.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -59.92 -18.65 46.64 Favored 'General case' 0 C--O 1.249 1.036 0 O-C-N 124.969 1.418 . . . . 0.0 112.871 174.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ALA . . . . . 0.966 ' CA ' ' CD ' ' A' ' 125' ' ' ARG . . . -65.98 -14.86 62.37 Favored 'General case' 0 C--O 1.251 1.179 0 CA-C-N 114.486 -1.234 . . . . 0.0 113.357 178.919 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' TRP . . . . . 1.15 ' O ' ' NH2' ' A' ' 5' ' ' ARG . 82.0 m95 -83.54 -25.03 31.36 Favored 'General case' 0 C--O 1.249 1.061 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 179.42 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 7.8 pt -107.94 13.68 8.37 Favored 'Isoleucine or valine' 0 C--O 1.26 1.636 0 N-CA-C 117.839 2.533 . . . . 0.0 117.839 171.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ARG . . . . . 1.333 ' NH1' ' OD2' ' A' ' 119' ' ' ASP . 51.5 mtt180 -71.55 137.67 48.24 Favored 'General case' 0 C--O 1.253 1.265 1 N-CA-C 96.606 -5.331 . . . . 0.0 96.606 177.658 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 96.5 -21.0 48.06 Favored Glycine 0 N--CA 1.474 1.171 0 N-CA-C 118.14 2.016 . . . . 0.0 118.14 178.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . 0.375 4.0 m -78.74 140.73 38.24 Favored 'General case' 0 C--O 1.254 1.297 1 N-CA-C 122.215 4.154 . . . . 0.0 122.215 -175.769 -40.311 -57.023 -81.768 111.089 2.15 106.012 -47.293 -72.75 3 2 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 24.6 mtt180 -86.6 118.04 25.76 Favored 'General case' 0 C--N 1.317 -0.818 1 N-CA-C 93.124 -6.621 . . . . 0.0 93.124 174.952 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 29.0 mt . . . . . 0 C--O 1.255 1.372 1 N-CA-C 99.813 -4.143 . . . . 0.0 99.813 -175.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 52.6 tttt . . . . . 0 C--O 1.256 1.408 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.7 t -112.82 107.13 22.2 Favored 'Isoleucine or valine' 0 C--O 1.253 1.265 0 N-CA-C 105.387 -2.079 . . . . 0.0 105.387 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -72.04 155.54 40.19 Favored 'General case' 0 C--O 1.258 1.525 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.1 147.15 18.45 Favored Glycine 0 CA--C 1.532 1.122 1 N-CA-C 102.426 -4.27 . . . . 0.0 102.426 175.918 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ARG . . . . . 1.202 ' NH1' ' O ' ' A' ' 125' ' ' ARG . 44.4 ttp85 -34.15 -68.64 0.11 Allowed 'General case' 0 C--O 1.256 1.399 0 CA-C-N 113.428 -1.386 . . . . 0.0 111.901 171.329 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . 0.451 ' O ' ' HB3' ' A' ' 9' ' ' ALA 0.38 65.8 m -52.1 -56.58 13.56 Favored 'General case' 0 C--O 1.254 1.326 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 178.517 -72.75 -47.293 -81.768 106.012 2.15 111.089 -57.023 -40.311 3 3 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 78.0 tt0 -52.26 -36.14 51.89 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 119.45 3.13 . . . . 0.0 119.45 -179.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 67.1 tp -73.85 -39.3 64.08 Favored 'General case' 0 C--O 1.255 1.366 0 O-C-N 125.149 1.53 . . . . 0.0 110.131 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 6' ' ' CYS . . . -57.26 -58.21 9.21 Favored 'General case' 0 C--O 1.249 1.04 0 N-CA-C 104.539 -2.393 . . . . 0.0 104.539 179.673 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -50.54 -36.61 35.2 Favored 'General case' 0 C--O 1.252 1.194 0 O-C-N 124.938 1.399 . . . . 0.0 113.598 -178.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -82.75 -38.29 23.45 Favored 'General case' 0 C--O 1.249 1.048 0 CA-C-N 114.0 -1.455 . . . . 0.0 111.525 -170.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' MET . . . . . 0.868 ' HE1' ' HB3' ' A' ' 28' ' ' TRP . 75.2 mtp -67.22 -34.88 78.4 Favored 'General case' 0 C--O 1.249 1.04 0 O-C-N 124.899 1.374 . . . . 0.0 107.71 177.592 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -65.78 -50.57 64.24 Favored 'General case' 0 C--O 1.247 0.945 0 CA-C-N 114.037 -1.438 . . . . 0.0 110.71 177.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.32 -39.2 66.81 Favored 'General case' 0 C--O 1.247 0.958 0 O-C-N 125.277 1.611 . . . . 0.0 107.343 179.81 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -84.05 25.69 0.8 Allowed 'General case' 0 C--O 1.255 1.36 1 N-CA-C 125.569 5.396 . . . . 0.0 125.569 177.055 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.45 4.31 69.12 Favored Glycine 0 N--CA 1.471 0.988 1 N-CA-C 126.079 5.192 . . . . 0.0 126.079 177.943 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . 0.692 HD13 ' HE2' ' A' ' 12' ' ' MET . 16.0 mt -82.11 -13.82 56.69 Favored 'General case' 0 C--O 1.252 1.234 1 N-CA-C 128.033 6.308 . . . . 0.0 128.033 -177.926 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -68.83 121.5 16.68 Favored 'General case' 0 C--O 1.247 0.962 1 N-CA-C 98.71 -4.552 . . . . 0.0 98.71 177.299 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 30.8 m120 58.41 22.99 10.11 Favored 'General case' 0 C--O 1.246 0.892 1 N-CA-C 122.543 4.275 . . . . 0.0 122.543 -179.071 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -69.72 130.52 42.58 Favored 'General case' 0 C--O 1.25 1.082 1 N-CA-C 99.412 -4.292 . . . . 0.0 99.412 -179.446 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.0 mmt85 52.15 18.83 0.92 Allowed 'General case' 0 C--O 1.25 1.107 0 CA-C-N 113.772 -1.558 . . . . 0.0 112.189 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.47 14.51 61.64 Favored Glycine 0 CA--C 1.536 1.383 0 N-CA-C 121.548 3.379 . . . . 0.0 121.548 176.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -101.14 119.48 38.81 Favored 'General case' 0 C--O 1.25 1.114 0 CA-C-N 113.977 -1.112 . . . . 0.0 109.422 178.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . 0.442 ' O ' ' HB2' ' A' ' 27' ' ' ASN . 0.2 OUTLIER -51.84 150.47 4.09 Favored 'General case' 0 C--O 1.251 1.139 0 O-C-N 125.045 1.466 . . . . 0.0 110.528 173.849 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . 0.43 HD23 ' O ' ' A' ' 25' ' ' LEU . 0.8 OUTLIER -48.68 -41.39 31.41 Favored 'General case' 0 C--O 1.252 1.215 0 O-C-N 125.291 1.62 . . . . 0.0 111.303 175.558 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.81 -33.19 82.07 Favored Glycine 0 C--O 1.25 1.11 0 CA-C-N 114.429 -1.26 . . . . 0.0 114.364 -179.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASN . . . . . 0.442 ' HB2' ' O ' ' A' ' 24' ' ' SER . 