data_3hqc_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 3hqc _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A 1264 ' ' SER . . . . . . . . . . . . . 68.6 m . . . . . 0 N--CA 1.499 1.994 0 N-CA-C 108.661 -0.866 . . . . 47.399999999999999 108.661 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1265 ' ' THR . . . . . . . . . . . . . 18.2 p -77.01 160.95 28.73 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 114.528 -1.214 . . . . 48.560000000000002 111.138 175.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1266 ' ' ALA . . . . . . . . . . . . . . . -52.11 -54.43 30.58 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.36 -0.837 . . . . 48.57 111.078 -178.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1267 ' ' ALA . . . . . . . . . . . . . . . -66.77 -36.83 83.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.218 -0.446 . . . . 50.5 111.026 -172.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1268 ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.21 -45.45 69.85 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.358 -0.537 . . . . 59.740000000000002 111.031 177.362 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1269 ' ' LEU . . . . . . . . . . . . . 6.6 mt -55.48 -49.43 72.54 Favored 'General case' 0 CA--C 1.497 -1.087 0 CA-C-O 121.258 0.552 . . . . 46.329999999999998 110.053 175.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 77.2 mt -61.91 -35.15 77.52 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 119.38 -0.928 . . . . 45.280000000000001 109.384 -173.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1271 ' ' ARG . . . . . . . . . . . . . 72.0 mtp85 -64.74 -28.82 69.84 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.366 0.876 . . . . 54.390000000000001 113.366 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1272 ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -69.0 -15.53 63.5 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 123.53 0.519 . . . . 39.719999999999999 112.014 177.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1273 ' ' GLY . . . . . . . . . . . . . . . 65.52 -157.35 47.71 Favored Glycine 0 N--CA 1.461 0.303 0 N-CA-C 115.703 1.041 . . . . 31.23 115.703 174.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1274 ' ' ALA . . . . . . . . . . . . . . . -121.96 137.15 54.9 Favored 'General case' 0 C--O 1.249 1.047 0 CA-C-N 114.884 -0.658 . . . . 25.989999999999998 109.649 -171.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1275 ' ' ALA . . . . . . . . . . . . . . . -127.19 143.8 51.18 Favored 'General case' 0 C--O 1.239 0.551 0 O-C-N 124.177 0.923 . . . . 25.559999999999999 111.214 175.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1276 ' ' CYS . . . . . . . . . . . . . 22.9 p -155.34 175.1 14.31 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.984 -0.376 . . . . 31.280000000000001 109.984 174.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1277 ' ' SER . . . . . . . . . . . . . 73.0 m -91.1 140.49 29.77 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 123.691 0.619 . . . . 30.989999999999998 110.473 177.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1278 ' ' VAL . . . . . . . . . . . . . 34.1 m -143.88 163.97 14.96 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 123.704 0.802 . . . . 27.09 108.94 176.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1279 ' ' LEU . . . . . . . . . . . . . 57.0 mt -89.08 133.2 34.45 Favored 'General case' 0 CA--C 1.5 -0.979 0 N-CA-C 107.045 -1.465 . . . . 33.25 107.045 174.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1280 ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -95.32 108.3 20.46 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 108.882 -0.785 . . . . 32.140000000000001 108.882 176.715 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1281 ' ' LEU . . . . . . . . . . . . . 74.6 mt -82.43 -54.55 5.12 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 119.875 -0.73 . . . . 25.609999999999999 112.831 -170.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1282 ' ' THR . . . . . . . . . . . . . 11.0 t -169.36 171.97 7.48 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.154 -0.476 . . . . 30.0 111.283 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1283 ' ' SER . . . . . . . . . . . . . 98.9 p -134.46 135.53 42.56 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 114.018 -1.446 . . . . 26.960000000000001 108.525 170.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1284 ' ' VAL . . . . . . . . . . . . . 34.5 m -136.27 135.25 49.84 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-O 122.18 0.991 . . . . 28.32 111.246 -179.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1285 ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -69.35 137.79 53.19 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.208 -0.905 . . . . 39.280000000000001 109.014 177.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 50.5 p -139.26 68.13 1.38 Allowed 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.118 -0.492 . . . . 39.359999999999999 112.122 -172.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1287 ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -78.79 144.11 35.42 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.006 1.113 . . . . 45.159999999999997 114.006 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1288 ' ' SER . . . . . . . . . . . . . 6.0 m 57.45 28.64 15.75 Favored 'General case' 0 C--O 1.247 0.941 0 N-CA-C 113.472 0.916 . . . . 43.409999999999997 113.472 173.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1289 ' ' LEU . . . . . . . . . . . . . 56.3 mt -112.14 149.77 31.71 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 108.407 -0.96 . . . . 37.960000000000001 108.407 174.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1290 ' ' THR . . . . . . . . . . . . . 44.9 p -66.0 165.51 13.17 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 107.797 -1.186 . . . . 33.109999999999999 107.797 170.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -56.03 -54.21 37.0 Favored Glycine 0 N--CA 1.471 0.972 0 N-CA-C 111.236 -0.746 . . . . 27.84 111.236 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -57.52 -38.26 94.52 Favored 'Trans proline' 0 C--N 1.356 0.932 0 N-CA-C 114.838 1.053 . . . . 27.879999999999999 114.838 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1293 ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -61.76 -39.75 92.72 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-N 118.606 0.639 . . . . 28.059999999999999 112.069 174.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1294 ' ' ALA . . . . . . . . . . . . . . . -61.07 -50.97 71.15 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-O 121.404 0.621 . . . . 24.09 111.699 178.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1295 ' ' VAL . . . . . . . . . . . . . 95.1 t -62.43 -41.45 91.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 C-N-CA 120.222 -0.591 . . . . 25.949999999999999 110.236 178.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1296 ' ' ALA . . . . . . . . . . . . . . . -61.03 -39.12 88.56 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 120.038 -0.665 . . . . 24.550000000000001 112.136 178.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1297 ' ' ARG . . . . . 0.42 ' NH1' ' O ' ' A' ' 34' ' ' HOH . 3.9 tpm_? -62.48 -47.64 83.08 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-O 121.151 0.5 . . . . 51.82 110.781 179.292 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1298 ' ' ALA . . . . . . . . . . . . . . . -60.49 -45.82 92.35 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.4 0.619 . . . . 24.620000000000001 112.368 178.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1299 ' ' SER . . . . . . . . . . . . . 68.6 m -61.86 -39.18 90.96 Favored 'General case' 0 N--CA 1.439 -1.004 0 O-C-N 121.233 -0.917 . . . . 26.309999999999999 111.903 178.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1300 ' ' SER . . . . . . . . . . . . . 58.1 m -61.28 -42.92 99.46 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 120.884 -0.326 . . . . 26.690000000000001 111.113 178.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -62.91 -47.06 84.9 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 123.327 0.651 . . . . 30.760000000000002 110.642 178.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1302 ' ' ALA . . . . . . . . . . . . . . . -64.33 -41.31 96.86 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 121.021 -0.271 . . . . 31.98 111.482 -178.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1303 ' ' LEU . . . . . . . . . . . . . 56.0 mt -76.55 -17.4 59.25 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.076 0.769 . . . . 37.649999999999999 113.076 -177.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1304 ' ' SER . . . . . . . . . . . . . 75.1 m -92.86 -14.83 27.17 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 112.862 0.69 . . . . 43.490000000000002 112.862 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1305 ' ' CYS . . . . . 0.432 ' SG ' ' N ' ' A' 1306 ' ' SER . 46.3 t -69.58 165.51 20.95 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.132 0.79 . . . . 48.329999999999998 113.132 -175.79 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1306 ' ' SER . . . . . 0.432 ' N ' ' SG ' ' A' 1305 ' ' CYS . 45.2 t . . . . . 0 CA--C 1.507 -0.683 0 CA-C-N 116.007 -0.542 . . . . 53.619999999999997 109.976 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1310 ' ' THR . . . . . . . . . . . . . 46.6 m . . . . . 0 CA--C 1.536 0.433 0 CA-C-O 118.485 -0.769 . . . . 47.609999999999999 109.558 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1311 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -61.43 148.99 91.57 Favored 'Trans proline' 0 C--N 1.363 1.307 0 C-N-CA 121.611 1.54 . . . . 40.020000000000003 112.136 178.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1312 ' ' ALA . . . . . . . . . . . . . . . -80.67 145.2 31.74 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.038 -0.356 . . . . 33.609999999999999 110.038 179.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1313 ' ' VAL . . . . . . . . . . . . . 83.4 t -83.27 125.4 40.08 Favored 'Isoleucine or valine' 0 C--O 1.256 1.411 0 N-CA-C 106.88 -1.526 . . . . 30.760000000000002 106.88 165.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1314 ' ' VAL . . . . . . . . . . . . . 28.3 m -121.55 156.73 25.56 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 CA-C-O 121.477 0.656 . . . . 28.289999999999999 111.697 177.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1315 ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -84.98 126.95 33.95 Favored 'General case' 0 C--O 1.251 1.163 0 N-CA-C 107.064 -1.458 . . . . 33.159999999999997 107.064 172.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1316 ' ' PHE . . . . . . . . . . . . . 17.9 t80 -120.98 110.71 16.6 Favored 'General case' 0 C--O 1.249 1.045 0 C-N-CA 124.477 1.111 . . . . 28.920000000000002 108.715 -171.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1317 ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -112.96 130.92 55.95 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-N 116.347 -0.388 . . . . 35.82 111.479 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1318 ' ' VAL . . . . . . . . . . . . . 57.9 t -120.84 124.98 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.467 -0.938 . . . . 27.079999999999998 108.467 173.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1319 ' ' SER . . . . . . . . . . . . . 52.4 p -144.08 -178.3 5.88 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 122.383 1.087 . . . . 31.91 111.259 -177.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -53.81 -29.45 40.6 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 114.56 -1.2 . . . . 35.490000000000002 111.538 172.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1321 ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -85.82 -3.54 58.94 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 114.326 1.232 . . . . 51.439999999999998 114.326 -177.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1322 ' ' GLY . . . . . . . . . . . . . . . 115.43 -146.08 18.78 Favored Glycine 0 C--O 1.249 1.035 0 CA-C-O 119.946 -0.363 . . . . 31.27 112.858 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1323 ' ' ILE . . . . . . . . . . . . . 96.0 mt -114.86 133.64 60.39 Favored 'Isoleucine or valine' 0 C--O 1.248 0.995 0 CA-C-O 120.659 0.266 . . . . 25.48 111.024 -179.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1324 ' ' THR . . . . . . . . . . . . . 24.8 m -123.9 128.31 49.27 Favored 'General case' 0 C--O 1.248 0.994 0 N-CA-C 109.799 -0.445 . . . . 24.829999999999998 109.799 174.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1325 ' ' LEU . . . . . . . . . . . . . 43.1 mt -113.57 127.76 56.19 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 125.169 1.543 . . . . 24.719999999999999 108.055 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1326 ' ' THR . . . . . . . . . . . . . 43.8 p -138.48 156.39 47.58 Favored 'General case' 0 C--O 1.255 1.358 0 CA-C-O 121.339 0.59 . . . . 27.140000000000001 111.776 176.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 51.1 t0 -155.59 140.28 17.04 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 106.43 -1.693 . . . . 36.07 106.43 174.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1328 ' ' ASN . . . . . 0.403 ' ND2' ' O ' ' A' 1332 ' ' LEU . 16.7 p-10 -132.81 138.3 47.05 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.435 0.636 . . . . 38.869999999999997 110.804 173.537 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1329 ' ' GLN . . . . . . . . . . . . . . . -131.89 105.93 7.76 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 105.256 -2.128 . . . . 44.75 105.256 174.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1330 ' ' ARG . . . . . . . . . . . . . . . 60.82 -117.79 0.75 Allowed 'General case' 0 C--O 1.237 0.413 0 N-CA-C 107.617 -1.253 . . . . 48.130000000000003 107.617 -170.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . . . -104.62 4.49 32.8 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 111.933 0.346 . . . . 46.93 111.933 -179.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1332 ' ' LEU . . . . . 0.403 ' O ' ' ND2' ' A' 1328 ' ' ASN . 92.1 mt -80.92 139.04 36.1 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 109.111 -0.7 . . . . 47.850000000000001 109.111 170.321 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1333 ' ' PHE . . . . . . . . . . . . . 28.7 t80 -139.58 128.88 24.04 Favored 'General case' 0 N--CA 1.463 0.187 0 O-C-N 123.652 0.595 . . . . 34.25 111.987 -169.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 53.8 t80 -110.21 136.48 49.36 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.504 -0.771 . . . . 26.870000000000001 109.074 170.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1335 ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -153.22 133.33 13.37 Favored 'General case' 0 C--O 1.244 0.791 0 N-CA-C 113.219 0.822 . . . . 26.41 113.219 172.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1336 ' ' ARG . . . . . . . . . . . . . 78.2 mmt-85 -139.44 138.24 36.3 Favored 'General case' 0 C--O 1.248 1.003 0 N-CA-C 108.543 -0.91 . . . . 31.940000000000001 108.543 168.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1337 ' ' HIS . . . . . . . . . . . . . 85.4 t60 -118.44 138.51 52.42 Favored 'General case' 0 N--CA 1.419 -1.98 0 C-N-CA 123.818 0.847 . . . . 28.059999999999999 109.659 175.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1338 ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -121.62 104.21 39.95 Favored Pre-proline 0 C--O 1.259 1.574 0 N-CA-C 106.997 -1.483 . . . . 28.789999999999999 106.997 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1339 ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -61.67 154.6 59.11 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 O-C-N 122.774 0.881 . . . . 28.469999999999999 112.42 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1340 ' ' VAL . . . . . . . . . . . . . 9.7 p -47.7 -48.19 11.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 N-CA-C 113.733 1.012 . . . . 31.170000000000002 113.733 -177.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1341 ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -72.23 -6.38 42.57 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.382 0.882 . . . . 36.409999999999997 113.382 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1342 ' ' SER . . . . . . . . . . . . . 24.7 p -92.02 -15.53 27.75 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 115.23 1.567 . . . . 30.149999999999999 115.23 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1343 ' ' ILE . . . . . . . . . . . . . 51.6 mt -90.99 121.96 41.9 Favored 'Isoleucine or valine' 0 C--O 1.251 1.161 0 O-C-N 124.17 0.919 . . . . 29.170000000000002 108.612 -173.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1344 ' ' THR . . . . . . . . . . . . . 81.4 p -109.0 -13.71 14.68 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 114.979 1.474 . . . . 31.949999999999999 114.979 -173.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1345 ' ' PHE . . . . . . . . . . . . . 71.7 t80 -170.74 147.57 2.81 Favored 'General case' 0 CA--C 1.501 -0.933 0 O-C-N 123.159 0.287 . . . . 28.219999999999999 111.736 -174.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1346 ' ' SER . . . . . . . . . . . . . 9.9 p -148.07 145.0 28.26 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 123.851 0.719 . . . . 29.760000000000002 111.522 164.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1347 ' ' SER . . . . . . . . . . . . . 51.8 p -163.87 163.83 23.63 Favored 'General case' 0 CA--C 1.499 -1.01 0 CA-C-N 115.631 -0.713 . . . . 29.300000000000001 110.401 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1348 ' ' THR . . . . . . . . . . . . . 55.0 p -73.89 168.1 20.13 Favored 'General case' 0 C--O 1.254 1.332 0 N-CA-C 105.94 -1.874 . . . . 25.989999999999998 105.94 166.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1349 ' ' ASP . . . . . . . . . . . . . 34.6 t70 -59.39 125.47 79.3 Favored Pre-proline 0 N--CA 1.484 1.238 0 N-CA-C 108.529 -0.915 . . . . 30.02 108.529 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1350 ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -70.6 -10.27 27.54 Favored 'Trans proline' 0 C--N 1.35 0.627 0 N-CA-C 115.094 1.152 . . . . 28.75 115.094 -177.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1351 ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -99.44 7.52 45.37 Favored 'General case' 0 C--O 1.25 1.099 0 N-CA-C 114.025 1.12 . . . . 29.98 114.025 173.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1352 ' ' ASP . . . . . . . . . . . . . 52.5 m-20 58.48 27.61 15.78 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.884 0.874 . . . . 46.259999999999998 113.229 179.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1353 ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -75.99 144.37 40.95 Favored 'General case' 0 C--O 1.259 1.585 0 N-CA-C 109.762 -0.459 . . . . 29.620000000000001 109.762 175.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1354 ' ' ARG . . . . . . . . . . . . . 22.0 mmt180 -116.66 161.43 19.22 Favored 'General case' 0 C--O 1.244 0.791 0 O-C-N 124.317 1.011 . . . . 41.649999999999999 111.329 -176.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1355 ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -93.42 134.52 35.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.002 -0.999 . . . . 29.050000000000001 109.306 174.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1356 ' ' THR . . . . . . . . . . . . . 61.3 m -99.83 113.82 26.59 Favored 'General case' 0 C--O 1.253 1.241 0 N-CA-C 109.297 -0.631 . . . . 26.780000000000001 109.297 179.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1357 ' ' ASN . . . . . . . . . . . . . 30.6 m120 -71.8 162.61 72.31 Favored Pre-proline 0 CA--C 1.543 0.696 0 CA-C-N 113.811 -1.541 . . . . 34.039999999999999 111.804 -177.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1358 ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -53.78 -30.67 58.07 Favored 'Trans proline' 0 C--O 1.251 1.136 0 N-CA-C 115.507 1.311 . . . . 31.780000000000001 115.507 179.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1359 ' ' ASP . . . . . . . . . . . . . 47.0 p30 -81.07 4.64 19.15 Favored 'General case' 0 C--O 1.248 0.987 0 N-CA-C 115.42 1.637 . . . . 41.039999999999999 115.42 175.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1360 ' ' GLY . . . . . . . . . . . . . . . 84.93 -4.98 84.31 Favored Glycine 0 C--O 1.214 -1.11 0 N-CA-C 115.739 1.056 . . . . 29.030000000000001 115.739 176.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1361 ' ' THR . . . . . . . . . . . . . 62.9 p -80.02 161.77 25.23 Favored 'General case' 0 C--O 1.217 -0.632 0 N-CA-C 109.298 -0.63 . . . . 29.550000000000001 109.298 175.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1362 ' ' THR . . . . . . . . . . . . . 70.8 p -110.8 154.04 24.52 Favored 'General case' 0 C--O 1.249 1.059 0 C-N-CA 120.743 -0.383 . . . . 31.039999999999999 111.755 -177.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1363 ' ' SER . . . . . . . . . . . . . 40.2 m -133.55 139.84 46.83 Favored 'General case' 0 C--O 1.251 1.159 0 O-C-N 124.057 0.848 . . . . 30.010000000000002 109.437 179.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1364 ' ' LYS . . . . . . . . . . . . . . . -63.12 143.87 57.41 Favored 'General case' 0 C--O 1.251 1.149 0 CA-C-N 115.95 -0.568 . . . . 25.370000000000001 110.91 176.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1365 ' ' ILE . . . . . . . . . . . . . 55.6 mt -106.34 137.53 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 CA-C-N 114.153 -1.385 . . . . 25.27 109.453 -179.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1366 ' ' PHE . . . . . . . . . . . . . 27.7 p90 -143.62 160.02 41.41 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 121.069 0.461 . . . . 28.649999999999999 110.027 172.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1367 ' ' GLY . . . . . . . . . . . . . . . -146.4 169.51 27.65 Favored Glycine 0 CA--C 1.494 -1.264 0 C-N-CA 120.534 -0.841 . . . . 23.219999999999999 112.557 175.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1368 ' ' PHE . . . . . . . . . . . . . 