12.1 m-80 -61.86 -36.63 81.79 Favored 'General case' 0 C--O 1.245 0.829 0 N-CA-C 106.599 -1.63 . . . . 0.0 106.599 -179.043 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TRP . . . . . 0.868 ' HB3' ' HE1' ' A' ' 12' ' ' MET . 92.2 m95 -76.52 -34.74 58.56 Favored 'General case' 0 C--O 1.254 1.311 1 N-CA-C 122.178 4.14 . . . . 0.0 122.178 177.89 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 52.0 t -74.13 -39.36 50.12 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 179.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' CYS . . . . . 0.412 ' HB2' ' CD1' ' A' ' 123' ' ' TRP . 53.8 t -60.24 -53.36 58.56 Favored 'General case' 0 C--O 1.247 0.937 0 CA-C-N 113.884 -1.507 . . . . 0.0 111.879 -178.991 -179.603 -86.913 -100.054 105.807 1.992 106.53 -72.44 -67.399 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ALA . . . . . 0.705 ' O ' ' HB2' ' A' ' 35' ' ' GLU . . . -58.88 -42.44 89.48 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 125.46 1.725 . . . . 0.0 110.554 -177.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.13 -34.1 75.73 Favored 'General case' 0 C--O 1.259 1.592 0 O-C-N 125.693 1.871 . . . . 0.0 115.367 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . 0.41 ' HB2' ' CZ ' ' A' ' 38' ' ' PHE . 38.5 tptt -63.45 -59.98 3.96 Favored 'General case' 0 C--O 1.245 0.837 0 CA-C-N 114.464 -1.243 . . . . 0.0 109.206 177.404 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -71.18 -8.93 56.88 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 119.522 3.156 . . . . 0.0 119.522 177.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . 0.705 ' HB2' ' O ' ' A' ' 31' ' ' ALA . 2.2 tt0 -96.01 -46.91 6.32 Favored 'General case' 0 C--O 1.25 1.126 0 O-C-N 125.314 1.634 . . . . 0.0 112.189 178.277 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 83.2 p -132.2 2.6 3.93 Favored 'General case' 0 C--O 1.252 1.227 1 N-CA-C 125.384 5.327 . . . . 0.0 125.384 178.504 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 52.55 41.1 30.95 Favored 'General case' 0 C--O 1.253 1.273 0 CA-C-N 113.892 -1.504 . . . . 0.0 114.416 -173.156 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . 0.495 ' HA ' HD11 ' A' ' 55' ' ' ILE . 20.4 m-30 69.08 8.62 6.95 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 114.069 -1.423 . . . . 0.0 111.252 174.255 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -97.35 106.26 18.55 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-N 113.904 -1.498 . . . . 0.0 113.598 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.5 p -64.07 -19.2 65.06 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 119.239 3.051 . . . . 0.0 119.239 178.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -88.74 -6.12 57.63 Favored 'General case' 0 C--O 1.256 1.397 0 N-CA-C 116.386 1.995 . . . . 0.0 116.386 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.69 138.33 41.95 Favored 'General case' 0 C--O 1.246 0.89 0 N-CA-C 116.689 2.107 . . . . 0.0 116.689 172.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 77.5 p -142.79 154.12 43.9 Favored 'General case' 0 C--O 1.245 0.867 0 N-CA-C 105.816 -1.92 . . . . 0.0 105.816 175.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -156.74 127.44 6.69 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 113.916 -1.493 . . . . 0.0 113.334 176.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . 1.4 ' NH2' ' NH2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -88.09 134.76 33.68 Favored 'General case' 0 C--O 1.246 0.89 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.939 -179.292 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -100.96 172.05 7.26 Favored 'General case' 0 C--O 1.248 0.981 1 N-CA-C 94.152 -6.24 . . . . 0.0 94.152 -176.531 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.9 p -69.77 -18.96 63.53 Favored 'General case' 0 C--O 1.247 0.928 0 N-CA-C 121.486 3.884 . . . . 0.0 121.486 177.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -94.64 7.41 45.84 Favored 'General case' 0 C--O 1.245 0.844 0 CA-C-N 114.045 -1.434 . . . . 0.0 110.265 -169.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.9 -23.54 34.36 Favored Glycine 0 C--O 1.252 1.265 0 CA-C-N 113.633 -1.621 . . . . 0.0 109.978 171.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.66 160.25 17.33 Favored 'General case' 0 C--O 1.249 1.055 0 C-N-CA 123.821 0.848 . . . . 0.0 109.794 177.138 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . 0.404 HG22 ' CE2' ' A' ' 53' ' ' TYR . 16.7 m -138.19 149.73 46.1 Favored 'General case' 0 C--O 1.248 1.013 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 -179.257 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -106.9 137.69 44.49 Favored 'General case' 0 C--O 1.254 1.332 0 CA-C-N 113.975 -1.466 . . . . 0.0 107.112 -177.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' TYR . . . . . 0.404 ' CE2' HG22 ' A' ' 51' ' ' THR . 27.3 m-85 -131.67 136.35 47.61 Favored 'General case' 0 C--O 1.246 0.878 1 N-CA-C 125.519 5.378 . . . . 0.0 125.519 -177.715 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 81.66 -169.89 51.22 Favored Glycine 0 C--O 1.245 0.827 0 N-CA-C 122.48 3.752 . . . . 0.0 122.48 -177.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . 0.804 HG23 ' N ' ' A' ' 56' ' ' LEU . 2.7 tp -51.82 -38.23 22.22 Favored 'Isoleucine or valine' 0 C--O 1.257 1.448 0 N-CA-C 116.902 2.186 . . . . 0.0 116.902 175.203 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . 0.804 ' N ' HG23 ' A' ' 55' ' ' ILE . 0.0 OUTLIER -106.23 8.16 31.82 Favored 'General case' 0 C--O 1.251 1.137 0 CA-C-N 114.094 -1.412 . . . . 0.0 114.67 -177.515 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 39.6 mm-40 41.97 56.44 3.5 Favored 'General case' 0 C--O 1.246 0.894 0 N-CA-C 119.404 3.112 . . . . 0.0 119.404 -179.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ILE . . . . . 0.556 HD13 ' SG ' ' A' ' 94' ' ' CYS . 54.4 mt -68.94 133.61 31.56 Favored 'Isoleucine or valine' 0 C--O 1.254 1.315 0 O-C-N 125.103 1.502 . . . . 0.0 111.953 175.447 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . 0.505 ' OD1' ' HB3' ' A' ' 61' ' ' ARG . 4.0 t-20 -79.74 147.77 31.76 Favored 'General case' 0 C--O 1.249 1.038 0 N-CA-C 115.826 1.788 . . . . 0.0 115.826 -178.542 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 83.1 p -88.55 -3.91 58.71 Favored 'General case' 0 C--O 1.253 1.267 1 N-CA-C 123.266 4.543 . . . . 0.0 123.266 176.332 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ARG . . . . . 0.505 ' HB3' ' OD1' ' A' ' 59' ' ' ASN . 1.8 ttt180 -80.73 -21.7 40.92 Favored 'General case' 0 C--O 1.251 1.177 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.071 179.893 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TRP . . . . . 0.442 ' O ' HD23 ' A' ' 75' ' ' LEU . 3.0 m95 -133.16 -41.61 0.89 Allowed 'General case' 0 C--O 1.249 1.057 1 N-CA-C 127.001 5.926 . . . . 0.0 127.001 178.741 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TRP . . . . . 0.707 ' HH2' ' OD2' ' A' ' 101' ' ' ASP . 43.1 m95 -84.39 -37.89 20.94 Favored 'General case' 0 C--O 1.258 1.512 1 N-CA-C 124.848 5.129 . . . . 0.0 124.848 178.946 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.6 p -143.3 151.76 40.88 Favored 'General case' 0 C--O 1.255 1.349 0 O-C-N 124.995 1.434 . . . . 0.0 112.603 -178.359 62.47 83.685 95.787 104.149 2.056 103.394 -41.686 -69.979 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASN . . . . . 0.494 ' O ' ' HA ' ' A' ' 79' ' ' PRO . 46.7 t30 -94.66 128.93 41.66 Favored 'General case' 0 C--N 1.312 -1.048 0 O-C-N 125.077 1.486 . . . . 0.0 113.125 174.389 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 49.9 p-10 -122.19 15.77 10.65 Favored 'General case' 0 C--O 1.248 1.023 0 CA-C-N 113.276 -1.784 . . . . 0.0 113.613 170.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 61.93 6.3 9.27 Favored Glycine 0 C--O 1.254 1.375 1 N-CA-C 123.245 4.058 . . . . 0.0 123.245 176.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . 1.4 ' NH2' ' NH2' ' A' ' 45' ' ' ARG . 21.0 ptt180 -135.58 22.97 3.4 Favored 'General case' 0 C--O 1.253 1.261 1 N-CA-C 121.889 4.033 . . . . 0.0 121.889 171.351 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . 0.419 ' O ' ' HB2' ' A' ' 72' ' ' SER . 3.1 m -120.08 102.01 46.74 Favored Pre-proline 0 C--O 1.255 1.385 0 CA-C-N 114.678 -1.146 . . . . 0.0 111.514 167.191 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 69' ' ' THR 0.287 21.4 Cg_exo -51.0 -46.21 32.12 Favored 'Trans proline' 0 C--N 1.316 -1.135 1 N-CA-C 127.394 5.882 . . . . 0.0 127.394 -179.661 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -54.51 -33.87 54.55 Favored Glycine 0 C--O 1.256 1.489 1 N-CA-C 102.183 -4.367 . . . . 0.0 102.183 -176.629 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . 0.419 ' HB2' ' O ' ' A' ' 69' ' ' THR 0.282 0.5 OUTLIER -29.08 120.2 0.13 Allowed 'General case' 0 C--O 1.244 0.784 1 N-CA-C 144.975 12.583 . . . . 0.0 144.975 -165.892 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . 0.4 ' HB3' ' CD2' ' A' ' 75' ' ' LEU . 87.4 mtt180 -116.92 143.77 45.32 Favored 'General case' 0 C--O 1.263 1.784 1 N-CA-C 83.03 -10.359 . . . . 0.0 83.03 -163.482 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASN . . . . . 0.474 ' ND2' ' HA ' ' A' ' 77' ' ' ASN . 22.9 t30 -122.55 65.4 0.95 Allowed 'General case' 0 C--O 1.244 0.787 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 175.352 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . 0.442 HD23 ' O ' ' A' ' 62' ' ' TRP . 3.8 mm? -60.13 -21.47 61.63 Favored 'General case' 0 C--O 1.25 1.091 0 N-CA-C 117.284 2.327 . . . . 0.0 117.284 -176.069 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . 1.0 0.6 OUTLIER -88.99 -15.05 35.14 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-N 114.196 -1.366 . . . . 0.0 109.587 -179.853 -25.902 143.085 71.45 105.906 2.153 105.968 44.79 -177.476 3 3 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASN . . . . . 0.474 ' HA ' ' ND2' ' A' ' 74' ' ' ASN . 0.2 OUTLIER 44.05 59.65 3.09 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -171.179 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ILE . . . . . 0.652 HG13 ' HD2' ' A' ' 79' ' ' PRO . 4.9 tp -147.49 148.95 32.79 Favored Pre-proline 0 C--O 1.251 1.158 0 N-CA-C 104.124 -2.547 . . . . 0.0 104.124 177.903 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PRO . . . . . 0.652 ' HD2' HG13 ' A' ' 78' ' ' ILE . 8.8 Cg_endo -71.87 134.26 23.33 Favored 'Trans proline' 0 C--O 1.262 1.723 0 N-CA-C 102.216 -3.801 . . . . 0.0 102.216 169.35 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 93.6 m -42.76 -40.1 2.69 Favored 'General case' 0 C--N 1.311 -1.084 0 O-C-N 124.9 1.375 . . . . 0.0 114.119 173.646 -69.979 -41.686 95.787 103.394 2.056 104.149 83.685 62.47 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 60.3 p -57.64 -35.48 70.56 Favored 'General case' 0 C--O 1.252 1.192 0 CA-C-N 113.564 -1.653 . . . . 0.0 111.66 -175.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -54.77 -25.3 27.05 Favored 'General case' 0 C--O 1.253 1.271 0 O-C-N 125.668 1.855 . . . . 0.0 113.51 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . 0.487 HD13 HD12 ' A' ' 58' ' ' ILE . 68.9 mt -86.15 -6.54 58.98 Favored 'General case' 0 C--O 1.251 1.149 0 O-C-N 125.386 1.679 . . . . 0.0 110.066 -170.569 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 42.7 mt -99.64 -2.53 35.27 Favored 'General case' 0 C--O 1.254 1.318 0 N-CA-C 117.438 2.384 . . . . 0.0 117.438 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.93 159.24 35.05 Favored 'General case' 0 C--O 1.258 1.55 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 -176.129 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 24.8 m -66.64 -16.21 64.03 Favored 'General case' 0 C--O 1.256 1.441 0 N-CA-C 117.744 2.498 . . . . 0.0 117.744 177.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . 0.605 ' OD1' ' OG1' ' A' ' 89' ' ' THR . 8.6 t70 -96.05 127.36 41.99 Favored 'General case' 0 C--O 1.246 0.869 0 N-CA-C 104.597 -2.371 . . . . 0.0 104.597 170.979 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 31.5 pt -90.79 6.32 5.04 Favored 'Isoleucine or valine' 0 C--O 1.241 0.623 0 N-CA-C 115.75 1.759 . . . . 0.0 115.75 -175.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' THR . . . . . 0.605 ' OG1' ' OD1' ' A' ' 87' ' ' ASP . 75.2 m -54.71 -51.07 66.73 Favored 'General case' 0 C--O 1.259 1.579 0 CA-C-N 113.813 -1.54 . . . . 0.0 111.779 -173.236 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.0 85.69 Favored 'General case' 0 C--O 1.253 1.271 0 CA-C-N 114.214 -1.357 . . . . 0.0 113.396 178.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 57.9 m -69.38 -41.53 76.39 Favored 'General case' 0 C--N 1.312 -1.031 0 O-C-N 125.279 1.612 . . . . 0.0 114.933 -179.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.85 -58.28 8.28 Favored 'Isoleucine or valine' 0 C--O 1.257 1.45 0 CA-C-N 114.217 -1.356 . . . . 0.0 109.049 172.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -44.02 -43.93 7.04 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.748 -179.