50.1 p90 -135.09 155.38 50.83 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 108.174 -1.047 . . . . 24.379999999999999 108.174 166.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1369 ' ' VAL . . . . . . . . . . . . . 44.5 t -111.09 131.79 61.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 0 O-C-N 125.534 1.771 . . . . 23.890000000000001 107.138 178.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1370 ' ' ALA . . . . . . . . . . . . . . . -145.75 156.48 43.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.984 -0.553 . . . . 27.710000000000001 111.16 177.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1371 ' ' LYS . . . . . . . . . . . . . 68.1 mmtt -60.82 141.99 56.52 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 115.988 -0.551 . . . . 42.200000000000003 111.238 168.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1372 ' ' LYS . . . . . 0.497 ' NZ ' ' O1 ' ' A' ' 3' ' ' SO4 . 46.4 tttm -78.62 117.56 67.18 Favored Pre-proline 0 C--O 1.247 0.952 0 O-C-N 121.805 -0.559 . . . . 37.659999999999997 109.683 178.621 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1373 ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -46.09 -45.02 18.59 Favored 'Trans proline' 0 C--N 1.359 1.128 0 C-N-CA 121.81 1.673 . . . . 41.619999999999997 114.887 -173.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1374 ' ' GLY . . . . . . . . . . . . . . . -97.7 5.98 62.42 Favored Glycine 0 N--CA 1.477 1.387 0 N-CA-C 117.82 1.888 . . . . 39.509999999999998 117.82 178.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1375 ' ' SER . . . . . . . . . . . . . 19.7 m -145.29 67.52 13.13 Favored Pre-proline 0 N--CA 1.493 1.719 0 N-CA-C 106.657 -1.609 . . . . 38.899999999999999 106.657 171.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1376 ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -58.08 -22.13 54.29 Favored 'Trans proline' 0 N--CA 1.488 1.173 1 C-N-CA 126.178 4.585 . . . . 39.310000000000002 117.605 -166.731 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1377 ' ' TRP . . . . . . . . . . . . . 47.4 p90 -71.37 -18.44 62.36 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.678 0.791 . . . . 37.649999999999999 109.471 174.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1378 ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -91.45 133.34 35.57 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.338 0.866 . . . . 41.630000000000003 113.338 -176.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1379 ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -99.86 128.24 45.97 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 107.211 -1.403 . . . . 38.770000000000003 107.211 172.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1380 ' ' VAL . . . . . . . . . . . . . 96.8 t -130.79 134.12 62.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 N-CA-C 108.648 -0.871 . . . . 26.870000000000001 108.648 -174.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1381 ' ' CYS . . . . . . . . . . . . . 47.3 t -98.58 124.82 43.58 Favored 'General case' 0 C--O 1.256 1.425 0 O-C-N 124.115 0.884 . . . . 27.620000000000001 108.939 177.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1382 ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -104.46 124.07 48.59 Favored 'General case' 0 C--O 1.251 1.136 0 N-CA-C 107.383 -1.34 . . . . 26.030000000000001 107.383 179.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1383 ' ' LEU . . . . . . . . . . . . . 10.8 tp -117.43 138.82 51.58 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 124.206 0.941 . . . . 23.449999999999999 112.274 -170.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1384 ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -136.82 161.63 35.45 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 115.236 -0.893 . . . . 24.34 112.111 -173.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1385 ' ' ALA . . . . . . . . . . . . . . . -123.15 147.27 46.99 Favored 'General case' 0 C--O 1.243 0.736 0 O-C-N 124.058 0.849 . . . . 25.309999999999999 110.181 165.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1386 ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -64.84 149.84 48.72 Favored 'General case' 0 C--O 1.25 1.119 0 CA-C-N 113.493 -1.685 . . . . 34.539999999999999 110.578 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1387 ' ' LEU . . . . . . . . . . . . . 20.2 mt -117.16 -26.53 6.76 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-O 119.494 -0.288 . . . . 39.350000000000001 111.073 172.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1388 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.89 123.3 22.73 Favored Pre-proline 0 CA--C 1.553 1.082 0 N-CA-C 108.657 -0.868 . . . . 45.460000000000001 108.657 -171.436 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1389 ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.13 -16.04 52.72 Favored 'Trans proline' 0 C--N 1.368 1.574 0 C-N-CA 118.378 -0.615 . . . . 41.560000000000002 112.913 177.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1390 ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -92.55 -7.62 46.68 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.525 0.935 . . . . 50.259999999999998 113.525 178.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1391 ' ' GLN . . . . . . . . . . . . . 92.1 mm-40 -127.85 72.44 78.71 Favored Pre-proline 0 N--CA 1.474 0.773 0 N-CA-C 105.751 -1.944 . . . . 38.219999999999999 105.751 164.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1392 ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -81.29 160.6 20.12 Favored 'Trans proline' 0 N--CA 1.446 -1.276 0 C-N-CA 121.149 1.233 . . . . 32.770000000000003 113.721 -168.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1393 ' ' ALA . . . . . . . . . . . . . . . -52.32 -43.09 64.34 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.208 -0.906 . . . . 30.109999999999999 112.256 -178.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1394 ' ' GLY . . . . . . . . . . . . . . . -61.38 -39.41 97.23 Favored Glycine 0 CA--C 1.537 1.467 0 CA-C-N 118.095 0.407 . . . . 30.34 113.505 -177.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1395 ' ' ALA . . . . . . . . . . . . . . . -65.76 -42.21 91.17 Favored 'General case' 0 C--O 1.256 1.423 0 CA-C-O 121.019 0.438 . . . . 29.760000000000002 110.551 177.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1396 ' ' ILE . . . . . . . . . . . . . 68.0 mt -64.04 -44.75 97.84 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.451 0 N-CA-C 108.213 -1.032 . . . . 28.280000000000001 108.213 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1397 ' ' VAL . . . . . . . . . . . . . 48.5 t -58.13 -44.19 86.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 120.366 -0.534 . . . . 27.440000000000001 110.578 176.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1398 ' ' THR . . . . . . . . . . . . . 79.1 m -63.25 -39.48 94.72 Favored 'General case' 0 C--O 1.248 1.023 0 CA-C-O 121.511 0.672 . . . . 29.82 111.737 178.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1399 ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -63.77 -41.94 97.88 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 120.288 -0.565 . . . . 35.810000000000002 112.018 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1400 ' ' ILE . . . . . . . . . . . . . 96.1 mt -62.26 -43.9 98.51 Favored 'Isoleucine or valine' 0 C--O 1.244 0.788 0 O-C-N 121.17 -0.956 . . . . 32.189999999999998 109.891 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1401 ' ' THR . . . . . . . . . . . . . 13.3 t -60.0 -39.57 86.21 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 119.626 -0.83 . . . . 35.0 110.191 -176.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1402 ' ' LYS . . . . . . . . . . . . . . . -63.92 -45.28 89.99 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 111.794 0.294 . . . . 40.920000000000002 111.794 175.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1403 ' ' VAL . . . . . . . . . . . . . 27.0 m -74.44 -21.99 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 120.433 -0.507 . . . . 46.950000000000003 111.511 -178.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1404 ' ' MSE . . . . . . . . . . . . . 93.9 mtp -68.46 -48.89 63.33 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 109.307 -0.627 . . . . 51.520000000000003 109.307 166.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1405 ' ' LEU . . . . . . . . . . . . . 20.5 tp -58.71 -44.6 90.41 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.397 0.679 . . . . 56.619999999999997 111.81 -179.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1406 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.29 0 N-CA-C 109.995 -1.242 . . . . 58.210000000000001 109.995 169.983 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' SO4 . . . . . 0.4 ' O1 ' ' NZ ' ' A' 1372 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' SO4 . . . . . 0.497 ' O1 ' ' NZ ' ' A' 1372 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1418 ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1419 ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1420 ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' HOH . . . . . 0.42 ' O ' ' NH1' ' A' 1297 ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1421 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1422 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1423 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1264 ' ' SER . . . . . . . . . . . . . 68.6 m . . . . . 0 N--CA 1.499 1.994 0 N-CA-C 108.661 -0.866 . . . . 47.4 108.661 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1265 ' ' THR . . . . . . . . . . . . . 18.2 p -77.01 160.95 28.73 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 114.528 -1.214 . . . . 48.56 111.138 175.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1266 ' ' ALA . . . . . . . . . . . . . . . -52.11 -54.43 30.58 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.36 -0.837 . . . . 48.57 111.078 -178.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1267 ' ' ALA . . . . . . . . . . . . . . . -66.77 -36.83 83.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.218 -0.446 . . . . 50.5 111.026 -172.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1268 ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.21 -45.45 69.85 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.358 -0.537 . . . . 59.74 111.031 177.362 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1269 ' ' LEU . . . . . . . . . . . . . 6.6 mt -55.48 -49.43 72.54 Favored 'General case' 0 CA--C 1.497 -1.087 0 CA-C-O 121.258 0.552 . . . . 46.33 110.053 175.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 77.2 mt -61.91 -35.15 77.52 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 119.38 -0.928 . . . . 45.28 109.384 -173.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1271 ' ' ARG . . . . . . . . . . . . . 72.0 mtp85 -64.74 -28.82 69.84 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.366 0.876 . . . . 54.39 113.366 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1272 ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -69.0 -15.53 63.5 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 123.53 0.519 . . . . 