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' CYS . . . . . 0.556 ' SG ' HD13 ' A' ' 58' ' ' ILE . 48.5 t -79.65 -37.11 36.71 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-N 114.016 -1.447 . . . . 0.0 111.099 -175.134 -177.476 44.79 71.45 105.968 2.153 105.906 143.085 -25.902 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.66 -27.53 69.28 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-N 114.127 -1.397 . . . . 0.0 113.494 177.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . 0.489 ' O ' HG12 ' A' ' 99' ' ' VAL . 11.1 mttp -67.02 -43.88 81.71 Favored 'General case' 0 C--O 1.25 1.116 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 -179.829 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . 0.731 ' O ' ' OD1' ' A' ' 101' ' ' ASP . 1.3 mttt -61.52 -38.74 88.49 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-N 113.667 -1.606 . . . . 0.0 113.861 178.683 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ILE . . . . . 0.54 HG21 ' CZ3' ' A' ' 108' ' ' TRP . 4.5 mt -71.83 -54.48 16.76 Favored 'Isoleucine or valine' 0 C--O 1.251 1.141 0 N-CA-C 102.594 -3.113 . . . . 0.0 102.594 -168.798 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . 0.489 HG12 ' O ' ' A' ' 96' ' ' LYS . 2.6 p -61.12 -26.21 38.51 Favored 'Isoleucine or valine' 0 C--O 1.252 1.192 0 N-CA-C 119.7 3.222 . . . . 0.0 119.7 -177.974 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 50.6 m -82.6 -17.26 45.39 Favored 'General case' 0 C--O 1.248 0.977 1 N-CA-C 122.799 4.37 . . . . 0.0 122.799 172.848 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASP . . . . . 0.731 ' OD1' ' O ' ' A' ' 97' ' ' LYS . 67.5 m-20 -61.59 -52.2 65.39 Favored 'General case' 0 C--O 1.25 1.091 0 CA-C-N 113.803 -1.544 . . . . 0.0 109.919 -171.524 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -176.99 -29.67 0.04 OUTLIER Glycine 0 N--CA 1.477 1.413 1 N-CA-C 128.779 6.272 . . . . 0.0 128.779 177.026 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASN . . . . . 0.658 ' O ' ' HB2' ' A' ' 106' ' ' ASN . 19.1 m120 -100.01 5.92 45.09 Favored 'General case' 0 C--O 1.252 1.227 0 N-CA-C 120.214 3.413 . . . . 0.0 120.214 -179.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 58.79 -148.35 39.15 Favored Glycine 0 CA--C 1.539 1.564 0 N-CA-C 104.177 -3.569 . . . . 0.0 104.177 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 17.1 mtp -78.16 11.57 2.27 Favored 'General case' 0 C--O 1.247 0.945 0 O-C-N 125.307 1.239 . . . . 0.0 113.599 -176.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASN . . . . . 0.658 ' HB2' ' O ' ' A' ' 103' ' ' ASN . 56.4 m-20 -73.38 -19.6 60.96 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 104.239 -2.504 . . . . 0.0 104.239 177.536 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.79 -14.41 59.0 Favored 'General case' 0 C--O 1.257 1.448 0 CA-C-N 114.28 -1.327 . . . . 0.0 107.889 -177.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' TRP . . . . . 0.795 ' NE1' ' O ' ' A' ' 56' ' ' LEU . 1.9 m-90 -112.51 100.43 8.74 Favored 'General case' 0 C--O 1.251 1.158 0 CA-C-N 113.937 -1.483 . . . . 0.0 111.428 -179.256 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . 0.585 HG13 ' N ' ' A' ' 110' ' ' ALA . 14.9 p -37.11 -56.16 0.23 Allowed 'Isoleucine or valine' 0 C--O 1.25 1.131 0 CA-C-N 114.11 -1.404 . . . . 0.0 112.851 -178.514 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . 0.677 ' O ' ' HG3' ' A' ' 114' ' ' ARG . . . -60.33 -32.03 70.86 Favored 'General case' 0 C--O 1.251 1.164 1 N-CA-C 122.429 4.233 . . . . 0.0 122.429 -178.566 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 111' ' ' TRP . . . . . 0.582 ' CZ3' ' HD2' ' A' ' 116' ' ' LYS . 71.7 t90 -69.56 -50.03 48.67 Favored 'General case' 0 C--O 1.26 1.613 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 176.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -55.28 -47.68 75.17 Favored 'General case' 0 C--O 1.254 1.33 0 N-CA-C 115.965 1.839 . . . . 0.0 115.965 -179.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -83.98 -25.52 29.95 Favored 'General case' 0 C--O 1.257 1.479 1 N-CA-C 122.268 4.173 . . . . 0.0 122.268 178.026 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ARG . . . . . 0.677 ' HG3' ' O ' ' A' ' 110' ' ' ALA . 0.1 OUTLIER -125.09 2.03 7.93 Favored 'General case' 0 C--O 1.253 1.25 1 N-CA-C 123.089 4.478 . . . . 0.0 123.089 -179.229 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 84.7 m -130.88 -57.62 1.03 Allowed 'General case' 0 C--O 1.257 1.494 0 CA-C-N 113.866 -1.515 . . . . 0.0 109.298 -171.974 -67.399 -72.44 -100.054 106.53 1.992 105.807 -86.913 -179.603 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . 0.582 ' HD2' ' CZ3' ' A' ' 111' ' ' TRP . 34.7 tttt -40.43 114.06 0.42 Allowed 'General case' 0 C--O 1.254 1.315 0 O-C-N 125.396 1.685 . . . . 0.0 114.551 172.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 81.47 31.8 32.67 Favored Glycine 0 N--CA 1.472 1.06 0 N-CA-C 119.173 2.429 . . . . 0.0 119.173 173.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . 0.273 13.7 p -130.27 172.61 11.63 Favored 'General case' 0 C--O 1.259 1.592 1 N-CA-C 89.752 -7.87 . . . . 0.0 89.752 -171.427 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . 1.333 ' OD2' ' NH1' ' A' ' 125' ' ' ARG . 0.0 OUTLIER -94.75 95.16 8.54 Favored 'General case' 0 C--N 1.319 -0.752 1 N-CA-C 98.207 -4.738 . . . . 0.0 98.207 -173.746 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 21.2 m -78.08 -17.62 13.85 Favored 'Isoleucine or valine' 0 C--O 1.253 1.273 0 N-CA-C 115.783 1.771 . . . . 0.0 115.783 -176.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLN . . . . . 0.618 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 67.5 mt-30 -59.92 -18.65 46.64 Favored 'General case' 0 C--O 1.249 1.036 0 O-C-N 124.969 1.418 . . . . 0.0 112.871 174.831 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ALA . . . . . 1.277 ' HA ' ' CD ' ' A' ' 125' ' ' ARG . . . -65.98 -14.86 62.37 Favored 'General case' 0 C--O 1.251 1.179 0 CA-C-N 114.486 -1.234 . . . . 0.0 113.357 178.919 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' TRP . . . . . 1.143 ' O ' ' NH2' ' A' ' 5' ' ' ARG . 82.0 m95 -83.54 -25.03 31.36 Favored 'General case' 0 C--O 1.249 1.061 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 179.42 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 7.8 pt -107.94 13.68 8.37 Favored 'Isoleucine or valine' 0 C--O 1.26 1.636 0 N-CA-C 117.839 2.533 . . . . 0.0 117.839 171.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ARG . . . . . 1.333 ' NH1' ' OD2' ' A' ' 119' ' ' ASP . 51.5 mtt180 -71.55 137.67 48.24 Favored 'General case' 0 C--O 1.253 1.265 1 N-CA-C 96.606 -5.331 . . . . 0.0 96.606 177.658 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 96.5 -21.0 48.06 Favored Glycine 0 N--CA 1.474 1.171 0 N-CA-C 118.14 2.016 . . . . 0.0 118.14 178.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . 0.375 4.0 m -78.74 140.73 38.24 Favored 'General case' 0 C--O 1.254 1.297 1 N-CA-C 122.215 4.154 . . . . 0.0 122.215 -175.769 -40.311 -57.023 -81.768 111.089 2.15 106.012 -47.293 -72.75 3 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 24.6 mtt180 -86.6 118.04 25.76 Favored 'General case' 0 C--N 1.317 -0.818 1 N-CA-C 93.124 -6.621 . . . . 0.0 93.124 174.952 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 29.0 mt . . . . . 0 C--O 1.255 1.372 1 N-CA-C 99.813 -4.143 . . . . 0.0 99.813 -175.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 52.6 tttt . . . . . 0 C--O 1.256 1.408 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.7 t -112.82 107.13 22.2 Favored 'Isoleucine or valine' 0 C--O 1.253 1.265 0 N-CA-C 105.387 -2.079 . . . . 0.0 105.387 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -72.04 155.54 40.19 Favored 'General case' 0 C--O 1.258 1.525 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.1 147.15 18.45 Favored Glycine 0 CA--C 1.532 1.122 1 N-CA-C 102.426 -4.27 . . . . 0.0 102.426 175.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ARG . . . . . 1.202 ' NH1' ' O ' ' A' ' 125' ' ' ARG . 44.4 ttp85 -34.15 -68.64 0.11 Allowed 'General case' 0 C--O 1.256 1.399 0 CA-C-N 113.428 -1.386 . . . . 0.0 111.901 171.329 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.451 ' O ' ' HB3' ' A' ' 9' ' ' ALA 0.38 65.8 m -52.1 -56.58 13.56 Favored 'General case' 0 C--O 1.254 1.326 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 178.517 -72.75 -47.293 -81.768 106.012 2.15 111.089 -57.023 -40.311 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 78.0 tt0 -52.26 -36.14 51.89 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 119.45 3.13 . . . . 0.0 119.45 -179.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 67.1 tp -73.85 -39.3 64.08 Favored 'General case' 0 C--O 1.255 1.366 0 O-C-N 125.149 1.53 . . . . 0.0 110.131 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 6' ' ' CYS . . . -57.26 -58.21 9.21 Favored 'General case' 0 C--O 1.249 1.04 0 N-CA-C 104.539 -2.393 . . . . 0.0 104.539 179.673 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -50.54 -36.61 35.2 Favored 'General case' 0 C--O 1.252 1.194 0 O-C-N 124.938 1.399 . . . . 0.0 113.598 -178.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -82.75 -38.29 23.45 Favored 'General case' 0 C--O 1.249 1.048 0 CA-C-N 114.0 -1.455 . . . . 0.0 111.525 -170.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' MET . . . . . 0.868 ' HE1' ' HB3' ' A' ' 28' ' ' TRP . 75.2 mtp -67.22 -34.88 78.4 Favored 'General case' 0 C--O 1.249 1.04 0 O-C-N 124.899 1.374 . . . . 0.0 107.71 177.592 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -65.78 -50.57 64.24 Favored 'General case' 0 C--O 1.247 0.945 0 CA-C-N 114.037 -1.438 . . . . 0.0 110.71 177.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.32 -39.2 66.81 Favored 'General case' 0 C--O 1.247 0.958 0 O-C-N 125.277 1.611 . . . . 0.0 107.343 179.81 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -84.05 25.69 0.8 Allowed 'General case' 0 C--O 1.255 1.36 1 N-CA-C 125.569 5.396 . . . . 0.0 125.569 177.055 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.45 4.31 69.12 Favored Glycine 0 N--CA 1.471 0.988 1 N-CA-C 126.079 5.192 . . . . 0.0 126.079 177.943 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.692 HD13 ' HE2' ' A' ' 12' ' ' MET . 16.0 mt -82.11 -13.82 56.69 Favored 'General case' 0 C--O 1.252 1.234 1 N-CA-C 128.033 6.308 . . . . 0.0 128.033 -177.926 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -68.83 121.5 16.68 Favored 'General case' 0 C--O 1.247 0.962 1 N-CA-C 98.71 -4.552 . . . . 0.0 98.71 177.299 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 30.8 m120 58.41 22.99 10.11 Favored 'General case' 0 C--O 1.246 0.892 1 N-CA-C 122.543 4.275 . . . . 0.0 122.543 -179.071 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -69.72 130.52 42.58 Favored 'General case' 0 C--O 1.25 1.082 1 N-CA-C 99.412 -4.292 . . . . 0.0 99.412 -179.446 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.0 mmt85 52.15 18.83 0.92 Allowed 'General case' 0 C--O 1.25 1.107 0 CA-C-N 113.772 -1.558 . . . . 0.0 112.189 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.47 14.51 61.64 Favored Glycine 0 CA--C 1.536 1.383 0 N-CA-C 121.548 3.379 . . . . 0.0 121.548 176.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -101.14 119.48 38.81 Favored 'General case' 0 C--O 1.25 1.114 0 CA-C-N 113.977 -1.112 . . . . 0.0 109.422 178.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . 0.442 ' O ' ' HB2' ' A' ' 27' ' ' ASN . 0.2 OUTLIER -51.84 150.47 4.09 Favored 'General case' 0 C--O 1.251 1.139 0 O-C-N 125.045 1.466 . . . . 0.0 110.528 173.849 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.43 HD23 ' O ' ' A' ' 25' ' ' LEU . 0.8 OUTLIER -48.68 -41.39 31.41 Favored 'General case' 0 C--O 1.252 1.215 0 O-C-N 125.291 1.62 . . . . 0.0 111.303 175.558 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.81 -33.19 82.07 Favored Glycine 0 C--O 1.25 1.11 0 CA-C-N 114.429 -1.26 . . . . 0.0 114.364 -179.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.946 HD22 ' HE1' ' A' ' 111' ' ' TRP . 3.9 m120 -61.86 -36.63 81.79 Favored 'General case' 0 C--O 1.245 0.829 0 N-CA-C 106.599 -1.63 . . . . 0.0 106.599 -179.043 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.868 ' HB3' ' HE1' ' A' ' 12' ' ' MET . 92.2 m95 -76.52 -34.74 58.56 Favored 'General case' 0 C--O 1.254 1.311 1 N-CA-C 122.178 4.14 . . . . 0.0 122.178 177.89 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 52.0 t -74.13 -39.36 50.12 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 179.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.412 ' HB2' ' CD1' ' A' ' 123' ' ' TRP . 53.8 t -60.24 -53.36 58.56 Favored 'General case' 0 C--O 1.247 0.937 0 CA-C-N 113.884 -1.507 . . . . 0.0 111.879 -178.991 -179.603 -86.913 -100.054 105.807 1.992 106.53 -72.44 -67.399 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.705 ' O ' ' HB2' ' A' ' 35' ' ' GLU . . . -58.88 -42.44 89.48 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 125.46 1.725 . . . . 