39.72 112.014 177.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1273 ' ' GLY . . . . . . . . . . . . . . . 65.52 -157.35 47.71 Favored Glycine 0 N--CA 1.461 0.303 0 N-CA-C 115.703 1.041 . . . . 31.23 115.703 174.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1274 ' ' ALA . . . . . . . . . . . . . . . -121.96 137.15 54.9 Favored 'General case' 0 C--O 1.249 1.047 0 CA-C-N 114.884 -0.658 . . . . 25.99 109.649 -171.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1275 ' ' ALA . . . . . . . . . . . . . . . -127.19 143.8 51.18 Favored 'General case' 0 C--O 1.239 0.551 0 O-C-N 124.177 0.923 . . . . 25.56 111.214 175.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1276 ' ' CYS . . . . . . . . . . . . . 22.9 p -155.34 175.1 14.31 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.984 -0.376 . . . . 31.28 109.984 174.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1277 ' ' SER . . . . . . . . . . . . . 73.0 m -91.1 140.49 29.77 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 123.691 0.619 . . . . 30.99 110.473 177.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1278 ' ' VAL . . . . . . . . . . . . . 34.1 m -143.88 163.97 14.96 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 123.704 0.802 . . . . 27.09 108.94 176.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1279 ' ' LEU . . . . . . . . . . . . . 57.0 mt -89.08 133.2 34.45 Favored 'General case' 0 CA--C 1.5 -0.979 0 N-CA-C 107.045 -1.465 . . . . 33.25 107.045 174.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1280 ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -95.32 108.3 20.46 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 108.882 -0.785 . . . . 32.14 108.882 176.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1281 ' ' LEU . . . . . . . . . . . . . 74.6 mt -82.43 -54.55 5.12 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 119.875 -0.73 . . . . 25.61 112.831 -170.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1282 ' ' THR . . . . . . . . . . . . . 11.0 t -169.36 171.97 7.48 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.154 -0.476 . . . . 30.0 111.283 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1283 ' ' SER . . . . . . . . . . . . . 98.9 p -134.46 135.53 42.56 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 114.018 -1.446 . . . . 31.88 108.525 170.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1284 ' ' VAL . . . . . . . . . . . . . 34.5 m -136.27 135.25 49.84 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-O 122.18 0.991 . . . . 28.32 111.246 -179.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1285 ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -69.35 137.79 53.19 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.208 -0.905 . . . . 39.28 109.014 177.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 50.5 p -139.26 68.13 1.38 Allowed 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.118 -0.492 . . . . 39.36 112.122 -172.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1287 ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -78.79 144.11 35.42 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.006 1.113 . . . . 45.16 114.006 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1288 ' ' SER . . . . . . . . . . . . . 6.0 m 57.45 28.64 15.75 Favored 'General case' 0 C--O 1.247 0.941 0 N-CA-C 113.472 0.916 . . . . 43.41 113.472 173.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1289 ' ' LEU . . . . . . . . . . . . . 56.3 mt -112.14 149.77 31.71 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 108.407 -0.96 . . . . 37.96 108.407 174.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1290 ' ' THR . . . . . . . . . . . . . 44.9 p -66.0 165.51 13.17 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 107.797 -1.186 . . . . 33.11 107.797 170.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -56.03 -54.21 37.0 Favored Glycine 0 N--CA 1.471 0.972 0 N-CA-C 111.236 -0.746 . . . . 27.84 111.236 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -57.52 -38.26 94.52 Favored 'Trans proline' 0 C--N 1.356 0.932 0 N-CA-C 114.838 1.053 . . . . 27.88 114.838 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1293 ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -61.76 -39.75 92.72 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-N 118.606 0.639 . . . . 28.06 112.069 174.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1294 ' ' ALA . . . . . . . . . . . . . . . -61.07 -50.97 71.15 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-O 121.404 0.621 . . . . 24.09 111.699 178.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1295 ' ' VAL . . . . . . . . . . . . . 95.1 t -62.43 -41.45 91.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 C-N-CA 120.222 -0.591 . . . . 25.95 110.236 178.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1296 ' ' ALA . . . . . . . . . . . . . . . -61.03 -39.12 88.56 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 120.038 -0.665 . . . . 24.55 112.136 178.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1297 ' ' ARG . . . . . 0.42 ' NH1' ' O ' ' A' ' 34' ' ' HOH . 3.9 tpm_? -62.48 -47.64 83.08 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-O 121.151 0.5 . . . . 51.82 110.781 179.292 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1298 ' ' ALA . . . . . . . . . . . . . . . -60.49 -45.82 92.35 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.4 0.619 . . . . 24.62 112.368 178.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1299 ' ' SER . . . . . . . . . . . . . 68.6 m -61.86 -39.18 90.96 Favored 'General case' 0 N--CA 1.439 -1.004 0 O-C-N 121.233 -0.917 . . . . 26.31 111.903 178.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1300 ' ' SER . . . . . . . . . . . . . 58.1 m -61.28 -42.92 99.46 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 120.884 -0.326 . . . . 26.69 111.113 178.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -62.91 -47.06 84.9 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 123.327 0.651 . . . . 30.76 110.642 178.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1302 ' ' ALA . . . . . . . . . . . . . . . -64.33 -41.31 96.86 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 121.021 -0.271 . . . . 31.98 111.482 -178.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1303 ' ' LEU . . . . . . . . . . . . . 56.0 mt -76.55 -17.4 59.25 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.076 0.769 . . . . 37.65 113.076 -177.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1304 ' ' SER . . . . . . . . . . . . . 75.1 m -92.86 -14.83 27.17 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 112.862 0.69 . . . . 43.49 112.862 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1305 ' ' CYS . . . . . 0.432 ' SG ' ' N ' ' A' 1306 ' ' SER . 46.3 t -69.58 165.51 20.95 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.132 0.79 . . . . 49.17 113.132 -175.79 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1306 ' ' SER . . . . . 0.432 ' N ' ' SG ' ' A' 1305 ' ' CYS . 45.2 t . . . . . 0 CA--C 1.507 -0.683 0 CA-C-N 116.007 -0.542 . . . . 53.62 109.976 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1310 ' ' THR . . . . . . . . . . . . . 46.6 m . . . . . 0 CA--C 1.536 0.433 0 CA-C-O 118.485 -0.769 . . . . 47.61 109.558 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1311 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -61.43 148.99 91.57 Favored 'Trans proline' 0 C--N 1.363 1.307 0 C-N-CA 121.611 1.54 . . . . 40.02 112.136 178.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1312 ' ' ALA . . . . . . . . . . . . . . . -80.67 145.2 31.74 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.038 -0.356 . . . . 33.61 110.038 179.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1313 ' ' VAL . . . . . . . . . . . . . 83.4 t -83.27 125.4 40.08 Favored 'Isoleucine or valine' 0 C--O 1.256 1.411 0 N-CA-C 106.88 -1.526 . . . . 30.76 106.88 165.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1314 ' ' VAL . . . . . . . . . . . . . 28.3 m -121.55 156.73 25.56 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 CA-C-O 121.477 0.656 . . . . 28.29 111.697 177.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1315 ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -84.98 126.95 33.95 Favored 'General case' 0 C--O 1.251 1.163 0 N-CA-C 107.064 -1.458 . . . . 33.16 107.064 172.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1316 ' ' PHE . . . . . . . . . . . . . 17.9 t80 -120.98 110.71 16.6 Favored 'General case' 0 C--O 1.249 1.045 0 C-N-CA 124.477 1.111 . . . . 28.92 108.715 -171.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1317 ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -112.96 130.92 55.95 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-N 116.347 -0.388 . . . . 35.82 111.479 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1318 ' ' VAL . . . . . . . . . . . . . 57.9 t -120.84 124.98 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.467 -0.938 . . . . 27.08 108.467 173.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1319 ' ' SER . . . . . . . . . . . . . 52.4 p -144.08 -178.3 5.88 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 122.383 1.087 . . . . 31.91 111.259 -177.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -53.81 -29.45 40.6 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 114.56 -1.2 . . . . 35.49 111.538 172.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1321 ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -85.82 -3.54 58.94 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 114.326 1.232 . . . . 51.44 114.326 -177.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1322 ' ' GLY . . . . . . . . . . . . . . . 115.43 -146.08 18.78 Favored Glycine 0 C--O 1.249 1.035 0 CA-C-O 119.946 -0.363 . . . . 31.27 112.858 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1323 ' ' ILE . . . . . . . . . . . . . 96.0 mt -114.86 133.64 60.39 Favored 'Isoleucine or valine' 0 C--O 1.248 0.995 0 CA-C-O 120.659 0.266 . . . . 25.48 111.024 -179.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1324 ' ' THR . . . . . . . . . . . . . 24.8 m -123.9 128.31 49.27 Favored 'General case' 0 C--O 1.248 0.994 0 N-CA-C 109.799 -0.445 . . . . 24.83 109.799 174.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1325 ' ' LEU . . . . . . . . . . . . . 43.1 mt -113.57 127.76 56.19 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 125.169 1.543 . . . . 24.72 108.055 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1326 ' ' THR . . . . . . . . . . . . . 43.8 p -138.48 156.39 47.58 Favored 'General case' 0 C--O 1.255 1.358 0 CA-C-O 121.339 0.59 . . . . 27.14 111.776 176.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 51.1 t0 -155.59 140.28 17.04 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 106.43 -1.693 . . . . 36.07 106.43 174.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1328 ' ' ASN . . . . . . . . . . . . . 16.7 p-10 -132.81 138.3 47.05 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.435 0.636 . . . . 38.87 110.804 173.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1329 ' ' GLN . . . . . . . . . . . . . . . -131.89 105.93 7.76 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 105.256 -2.128 . . . . 44.75 105.256 174.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1330 ' ' ARG . . . . . . . . . . . . . . . 60.82 -117.79 0.75 Allowed 'General case' 0 C--O 1.237 0.413 0 N-CA-C 107.617 -1.253 . . . . 48.13 107.617 -170.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . . . -104.62 4.49 32.8 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 111.933 0.346 . . . . 46.93 111.933 -179.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1332 ' ' LEU . . . . . . . . . . . . . 92.1 mt -80.92 139.04 36.1 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 109.111 -0.7 . . . . 47.85 109.111 170.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1333 ' ' PHE . . . . . . . . . . . . . 28.7 t80 -139.58 128.88 24.04 Favored 'General case' 0 N--CA 1.463 0.187 0 O-C-N 123.652 0.595 . . . . 34.25 111.987 -169.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 53.8 t80 -110.21 136.48 49.36 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.504 -0.771 . . . . 26.87 109.074 170.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1335 ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -153.22 133.33 13.37 Favored 'General case' 0 C--O 1.244 0.791 0 N-CA-C 113.219 0.822 . . . . 26.41 113.219 172.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1336 ' ' ARG . . . . . . . . . . . . . 78.2 mmt-85 -139.44 138.24 36.3 Favored 'General case' 0 C--O 1.248 1.003 0 N-CA-C 108.543 -0.91 . . . . 31.94 108.543 168.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1337 ' ' HIS . . . . . . . . . . . . . 85.4 t60 -118.44 138.51 52.42 Favored 'General case' 0 N--CA 1.419 -1.98 0 C-N-CA 123.818 0.847 . . . . 28.06 109.659 175.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1338 ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -121.62 104.21 39.95 Favored Pre-proline 0 C--O 1.259 1.574 0 N-CA-C 106.997 -1.483 . . . . 28.79 106.997 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1339 ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -61.67 154.6 59.11 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 O-C-N 122.774 0.881 . . . . 28.47 112.42 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1340 ' ' VAL . . . . . 0.544 HG21 ' O ' ' A' 1403 ' ' VAL . 9.7 p -47.7 -48.19 11.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 N-CA-C 113.733 1.012 . . . . 31.17 113.733 -177.265 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1341 ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -72.23 -6.38 42.57 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.382 0.882 . . . . 36.41 113.382 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1342 ' ' SER . . . . . . . . . . . . . 24.7 p -92.02 -15.53 27.75 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 115.23 1.567 . . . . 30.15 115.23 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1343 ' ' ILE . . . . . . . . . . . . . 51.6 mt -90.99 121.96 41.9 Favored 'Isoleucine or valine' 0 C--O 1.251 1.161 0 O-C-N 124.17 0.919 . . . . 29.17 108.612 -173.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1344 ' ' THR . . . . . . . . . . . . . 81.4 p -109.0 -13.71 14.68 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 114.979 1.474 . . . . 31.95 114.979 -173.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1345 ' ' PHE . . . . . . . . . . . . . 71.7 t80 -170.74 147.57 2.81 Favored 'General case' 0 CA--C 1.501 -0.933 0 O-C-N 123.159 0.287 . . . . 28.22 111.736 -174.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1346 ' ' SER . . . . . . . . . . . . . 9.9 p -148.07 145.0 28.26 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 123.851 0.719 . . . . 29.76 111.522 164.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1347 ' ' SER . . . . . . . . . . . . . 51.8 p -163.87 163.83 23.63 Favored 'General case' 0 CA--C 1.499 -1.01 0 CA-C-N 115.631 -0.713 . . . . 29.3 110.401 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1348 ' ' THR . . . . . . . . . . . . . 55.0 p -73.89 168.1 20.13 Favored 'General case' 0 C--O 1.254 1.332 0 N-CA-C 105.94 -1.874 . . . . 25.99 105.94 166.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1349 ' ' ASP . . . . . . . . . . . . . 34.6 t70 -59.39 125.47 79.3 Favored Pre-proline 0 N--CA 1.484 1.238 0 N-CA-C 108.529 -0.915 . . . . 30.02 108.529 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1350 ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -70.6 -10.27 27.54 Favored 'Trans proline' 0 C--N 1.35 0.627 0 N-CA-C 115.094 1.152 . . . . 28.75 115.094 -177.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1351 ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -99.44 7.52 45.37 Favored 'General case' 0 C--O 1.25 1.099 0 N-CA-C 114.025 1.12 . . . . 29.98 114.025 173.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1352 ' ' ASP . . . . . . . . . . . . . 52.5 m-20 58.48 27.61 15.78 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.884 0.874 . . . . 46.26 113.229 179.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1353 ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -75.99 144.37 40.95 Favored 'General case' 0 C--O 1.259 1.585 0 N-CA-C 109.762 -0.459 . . . . 29.62 109.762 175.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1354 ' ' ARG . . . . . . . . . . . . . 22.0 mmt180 -116.66 161.43 19.22 Favored 'General case' 0 C--O 1.244 0.791 0 O-C-N 124.317 1.011 . . . . 41.65 111.329 -176.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1355 ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -93.42 134.52 35.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.002 -0.999 . . . . 29.05 109.306 174.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1356 ' ' THR . . . . . . . . . . . . . 61.3 m -99.83 113.82 26.59 Favored 'General case' 0 C--O 1.253 1.241 0 N-CA-C 109.297 -0.631 . . . . 26.78 109.297 179.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1357 ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -71.8 162.61 72.31 Favored Pre-proline 0 CA--C 1.543 0.696 0 CA-C-N 113.811 -1.541 . . . . 34.04 111.804 -177.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1358 ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -53.78 -30.67 58.07 Favored 'Trans proline' 0 C--O 1.251 1.136 0 N-CA-C 115.507 1.311 . . . . 31.78 115.507 179.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1359 ' ' ASP . . . . . . . . . . . . . 47.0 p30 -81.07 4.64 19.15 Favored 'General case' 0 C--O 1.248 0.987 0 N-CA-C 115.42 1.637 . . . . 41.04 115.42 175.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1360 ' ' GLY . . . . . . . . . . . . . . . 84.93 -4.98 84.31 Favored Glycine 0 C--O 1.214 -1.11 0 N-CA-C 115.739 1.056 . . . . 29.03 115.739 176.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1361 ' ' THR . . . . . . . . . . . . . 62.9 p -80.02 161.77 25.23 Favored 'General case' 0 C--O 1.217 -0.632 0 N-CA-C 109.298 -0.63 . . . . 29.55 109.298 175.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1362 ' ' THR . . . . . . . . . . . . . 70.8 p -110.8 154.04 24.52 Favored 'General case' 0 C--O 1.249 1.059 0 C-N-CA 120.743 -0.383 . . . . 31.04 111.755 -177.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1363 ' ' SER . . . . . . . . . . . . . 40.2 m -133.55 139.84 46.83 Favored 'General case' 0 C--O 1.251 1.159 0 O-C-N 124.057 0.848 . . . . 30.01 109.437 179.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1364 ' ' LYS . . . . . . . . . . . . . . . -63.12 143.87 57.41 Favored 'General case' 0 C--O 1.251 1.149 0 CA-C-N 115.95 -0.568 . . . . 25.37 110.91 176.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1365 ' ' ILE . . . . . . . . . . . . . 55.6 mt -106.34 137.53 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 CA-C-N 114.153 -1.385 . . . . 25.27 109.453 -179.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1366 ' ' PHE . . . . . . . . . . . . . 27.7 p90 -143.62 160.02 41.41 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 121.069 0.461 . . . . 28.65 110.027 172.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1367 ' ' GLY . . . . . . . . . . . . . . . -146.4 169.51 27.65 Favored Glycine 0 CA--C 1.494 -1.264 0 C-N-CA 120.534 -0.841 . . . . 23.22 112.557 175.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1368 ' ' PHE . . . . . . . . . . . . . 50.1 p90 -135.09 155.38 50.83 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 108.174 -1.047 . . . . 24.38 108.174 166.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1369 ' ' VAL . . . . . . . . . . . . . 44.5 t -111.09 131.79 61.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 0 O-C-N 125.534 1.771 . . . . 23.89 107.138 178.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1370 ' ' ALA . . . . . . . . . . . . . . . -145.75 156.48 43.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.984 -0.553 . . . . 27.71 111.16 177.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1371 ' ' LYS . . . . . . . . . . . . . 68.1 mmtt -60.82 141.99 56.52 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 115.988 -0.551 . . . . 42.2 111.238 168.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1372 ' ' LYS . . . . . 0.484 ' NZ ' ' O1 ' ' A' ' 3' ' ' SO4 . 46.4 tttm -78.62 117.56 67.18 Favored Pre-proline 0 C--O 1.247 0.952 0 O-C-N 121.805 -0.559 . . . . 37.66 109.683 178.621 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1373 ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -46.09 -45.02 18.59 Favored 'Trans proline' 0 C--N 1.359 1.128 0 C-N-CA 121.81 1.673 . . . . 41.62 114.887 -173.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1374 ' ' GLY . . . . . . . . . . . . . . . -97.7 5.98 62.42 Favored Glycine 0 N--CA 1.477 1.387 0 N-CA-C 117.82 1.888 . . . . 39.51 117.82 178.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1375 ' ' SER . . . . . . . . . . . . . 19.7 m -145.29 67.52 13.13 Favored Pre-proline 0 N--CA 1.493 1.719 0 N-CA-C 106.657 -1.609 . . . . 38.9 106.657 171.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1376 ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -58.08 -22.13 54.29 Favored 'Trans proline' 0 N--CA 1.488 1.173 1 C-N-CA 126.178 4.585 . . . . 39.31 117.605 -166.731 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1377 ' ' TRP . . . . . . . . . . . . . 47.4 p90 -71.37 -18.44 62.36 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.678 0.791 . . . . 37.65 109.471 174.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1378 ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -91.45 133.34 35.57 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.338 0.866 . . . . 41.63 113.338 -176.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1379 ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -99.86 128.24 45.97 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 107.211 -1.403 . . . . 38.77 107.211 172.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1380 ' ' VAL . . . . . . . . . . . . . 96.8 t -130.79 134.12 62.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 N-CA-C 108.648 -0.871 . . . . 26.87 108.648 -174.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1381 ' ' CYS . . . . . . . . . . . . . 