0.0 110.554 -177.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.13 -34.1 75.73 Favored 'General case' 0 C--O 1.259 1.592 0 O-C-N 125.693 1.871 . . . . 0.0 115.367 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.41 ' HB2' ' CZ ' ' A' ' 38' ' ' PHE . 38.5 tptt -63.45 -59.98 3.96 Favored 'General case' 0 C--O 1.245 0.837 0 CA-C-N 114.464 -1.243 . . . . 0.0 109.206 177.404 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -71.18 -8.93 56.88 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 119.522 3.156 . . . . 0.0 119.522 177.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.705 ' HB2' ' O ' ' A' ' 31' ' ' ALA . 2.2 tt0 -96.01 -46.91 6.32 Favored 'General case' 0 C--O 1.25 1.126 0 O-C-N 125.314 1.634 . . . . 0.0 112.189 178.277 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 83.2 p -132.2 2.6 3.93 Favored 'General case' 0 C--O 1.252 1.227 1 N-CA-C 125.384 5.327 . . . . 0.0 125.384 178.504 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 52.55 41.1 30.95 Favored 'General case' 0 C--O 1.253 1.273 0 CA-C-N 113.892 -1.504 . . . . 0.0 114.416 -173.156 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.495 ' HA ' HD11 ' A' ' 55' ' ' ILE . 20.4 m-30 69.08 8.62 6.95 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 114.069 -1.423 . . . . 0.0 111.252 174.255 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.473 ' ND2' ' H ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -97.35 106.26 18.55 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-N 113.904 -1.498 . . . . 0.0 113.598 179.942 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.5 p -64.07 -19.2 65.06 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 119.239 3.051 . . . . 0.0 119.239 178.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.473 ' H ' ' ND2' ' A' ' 39' ' ' ASN . 21.6 mt-30 -88.74 -6.12 57.63 Favored 'General case' 0 C--O 1.256 1.397 0 N-CA-C 116.386 1.995 . . . . 0.0 116.386 -179.866 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.69 138.33 41.95 Favored 'General case' 0 C--O 1.246 0.89 0 N-CA-C 116.689 2.107 . . . . 0.0 116.689 172.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 77.5 p -142.79 154.12 43.9 Favored 'General case' 0 C--O 1.245 0.867 0 N-CA-C 105.816 -1.92 . . . . 0.0 105.816 175.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -156.74 127.44 6.69 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 113.916 -1.493 . . . . 0.0 113.334 176.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . 1.4 ' NH2' ' NH2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -88.09 134.76 33.68 Favored 'General case' 0 C--O 1.246 0.89 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.939 -179.292 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -100.96 172.05 7.26 Favored 'General case' 0 C--O 1.248 0.981 1 N-CA-C 94.152 -6.24 . . . . 0.0 94.152 -176.531 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.9 p -69.77 -18.96 63.53 Favored 'General case' 0 C--O 1.247 0.928 0 N-CA-C 121.486 3.884 . . . . 0.0 121.486 177.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -94.64 7.41 45.84 Favored 'General case' 0 C--O 1.245 0.844 0 CA-C-N 114.045 -1.434 . . . . 0.0 110.265 -169.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.9 -23.54 34.36 Favored Glycine 0 C--O 1.252 1.265 0 CA-C-N 113.633 -1.621 . . . . 0.0 109.978 171.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.66 160.25 17.33 Favored 'General case' 0 C--O 1.249 1.055 0 C-N-CA 123.821 0.848 . . . . 0.0 109.794 177.138 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . 0.404 HG22 ' CE2' ' A' ' 53' ' ' TYR . 16.7 m -138.19 149.73 46.1 Favored 'General case' 0 C--O 1.248 1.013 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 -179.257 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -106.9 137.69 44.49 Favored 'General case' 0 C--O 1.254 1.332 0 CA-C-N 113.975 -1.466 . . . . 0.0 107.112 -177.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.404 ' CE2' HG22 ' A' ' 51' ' ' THR . 27.3 m-85 -131.67 136.35 47.61 Favored 'General case' 0 C--O 1.246 0.878 1 N-CA-C 125.519 5.378 . . . . 0.0 125.519 -177.715 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 81.66 -169.89 51.22 Favored Glycine 0 C--O 1.245 0.827 0 N-CA-C 122.48 3.752 . . . . 0.0 122.48 -177.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.804 HG23 ' N ' ' A' ' 56' ' ' LEU . 2.7 tp -51.82 -38.23 22.22 Favored 'Isoleucine or valine' 0 C--O 1.257 1.448 0 N-CA-C 116.902 2.186 . . . . 0.0 116.902 175.203 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.804 ' N ' HG23 ' A' ' 55' ' ' ILE . 0.0 OUTLIER -106.23 8.16 31.82 Favored 'General case' 0 C--O 1.251 1.137 0 CA-C-N 114.094 -1.412 . . . . 0.0 114.67 -177.515 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 39.6 mm-40 41.97 56.44 3.5 Favored 'General case' 0 C--O 1.246 0.894 0 N-CA-C 119.404 3.112 . . . . 0.0 119.404 -179.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.556 HD13 ' SG ' ' A' ' 94' ' ' CYS . 54.4 mt -68.94 133.61 31.56 Favored 'Isoleucine or valine' 0 C--O 1.254 1.315 0 O-C-N 125.103 1.502 . . . . 0.0 111.953 175.447 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.505 ' OD1' ' HB3' ' A' ' 61' ' ' ARG . 4.0 t-20 -79.74 147.77 31.76 Favored 'General case' 0 C--O 1.249 1.038 0 N-CA-C 115.826 1.788 . . . . 0.0 115.826 -178.542 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 83.1 p -88.55 -3.91 58.71 Favored 'General case' 0 C--O 1.253 1.267 1 N-CA-C 123.266 4.543 . . . . 0.0 123.266 176.332 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.505 ' HB3' ' OD1' ' A' ' 59' ' ' ASN . 1.8 ttt180 -80.73 -21.7 40.92 Favored 'General case' 0 C--O 1.251 1.177 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.071 179.893 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.442 ' O ' HD23 ' A' ' 75' ' ' LEU . 3.0 m95 -133.16 -41.61 0.89 Allowed 'General case' 0 C--O 1.249 1.057 1 N-CA-C 127.001 5.926 . . . . 0.0 127.001 178.741 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TRP . . . . . 0.707 ' HH2' ' OD2' ' A' ' 101' ' ' ASP . 43.1 m95 -84.39 -37.89 20.94 Favored 'General case' 0 C--O 1.258 1.512 1 N-CA-C 124.848 5.129 . . . . 0.0 124.848 178.946 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.6 p -143.3 151.76 40.88 Favored 'General case' 0 C--O 1.255 1.349 0 O-C-N 124.995 1.434 . . . . 0.0 112.603 -178.359 62.47 83.685 95.787 104.149 2.056 103.394 -41.686 -69.979 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.494 ' O ' ' HA ' ' A' ' 79' ' ' PRO . 