47.3 t -98.58 124.82 43.58 Favored 'General case' 0 C--O 1.256 1.425 0 O-C-N 124.115 0.884 . . . . 27.62 108.939 177.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1382 ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -104.46 124.07 48.59 Favored 'General case' 0 C--O 1.251 1.136 0 N-CA-C 107.383 -1.34 . . . . 26.03 107.383 179.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1383 ' ' LEU . . . . . . . . . . . . . 10.8 tp -117.43 138.82 51.58 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 124.206 0.941 . . . . 23.45 112.274 -170.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1384 ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -136.82 161.63 35.45 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 115.236 -0.893 . . . . 24.34 112.111 -173.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1385 ' ' ALA . . . . . . . . . . . . . . . -123.15 147.27 46.99 Favored 'General case' 0 C--O 1.243 0.736 0 O-C-N 124.058 0.849 . . . . 25.31 110.181 165.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1386 ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -64.84 149.84 48.72 Favored 'General case' 0 C--O 1.25 1.119 0 CA-C-N 113.493 -1.685 . . . . 34.54 110.578 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1387 ' ' LEU . . . . . 0.438 HD23 ' O ' ' A' ' 19' ' ' HOH . 20.2 mt -117.16 -26.53 6.76 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-O 119.494 -0.288 . . . . 39.35 111.073 172.827 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1388 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.89 123.3 22.73 Favored Pre-proline 0 CA--C 1.553 1.082 0 N-CA-C 108.657 -0.868 . . . . 45.46 108.657 -171.436 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1389 ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.13 -16.04 52.72 Favored 'Trans proline' 0 C--N 1.368 1.574 0 C-N-CA 118.378 -0.615 . . . . 41.56 112.913 177.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1390 ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -92.55 -7.62 46.68 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.525 0.935 . . . . 50.26 113.525 178.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1391 ' ' GLN . . . . . . . . . . . . . 92.1 mm-40 -127.85 72.44 78.71 Favored Pre-proline 0 N--CA 1.474 0.773 0 N-CA-C 105.751 -1.944 . . . . 38.22 105.751 164.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1392 ' ' PRO . . . . . 1.022 ' HB2' ' H2 ' ' A' 1420 ' ' GOL . 55.1 Cg_endo -81.29 160.6 20.12 Favored 'Trans proline' 0 N--CA 1.446 -1.276 0 C-N-CA 121.149 1.233 . . . . 32.77 113.721 -168.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1393 ' ' ALA . . . . . . . . . . . . . . . -52.32 -43.09 64.34 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.208 -0.906 . . . . 30.11 112.256 -178.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1394 ' ' GLY . . . . . 0.582 ' O ' HG23 ' A' 1398 ' ' THR . . . -61.38 -39.41 97.23 Favored Glycine 0 CA--C 1.537 1.467 0 CA-C-N 118.095 0.407 . . . . 30.34 113.505 -177.946 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1395 ' ' ALA . . . . . . . . . . . . . . . -65.76 -42.21 91.17 Favored 'General case' 0 C--O 1.256 1.423 0 CA-C-O 121.019 0.438 . . . . 29.76 110.551 177.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1396 ' ' ILE . . . . . . . . . . . . . 68.0 mt -64.04 -44.75 97.84 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.451 0 N-CA-C 108.213 -1.032 . . . . 28.28 108.213 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1397 ' ' VAL . . . . . . . . . . . . . 48.5 t -58.13 -44.19 86.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 120.366 -0.534 . . . . 27.44 110.578 176.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1398 ' ' THR . . . . . 0.582 HG23 ' O ' ' A' 1394 ' ' GLY . 79.1 m -63.25 -39.48 94.72 Favored 'General case' 0 C--O 1.248 1.023 0 CA-C-O 121.511 0.672 . . . . 31.93 111.737 178.158 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1399 ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -63.77 -41.94 97.88 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 120.288 -0.565 . . . . 35.81 112.018 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1400 ' ' ILE . . . . . . . . . . . . . 96.1 mt -62.26 -43.9 98.51 Favored 'Isoleucine or valine' 0 C--O 1.244 0.788 0 O-C-N 121.17 -0.956 . . . . 32.19 109.891 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1401 ' ' THR . . . . . 0.579 HG23 ' O ' ' A' ' 60' ' ' HOH . 13.3 t -60.0 -39.57 86.21 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 119.626 -0.83 . . . . 35.0 110.191 -176.586 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1402 ' ' LYS . . . . . . . . . . . . . . . -63.92 -45.28 89.99 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 111.794 0.294 . . . . 40.92 111.794 175.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1403 ' ' VAL . . . . . 0.544 ' O ' HG21 ' A' 1340 ' ' VAL . 27.0 m -74.44 -21.99 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 120.433 -0.507 . . . . 46.95 111.511 -178.306 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1404 ' ' MSE . . . . . . . . . . . . . 93.9 mtp -68.46 -48.89 63.33 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 109.307 -0.627 . . . . 51.52 109.307 166.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1405 ' ' LEU . . . . . . . . . . . . . 20.5 tp -58.71 -44.6 90.41 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.397 0.679 . . . . 56.62 111.81 -179.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1406 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.29 0 N-CA-C 109.995 -1.242 . . . . 58.21 109.995 169.983 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' SO4 . . . . . 0.484 ' O1 ' ' NZ ' ' A' 1372 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1418 ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1419 ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1420 ' ' GOL . . . . . 1.022 ' H2 ' ' HB2' ' A' 1392 ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' HOH . . . . . 0.438 ' O ' HD23 ' A' 1387 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 34' ' ' HOH . . . . . 0.42 ' O ' ' NH1' ' A' 1297 ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 60' ' ' HOH . . . . . 0.579 ' O ' HG23 ' A' 1401 ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1421 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1422 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1423 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1264 ' ' SER . . . . . . . . . . . . . 68.6 m . . . . . 0 N--CA 1.499 1.994 0 N-CA-C 108.661 -0.866 . . . . 47.4 108.661 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1265 ' ' THR . . . . . . . . . . . . . 18.2 p -77.01 160.95 28.73 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 114.528 -1.214 . . . . 48.56 111.138 175.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1266 ' ' ALA . . . . . . . . . . . . . . . -52.11 -54.43 30.58 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.36 -0.837 . . . . 48.57 111.078 -178.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1267 ' ' ALA . . . . . . . . . . . . . . . -66.77 -36.83 83.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.218 -0.446 . . . . 50.5 111.026 -172.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1268 ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.21 -45.45 69.85 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.358 -0.537 . . . . 59.74 111.031 177.362 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1269 ' ' LEU . . . . . . . . . . . . . 6.6 mt -55.48 -49.43 72.54 Favored 'General case' 0 CA--C 1.497 -1.087 0 CA-C-O 121.258 0.552 . . . . 46.33 110.053 175.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 77.2 mt -61.91 -35.15 77.52 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 119.38 -0.928 . . . . 45.28 109.384 -173.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1271 ' ' ARG . . . . . . . . . . . . . 72.0 mtp85 -64.74 -28.82 69.84 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.366 0.876 . . . . 54.39 113.366 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1272 ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -69.0 -15.53 63.5 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 123.53 0.519 . . . . 39.72 112.014 177.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1273 ' ' GLY . . . . . . . . . . . . . . . 65.52 -157.35 47.71 Favored Glycine 0 N--CA 1.461 0.303 0 N-CA-C 115.703 1.041 . . . . 31.23 115.703 174.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1274 ' ' ALA . . . . . . . . . . . . . . . -121.96 137.15 54.9 Favored 'General case' 0 C--O 1.249 1.047 0 CA-C-N 114.884 -0.658 . . . . 25.99 109.649 -171.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1275 ' ' ALA . . . . . . . . . . . . . . . -127.19 143.8 51.18 Favored 'General case' 0 C--O 1.239 0.551 0 O-C-N 124.177 0.923 . . . . 25.56 111.214 175.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1276 ' ' CYS . . . . . . . . . . . . . 22.9 p -155.34 175.1 14.31 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.984 -0.376 . . . . 31.28 109.984 174.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1277 ' ' SER . . . . . . . . . . . . . 73.0 m -91.1 140.49 29.77 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 123.691 0.619 . . . . 30.99 110.473 177.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1278 ' ' VAL . . . . . . . . . . . . . 34.1 m -143.88 163.97 14.96 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 123.704 0.802 . . . . 27.09 108.94 176.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1279 ' ' LEU . . . . . . . . . . . . . 57.0 mt -89.08 133.2 34.45 Favored 'General case' 0 CA--C 1.5 -0.979 0 N-CA-C 107.045 -1.465 . . . . 33.25 107.045 174.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1280 ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -95.32 108.3 20.46 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 108.882 -0.785 . . . . 32.14 108.882 176.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1281 ' ' LEU . . . . . . . . . . . . . 74.6 mt -82.43 -54.55 5.12 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 119.875 -0.73 . . . . 25.61 112.831 -170.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1282 ' ' THR . . . . . . . . . . . . . 11.0 t -169.36 171.97 7.48 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.154 -0.476 . . . . 30.0 111.283 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1283 ' ' SER . . . . . . . . . . . . . 98.9 p -134.46 135.53 42.56 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 114.018 -1.446 . . . . 31.88 108.525 170.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1284 ' ' VAL . . . . . . . . . . . . . 34.5 m -136.27 135.25 49.84 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-O 122.18 0.991 . . . . 28.32 111.246 -179.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1285 ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -69.35 137.79 53.19 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.208 -0.905 . . . . 39.28 109.014 177.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 50.5 p -139.26 68.13 1.38 Allowed 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.118 -0.492 . . . . 39.36 112.122 -172.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1287 ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -78.79 144.11 35.42 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.006 1.113 . . . . 45.16 114.006 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1288 ' ' SER . . . . . . . . . . . . . 6.0 m 57.45 28.64 15.75 Favored 'General case' 0 C--O 1.247 0.941 0 N-CA-C 113.472 0.916 . . . . 43.41 113.472 173.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1289 ' ' LEU . . . . . . . . . . . . . 56.3 mt -112.14 149.77 31.71 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 108.407 -0.96 . . . . 37.96 108.407 174.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1290 ' ' THR . . . . . . . . . . . . . 44.9 p -66.0 165.51 13.17 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 107.797 -1.186 . . . . 33.11 107.797 170.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -56.03 -54.21 37.0 Favored Glycine 0 N--CA 1.471 0.972 0 N-CA-C 111.236 -0.746 . . . . 27.84 111.236 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -57.52 -38.26 94.52 Favored 'Trans proline' 0 C--N 1.356 0.932 0 N-CA-C 114.838 1.053 . . . . 27.88 114.838 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1293 ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -61.76 -39.75 92.72 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-N 118.606 0.639 . . . . 28.06 112.069 174.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1294 ' ' ALA . . . . . . . . . . . . . . . -61.07 -50.97 71.15 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-O 121.404 0.621 . . . . 24.09 111.699 178.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1295 ' ' VAL . . . . . . . . . . . . . 95.1 t -62.43 -41.45 91.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 C-N-CA 120.222 -0.591 . . . . 25.95 110.236 178.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1296 ' ' ALA . . . . . . . . . . . . . . . -61.03 -39.12 88.56 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 120.038 -0.665 . . . . 24.55 112.136 178.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1297 ' ' ARG . . . . . 0.42 ' NH1' ' O ' ' A' ' 34' ' ' HOH . 3.9 tpm_? -62.48 -47.64 83.08 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-O 121.151 0.5 . . . . 51.82 110.781 179.292 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1298 ' ' ALA . . . . . . . . . . . . . . . -60.49 -45.82 92.35 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.4 0.619 . . . . 24.62 112.368 178.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1299 ' ' SER . . . . . . . . . . . . . 68.6 m -61.86 -39.18 90.96 Favored 'General case' 0 N--CA 1.439 -1.004 0 O-C-N 121.233 -0.917 . . . . 26.31 111.903 178.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1300 ' ' SER . . . . . . . . . . . . . 58.1 m -61.28 -42.92 99.46 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 120.884 -0.326 . . . . 26.69 111.113 178.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -62.91 -47.06 84.9 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 123.327 0.651 . . . . 30.76 110.642 178.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1302 ' ' ALA . . . . . . . . . . . . . . . -64.33 -41.31 96.86 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 121.021 -0.271 . . . . 31.98 111.482 -178.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1303 ' ' LEU . . . . . . . . . . . . . 56.0 mt -76.55 -17.4 59.25 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.076 0.769 . . . . 37.65 113.076 -177.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1304 ' ' SER . . . . . . . . . . . . . 75.1 m -92.86 -14.83 27.17 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 112.862 0.69 . . . . 43.49 112.862 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1305 ' ' CYS . . . . . 0.432 ' SG ' ' N ' ' A' 1306 ' ' SER . 46.3 t -69.58 165.51 20.95 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.132 0.79 . . . . 49.17 113.132 -175.79 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1306 ' ' SER . . . . . 0.432 ' N ' ' SG ' ' A' 1305 ' ' CYS . 45.2 t . . . . . 0 CA--C 1.507 -0.683 0 CA-C-N 116.007 -0.542 . . . . 53.62 109.976 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1310 ' ' THR . . . . . . . . . . . . . 46.6 m . . . . . 0 CA--C 1.536 0.433 0 CA-C-O 118.485 -0.769 . . . . 47.61 109.558 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1311 ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -61.43 148.99 91.57 Favored 'Trans proline' 0 C--N 1.363 1.307 0 C-N-CA 121.611 1.54 . . . . 40.02 112.136 178.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1312 ' ' ALA . . . . . . . . . . . . . . . -80.67 145.2 31.74 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.038 -0.356 . . . . 33.61 110.038 179.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1313 ' ' VAL . . . . . . . . . . . . . 83.4 t -83.27 125.4 40.08 Favored 'Isoleucine or valine' 0 C--O 1.256 1.411 0 N-CA-C 106.88 -1.526 . . . . 30.76 106.88 165.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1314 ' ' VAL . . . . . . . . . . . . . 28.3 m -121.55 156.73 25.56 Favored 'Isoleucine or valine' 0 C--O 1.243 0.723 0 CA-C-O 121.477 0.656 . . . . 28.29 111.697 177.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1315 ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -84.98 126.95 33.95 Favored 'General case' 0 C--O 1.251 1.163 0 N-CA-C 107.064 -1.458 . . . . 33.16 107.064 172.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1316 ' ' PHE . . . . . . . . . . . . . 17.9 t80 -120.98 110.71 16.6 Favored 'General case' 0 C--O 1.249 1.045 0 C-N-CA 124.477 1.111 . . . . 28.92 108.715 -171.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1317 ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -112.96 130.92 55.95 Favored 'General case' 0 C--O 1.255 1.36 0 CA-C-N 116.347 -0.388 . . . . 35.82 111.479 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1318 ' ' VAL . . . . . . . . . . . . . 57.9 t -120.84 124.98 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.467 -0.938 . . . . 27.08 108.467 173.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1319 ' ' SER . . . . . . . . . . . . . 52.4 p -144.08 -178.3 5.88 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 122.383 1.087 . . . . 31.91 111.259 -177.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -53.81 -29.45 40.6 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 114.56 -1.2 . . . . 35.49 111.538 172.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1321 ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -85.82 -3.54 58.94 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 114.326 1.232 . . . . 51.44 114.326 -177.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1322 ' ' GLY . . . . . . . . . . . . . . . 115.43 -146.08 18.78 Favored Glycine 0 C--O 1.249 1.035 0 CA-C-O 119.946 -0.363 . . . . 31.27 112.858 -177.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1323 ' ' ILE . . . . . . . . . . . . . 96.0 mt -114.86 133.64 60.39 Favored 'Isoleucine or valine' 0 C--O 1.248 0.995 0 CA-C-O 120.659 0.266 . . . . 25.48 111.024 -179.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1324 ' ' THR . . . . . . . . . . . . . 24.8 m -123.9 128.31 49.27 Favored 'General case' 0 C--O 1.248 0.994 0 N-CA-C 109.799 -0.445 . . . . 24.83 109.799 174.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1325 ' ' LEU . . . . . . . . . . . . . 43.1 mt -113.57 127.76 56.19 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 125.169 1.543 . . . . 24.72 108.055 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1326 ' ' THR . . . . . . . . . . . . . 43.8 p -138.48 156.39 47.58 Favored 'General case' 0 C--O 1.255 1.358 0 CA-C-O 121.339 0.59 . . . . 27.14 111.776 176.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 51.1 t0 -155.59 140.28 17.04 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 106.43 -1.693 . . . . 36.07 106.43 174.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1328 ' ' ASN . . . . . . . . . . . . . 16.7 p-10 -132.81 138.3 47.05 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.435 0.636 . . . . 38.87 110.804 173.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1329 ' ' GLN . . . . . . . . . . . . . . . -131.89 105.93 7.76 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 105.256 -2.128 . . . . 44.75 105.256 174.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1330 ' ' ARG . . . . . . . . . . . . . . . 60.82 -117.79 0.75 Allowed 'General case' 0 C--O 1.237 0.413 0 N-CA-C 107.617 -1.253 . . . . 48.13 107.617 -170.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . . . -104.62 4.49 32.8 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 111.933 0.346 . . . . 46.93 111.933 -179.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1332 ' ' LEU . . . . . . . . . . . . . 92.1 mt -80.92 139.04 36.1 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 109.111 -0.7 . . . . 47.85 109.111 170.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1333 ' ' PHE . . . . . . . . . . . . . 28.7 t80 -139.58 128.88 24.04 Favored 'General case' 0 N--CA 1.463 0.187 0 O-C-N 123.652 0.595 . . . . 34.25 111.987 -169.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 53.8 t80 -110.21 136.48 49.36 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.504 -0.771 . . . . 26.87 109.074 170.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1335 ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -153.22 133.33 13.37 Favored 'General case' 0 C--O 1.244 0.791 0 N-CA-C 113.219 0.822 . . . . 26.41 113.219 172.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1336 ' ' ARG . . . . . . . . . . . . . 78.2 mmt-85 -139.44 138.24 36.3 Favored 'General case' 0 C--O 1.248 1.003 0 N-CA-C 108.543 -0.91 . . . . 31.94 108.543 168.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1337 ' ' HIS . . . . . . . . . . . . . 85.4 t60 -118.44 138.51 52.42 Favored 'General case' 0 N--CA 1.419 -1.98 0 C-N-CA 123.818 0.847 . . . . 28.06 109.659 175.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1338 ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -121.62 104.21 39.95 Favored Pre-proline 0 C--O 1.259 1.574 0 N-CA-C 106.997 -1.483 . . . . 28.79 106.997 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1339 ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -61.67 154.6 59.11 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 O-C-N 122.774 0.881 . . . . 28.47 112.42 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1340 ' ' VAL . . . . . 0.544 HG21 ' O ' ' A' 1403 ' ' VAL . 9.7 p -47.7 -48.19 11.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 N-CA-C 113.733 1.012 . . . . 31.17 113.733 -177.265 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1341 ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -72.23 -6.38 42.57 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.382 0.882 . . . . 36.41 113.382 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1342 ' ' SER . . . . . . . . . . . . . 24.7 p -92.02 -15.53 27.75 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 115.23 1.567 . . . . 30.15 115.23 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1343 ' ' ILE . . . . . . . . . . . . . 