10.8 t-20 -94.66 128.93 41.66 Favored 'General case' 0 C--N 1.312 -1.048 0 O-C-N 125.077 1.486 . . . . 0.0 113.125 174.389 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 49.9 p-10 -122.19 15.77 10.65 Favored 'General case' 0 C--O 1.248 1.023 0 CA-C-N 113.276 -1.784 . . . . 0.0 113.613 170.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.426 ' H ' ' ND2' ' A' ' 65' ' ' ASN . . . 61.93 6.3 9.27 Favored Glycine 0 C--O 1.254 1.375 1 N-CA-C 123.245 4.058 . . . . 0.0 123.245 176.987 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . 1.4 ' NH2' ' NH2' ' A' ' 45' ' ' ARG . 21.0 ptt180 -135.58 22.97 3.4 Favored 'General case' 0 C--O 1.253 1.261 1 N-CA-C 121.889 4.033 . . . . 0.0 121.889 171.351 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . 0.419 ' O ' ' HB2' ' A' ' 72' ' ' SER . 3.1 m -120.08 102.01 46.74 Favored Pre-proline 0 C--O 1.255 1.385 0 CA-C-N 114.678 -1.146 . . . . 0.0 111.514 167.191 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 69' ' ' THR 0.287 21.4 Cg_exo -51.0 -46.21 32.12 Favored 'Trans proline' 0 C--N 1.316 -1.135 1 N-CA-C 127.394 5.882 . . . . 0.0 127.394 -179.661 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -54.51 -33.87 54.55 Favored Glycine 0 C--O 1.256 1.489 1 N-CA-C 102.183 -4.367 . . . . 0.0 102.183 -176.629 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . 0.419 ' HB2' ' O ' ' A' ' 69' ' ' THR 0.282 0.5 OUTLIER -29.08 120.2 0.13 Allowed 'General case' 0 C--O 1.244 0.784 1 N-CA-C 144.975 12.583 . . . . 0.0 144.975 -165.892 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.4 ' HB3' ' CD2' ' A' ' 75' ' ' LEU . 87.4 mtt180 -116.92 143.77 45.32 Favored 'General case' 0 C--O 1.263 1.784 1 N-CA-C 83.03 -10.359 . . . . 0.0 83.03 -163.482 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.474 ' ND2' ' HA ' ' A' ' 77' ' ' ASN . 22.9 t30 -122.55 65.4 0.95 Allowed 'General case' 0 C--O 1.244 0.787 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 175.352 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.442 HD23 ' O ' ' A' ' 62' ' ' TRP . 3.8 mm? -60.13 -21.47 61.63 Favored 'General case' 0 C--O 1.25 1.091 0 N-CA-C 117.284 2.327 . . . . 0.0 117.284 -176.069 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . 1.0 0.6 OUTLIER -88.99 -15.05 35.14 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-N 114.196 -1.366 . . . . 0.0 109.587 -179.853 -25.902 143.085 71.45 105.906 2.153 105.968 44.79 -177.476 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.474 ' HA ' ' ND2' ' A' ' 74' ' ' ASN . 0.2 OUTLIER 44.05 59.65 3.09 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -171.179 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.652 HG13 ' HD2' ' A' ' 79' ' ' PRO . 4.9 tp -147.49 148.95 32.79 Favored Pre-proline 0 C--O 1.251 1.158 0 N-CA-C 104.124 -2.547 . . . . 0.0 104.124 177.903 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.652 ' HD2' HG13 ' A' ' 78' ' ' ILE . 8.8 Cg_endo -71.87 134.26 23.33 Favored 'Trans proline' 0 C--O 1.262 1.723 0 N-CA-C 102.216 -3.801 . . . . 0.0 102.216 169.35 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 93.6 m -42.76 -40.1 2.69 Favored 'General case' 0 C--N 1.311 -1.084 0 O-C-N 124.9 1.375 . . . . 0.0 114.119 173.646 -69.979 -41.686 95.787 103.394 2.056 104.149 83.685 62.47 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 60.3 p -57.64 -35.48 70.56 Favored 'General case' 0 C--O 1.252 1.192 0 CA-C-N 113.564 -1.653 . . . . 0.0 111.66 -175.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -54.77 -25.3 27.05 Favored 'General case' 0 C--O 1.253 1.271 0 O-C-N 125.668 1.855 . . . . 0.0 113.51 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.487 HD13 HD12 ' A' ' 58' ' ' ILE . 68.9 mt -86.15 -6.54 58.98 Favored 'General case' 0 C--O 1.251 1.149 0 O-C-N 125.386 1.679 . . . . 0.0 110.066 -170.569 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 42.7 mt -99.64 -2.53 35.27 Favored 'General case' 0 C--O 1.254 1.318 0 N-CA-C 117.438 2.384 . . . . 0.0 117.438 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.93 159.24 35.05 Favored 'General case' 0 C--O 1.258 1.55 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 -176.129 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 24.8 m -66.64 -16.21 64.03 Favored 'General case' 0 C--O 1.256 1.441 0 N-CA-C 117.744 2.498 . . . . 0.0 117.744 177.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.605 ' OD1' ' OG1' ' A' ' 89' ' ' THR . 8.6 t70 -96.05 127.36 41.99 Favored 'General case' 0 C--O 1.246 0.869 0 N-CA-C 104.597 -2.371 . . . . 0.0 104.597 170.979 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 31.5 pt -90.79 6.32 5.04 Favored 'Isoleucine or valine' 0 C--O 1.241 0.623 0 N-CA-C 115.75 1.759 . . . . 0.0 115.75 -175.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' THR . . . . . 0.605 ' OG1' ' OD1' ' A' ' 87' ' ' ASP . 75.2 m -54.71 -51.07 66.73 Favored 'General case' 0 C--O 1.259 1.579 0 CA-C-N 113.813 -1.54 . . . . 0.0 111.779 -173.236 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.0 85.69 Favored 'General case' 0 C--O 1.253 1.271 0 CA-C-N 114.214 -1.357 . . . . 0.0 113.396 178.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 57.9 m -69.38 -41.53 76.39 Favored 'General case' 0 C--N 1.312 -1.031 0 O-C-N 125.279 1.612 . . . . 0.0 114.933 -179.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.85 -58.28 8.28 Favored 'Isoleucine or valine' 0 C--O 1.257 1.45 0 CA-C-N 114.217 -1.356 . . . . 0.0 109.049 172.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -44.02 -43.93 7.04 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 114.23 -1.35 . . . . 0.0 110.748 -179.526 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.556 ' SG ' HD13 ' A' ' 58' ' ' ILE . 48.5 t -79.65 -37.11 36.71 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-N 114.016 -1.447 . . . . 0.0 111.099 -175.134 -177.476 44.79 71.45 105.968 2.153 105.906 143.085 -25.902 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.66 -27.53 69.28 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-N 114.127 -1.397 . . . . 0.0 113.494 177.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.489 ' O ' HG12 ' A' ' 99' ' ' VAL . 11.1 mttp -67.02 -43.88 81.71 Favored 'General case' 0 C--O 1.25 1.116 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 -179.829 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.731 ' O ' ' OD1' ' A' ' 101' ' ' ASP . 1.3 mttt -61.52 -38.74 88.49 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-N 113.667 -1.606 . . . . 0.0 113.861 178.683 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.54 HG21 ' CZ3' ' A' ' 108' ' ' TRP . 4.5 mt -71.83 -54.48 16.76 Favored 'Isoleucine or valine' 0 C--O 1.251 1.141 0 N-CA-C 102.594 -3.113 . . . . 0.0 102.594 -168.798 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.489 HG12 ' O ' ' A' ' 96' ' ' LYS . 2.6 p -61.12 -26.21 38.51 Favored 'Isoleucine or valine' 0 C--O 1.252 1.192 0 N-CA-C 119.7 3.222 . . . . 0.0 119.7 -177.974 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 50.6 m -82.6 -17.26 45.39 Favored 'General case' 0 C--O 1.248 0.977 1 N-CA-C 122.799 4.37 . . . . 0.0 122.799 172.848 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.731 ' OD1' ' O ' ' A' ' 97' ' ' LYS . 67.5 m-20 -61.59 -52.2 65.39 Favored 'General case' 0 C--O 1.25 1.091 0 CA-C-N 113.803 -1.544 . . . . 0.0 109.919 -171.524 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -176.99 -29.67 0.04 OUTLIER Glycine 0 N--CA 1.477 1.413 1 N-CA-C 128.779 6.272 . . . . 0.0 128.779 177.026 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.658 ' O ' ' HB2' ' A' ' 106' ' ' ASN . 19.1 m120 -100.01 5.92 45.09 Favored 'General case' 0 C--O 1.252 1.227 0 N-CA-C 120.214 3.413 . . . . 0.0 120.214 -179.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 58.79 -148.35 39.15 Favored Glycine 0 CA--C 1.539 1.564 0 N-CA-C 104.177 -3.569 . . . . 0.0 104.177 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 17.1 mtp -78.16 11.57 2.27 Favored 'General case' 0 C--O 1.247 0.945 0 O-C-N 125.307 1.239 . . . . 0.0 113.599 -176.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.658 ' HB2' ' O ' ' A' ' 103' ' ' ASN . 10.6 m120 -73.38 -19.6 60.96 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 104.239 -2.504 . . . . 0.0 104.239 177.536 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.79 -14.41 59.0 Favored 'General case' 0 C--O 1.257 1.448 0 CA-C-N 114.28 -1.327 . . . . 0.0 107.889 -177.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' TRP . . . . . 0.795 ' NE1' ' O ' ' A' ' 56' ' ' LEU . 1.9 m-90 -112.51 100.43 8.74 Favored 'General case' 0 C--O 1.251 1.158 0 CA-C-N 113.937 -1.483 . . . . 0.0 111.428 -179.256 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.585 HG13 ' N ' ' A' ' 110' ' ' ALA . 14.9 p -37.11 -56.16 0.23 Allowed 'Isoleucine or valine' 0 C--O 1.25 1.131 0 CA-C-N 114.11 -1.404 . . . . 0.0 112.851 -178.514 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.677 ' O ' ' HG3' ' A' ' 114' ' ' ARG . . . -60.33 -32.03 70.86 Favored 'General case' 0 C--O 1.251 1.164 1 N-CA-C 122.429 4.233 . . . . 0.0 122.429 -178.566 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.946 ' HE1' HD22 ' A' ' 27' ' ' ASN . 71.7 t90 -69.56 -50.03 48.67 Favored 'General case' 0 C--O 1.26 1.613 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 176.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -55.28 -47.68 75.17 Favored 'General case' 0 C--O 1.254 1.33 0 N-CA-C 115.965 1.839 . . . . 0.0 115.965 -179.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -83.98 -25.52 29.95 Favored 'General case' 0 C--O 1.257 1.479 1 N-CA-C 122.268 4.173 . . . . 0.0 122.268 178.026 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.677 ' HG3' ' O ' ' A' ' 110' ' ' ALA . 0.1 OUTLIER -125.09 2.03 7.93 Favored 'General case' 0 C--O 1.253 1.25 1 N-CA-C 123.089 4.478 . . . . 0.0 123.089 -179.229 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 84.7 m -130.88 -57.62 1.03 Allowed 'General case' 0 C--O 1.257 1.494 0 CA-C-N 113.866 -1.515 . . . . 0.0 109.298 -171.974 -67.399 -72.44 -100.054 106.53 1.992 105.807 -86.913 -179.603 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.582 ' HD2' ' CZ3' ' A' ' 111' ' ' TRP . 34.7 tttt -40.43 114.06 0.42 Allowed 'General case' 0 C--O 1.254 1.315 0 O-C-N 125.396 1.685 . . . . 0.0 114.551 172.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 81.47 31.8 32.67 Favored Glycine 0 N--CA 1.472 1.06 0 N-CA-C 119.173 2.429 . . . . 0.0 119.173 173.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . 0.273 13.7 p -130.27 172.61 11.63 Favored 'General case' 0 C--O 1.259 1.592 1 N-CA-C 89.752 -7.87 . . . . 0.0 89.752 -171.427 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . 1.333 ' OD2' ' NH1' ' A' ' 125' ' ' ARG . 0.0 OUTLIER -94.75 95.16 8.54 Favored 'General case' 0 C--N 1.319 -0.752 1 N-CA-C 98.207 -4.738 . . . . 0.0 98.207 -173.746 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 21.2 m -78.08 -17.62 13.85 Favored 'Isoleucine or valine' 0 C--O 1.253 1.273 0 N-CA-C 115.783 1.771 . . . . 0.0 115.783 -176.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.618 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 67.5 mt-30 -59.92 -18.65 46.64 Favored 'General case' 0 C--O 1.249 1.036 0 O-C-N 124.969 1.418 . . . . 0.0 112.871 174.831 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ALA . . . . . 1.277 ' HA ' ' CD ' ' A' ' 125' ' ' ARG . . . -65.98 -14.86 62.37 Favored 'General case' 0 C--O 1.251 1.179 0 CA-C-N 114.486 -1.234 . . . . 0.0 113.357 178.919 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' TRP . . . . . 1.143 ' O ' ' NH2' ' A' ' 5' ' ' ARG . 82.0 m95 -83.54 -25.03 31.36 Favored 'General case' 0 C--O 1.249 1.061 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 179.42 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 7.8 pt -107.94 13.68 8.37 Favored 'Isoleucine or valine' 0 C--O 1.26 1.636 0 N-CA-C 117.839 2.533 . . . . 0.0 117.839 171.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ARG . . . . . 1.333 ' NH1' ' OD2' ' A' ' 119' ' ' ASP . 51.5 mtt180 -71.55 137.67 48.24 Favored 'General case' 0 C--O 1.253 1.265 1 N-CA-C 96.606 -5.331 . . . . 0.0 96.606 177.658 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 96.5 -21.0 48.06 Favored Glycine 0 N--CA 1.474 1.171 0 N-CA-C 118.14 2.016 . . . . 0.0 118.14 178.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . 0.375 4.0 m -78.74 140.73 38.24 Favored 'General case' 0 C--O 1.254 1.297 1 N-CA-C 122.215 4.154 . . . . 0.0 122.215 -175.769 -40.311 -57.023 -81.768 111.089 2.15 106.012 -47.293 -72.75 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 24.6 mtt180 -86.6 118.04 25.76 Favored 'General case' 0 C--N 1.317 -0.818 1 N-CA-C 93.124 -6.621 . . . . 0.0 93.124 174.952 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 29.0 mt . . . . . 0 C--O 1.255 1.372 1 N-CA-C 99.813 -4.143 . . . . 0.0 99.813 -175.87 . . . . . . . . 1 1 . 1 stop_ save_