51.6 mt -90.99 121.96 41.9 Favored 'Isoleucine or valine' 0 C--O 1.251 1.161 0 O-C-N 124.17 0.919 . . . . 29.17 108.612 -173.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1344 ' ' THR . . . . . . . . . . . . . 81.4 p -109.0 -13.71 14.68 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 114.979 1.474 . . . . 31.95 114.979 -173.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1345 ' ' PHE . . . . . . . . . . . . . 71.7 t80 -170.74 147.57 2.81 Favored 'General case' 0 CA--C 1.501 -0.933 0 O-C-N 123.159 0.287 . . . . 28.22 111.736 -174.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1346 ' ' SER . . . . . . . . . . . . . 9.9 p -148.07 145.0 28.26 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 123.851 0.719 . . . . 29.76 111.522 164.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1347 ' ' SER . . . . . . . . . . . . . 51.8 p -163.87 163.83 23.63 Favored 'General case' 0 CA--C 1.499 -1.01 0 CA-C-N 115.631 -0.713 . . . . 29.3 110.401 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1348 ' ' THR . . . . . . . . . . . . . 55.0 p -73.89 168.1 20.13 Favored 'General case' 0 C--O 1.254 1.332 0 N-CA-C 105.94 -1.874 . . . . 25.99 105.94 166.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1349 ' ' ASP . . . . . . . . . . . . . 34.6 t70 -59.39 125.47 79.3 Favored Pre-proline 0 N--CA 1.484 1.238 0 N-CA-C 108.529 -0.915 . . . . 30.02 108.529 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1350 ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -70.6 -10.27 27.54 Favored 'Trans proline' 0 C--N 1.35 0.627 0 N-CA-C 115.094 1.152 . . . . 28.75 115.094 -177.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1351 ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -99.44 7.52 45.37 Favored 'General case' 0 C--O 1.25 1.099 0 N-CA-C 114.025 1.12 . . . . 29.98 114.025 173.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1352 ' ' ASP . . . . . . . . . . . . . 52.5 m-20 58.48 27.61 15.78 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.884 0.874 . . . . 46.26 113.229 179.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1353 ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -75.99 144.37 40.95 Favored 'General case' 0 C--O 1.259 1.585 0 N-CA-C 109.762 -0.459 . . . . 29.62 109.762 175.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1354 ' ' ARG . . . . . . . . . . . . . 22.0 mmt180 -116.66 161.43 19.22 Favored 'General case' 0 C--O 1.244 0.791 0 O-C-N 124.317 1.011 . . . . 41.65 111.329 -176.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1355 ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -93.42 134.52 35.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.002 -0.999 . . . . 29.05 109.306 174.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1356 ' ' THR . . . . . . . . . . . . . 61.3 m -99.83 113.82 26.59 Favored 'General case' 0 C--O 1.253 1.241 0 N-CA-C 109.297 -0.631 . . . . 26.78 109.297 179.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1357 ' ' ASN . . . . . . . . . . . . . 30.6 m120 -71.8 162.61 72.31 Favored Pre-proline 0 CA--C 1.543 0.696 0 CA-C-N 113.811 -1.541 . . . . 34.04 111.804 -177.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1358 ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -53.78 -30.67 58.07 Favored 'Trans proline' 0 C--O 1.251 1.136 0 N-CA-C 115.507 1.311 . . . . 31.78 115.507 179.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1359 ' ' ASP . . . . . . . . . . . . . 47.0 p30 -81.07 4.64 19.15 Favored 'General case' 0 C--O 1.248 0.987 0 N-CA-C 115.42 1.637 . . . . 41.04 115.42 175.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1360 ' ' GLY . . . . . . . . . . . . . . . 84.93 -4.98 84.31 Favored Glycine 0 C--O 1.214 -1.11 0 N-CA-C 115.739 1.056 . . . . 29.03 115.739 176.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1361 ' ' THR . . . . . . . . . . . . . 62.9 p -80.02 161.77 25.23 Favored 'General case' 0 C--O 1.217 -0.632 0 N-CA-C 109.298 -0.63 . . . . 29.55 109.298 175.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1362 ' ' THR . . . . . . . . . . . . . 70.8 p -110.8 154.04 24.52 Favored 'General case' 0 C--O 1.249 1.059 0 C-N-CA 120.743 -0.383 . . . . 31.04 111.755 -177.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1363 ' ' SER . . . . . . . . . . . . . 40.2 m -133.55 139.84 46.83 Favored 'General case' 0 C--O 1.251 1.159 0 O-C-N 124.057 0.848 . . . . 30.01 109.437 179.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1364 ' ' LYS . . . . . . . . . . . . . . . -63.12 143.87 57.41 Favored 'General case' 0 C--O 1.251 1.149 0 CA-C-N 115.95 -0.568 . . . . 25.37 110.91 176.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1365 ' ' ILE . . . . . . . . . . . . . 55.6 mt -106.34 137.53 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 CA-C-N 114.153 -1.385 . . . . 25.27 109.453 -179.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1366 ' ' PHE . . . . . . . . . . . . . 27.7 p90 -143.62 160.02 41.41 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 121.069 0.461 . . . . 28.65 110.027 172.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1367 ' ' GLY . . . . . . . . . . . . . . . -146.4 169.51 27.65 Favored Glycine 0 CA--C 1.494 -1.264 0 C-N-CA 120.534 -0.841 . . . . 23.22 112.557 175.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1368 ' ' PHE . . . . . . . . . . . . . 50.1 p90 -135.09 155.38 50.83 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 108.174 -1.047 . . . . 24.38 108.174 166.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1369 ' ' VAL . . . . . . . . . . . . . 44.5 t -111.09 131.79 61.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 0 O-C-N 125.534 1.771 . . . . 23.89 107.138 178.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1370 ' ' ALA . . . . . . . . . . . . . . . -145.75 156.48 43.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.984 -0.553 . . . . 27.71 111.16 177.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1371 ' ' LYS . . . . . . . . . . . . . 68.1 mmtt -60.82 141.99 56.52 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 115.988 -0.551 . . . . 42.2 111.238 168.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1372 ' ' LYS . . . . . 0.484 ' NZ ' ' O1 ' ' A' ' 3' ' ' SO4 . 46.4 tttm -78.62 117.56 67.18 Favored Pre-proline 0 C--O 1.247 0.952 0 O-C-N 121.805 -0.559 . . . . 37.66 109.683 178.621 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1373 ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -46.09 -45.02 18.59 Favored 'Trans proline' 0 C--N 1.359 1.128 0 C-N-CA 121.81 1.673 . . . . 41.62 114.887 -173.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1374 ' ' GLY . . . . . . . . . . . . . . . -97.7 5.98 62.42 Favored Glycine 0 N--CA 1.477 1.387 0 N-CA-C 117.82 1.888 . . . . 39.51 117.82 178.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1375 ' ' SER . . . . . . . . . . . . . 19.7 m -145.29 67.52 13.13 Favored Pre-proline 0 N--CA 1.493 1.719 0 N-CA-C 106.657 -1.609 . . . . 38.9 106.657 171.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1376 ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -58.08 -22.13 54.29 Favored 'Trans proline' 0 N--CA 1.488 1.173 1 C-N-CA 126.178 4.585 . . . . 39.31 117.605 -166.731 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1377 ' ' TRP . . . . . . . . . . . . . 47.4 p90 -71.37 -18.44 62.36 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.678 0.791 . . . . 37.65 109.471 174.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1378 ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -91.45 133.34 35.57 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 113.338 0.866 . . . . 41.63 113.338 -176.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1379 ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -99.86 128.24 45.97 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 107.211 -1.403 . . . . 38.77 107.211 172.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1380 ' ' VAL . . . . . . . . . . . . . 96.8 t -130.79 134.12 62.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 N-CA-C 108.648 -0.871 . . . . 26.87 108.648 -174.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1381 ' ' CYS . . . . . . . . . . . . . 47.3 t -98.58 124.82 43.58 Favored 'General case' 0 C--O 1.256 1.425 0 O-C-N 124.115 0.884 . . . . 27.62 108.939 177.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1382 ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -104.46 124.07 48.59 Favored 'General case' 0 C--O 1.251 1.136 0 N-CA-C 107.383 -1.34 . . . . 26.03 107.383 179.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1383 ' ' LEU . . . . . . . . . . . . . 10.8 tp -117.43 138.82 51.58 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 124.206 0.941 . . . . 23.45 112.274 -170.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1384 ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -136.82 161.63 35.45 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 115.236 -0.893 . . . . 24.34 112.111 -173.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1385 ' ' ALA . . . . . . . . . . . . . . . -123.15 147.27 46.99 Favored 'General case' 0 C--O 1.243 0.736 0 O-C-N 124.058 0.849 . . . . 25.31 110.181 165.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1386 ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -64.84 149.84 48.72 Favored 'General case' 0 C--O 1.25 1.119 0 CA-C-N 113.493 -1.685 . . . . 34.54 110.578 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1387 ' ' LEU . . . . . 0.438 HD23 ' O ' ' A' ' 19' ' ' HOH . 20.2 mt -117.16 -26.53 6.76 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-O 119.494 -0.288 . . . . 39.35 111.073 172.827 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1388 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.89 123.3 22.73 Favored Pre-proline 0 CA--C 1.553 1.082 0 N-CA-C 108.657 -0.868 . . . . 45.46 108.657 -171.436 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1389 ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.13 -16.04 52.72 Favored 'Trans proline' 0 C--N 1.368 1.574 0 C-N-CA 118.378 -0.615 . . . . 41.56 112.913 177.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1390 ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -92.55 -7.62 46.68 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.525 0.935 . . . . 50.26 113.525 178.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1391 ' ' GLN . . . . . . . . . . . . . 92.1 mm-40 -127.85 72.44 78.71 Favored Pre-proline 0 N--CA 1.474 0.773 0 N-CA-C 105.751 -1.944 . . . . 38.22 105.751 164.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1392 ' ' PRO . . . . . 1.022 ' HB2' ' H2 ' ' A' 1420 ' ' GOL . 55.1 Cg_endo -81.29 160.6 20.12 Favored 'Trans proline' 0 N--CA 1.446 -1.276 0 C-N-CA 121.149 1.233 . . . . 32.77 113.721 -168.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1393 ' ' ALA . . . . . . . . . . . . . . . -52.32 -43.09 64.34 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.208 -0.906 . . . . 30.11 112.256 -178.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1394 ' ' GLY . . . . . 0.582 ' O ' HG23 ' A' 1398 ' ' THR . . . -61.38 -39.41 97.23 Favored Glycine 0 CA--C 1.537 1.467 0 CA-C-N 118.095 0.407 . . . . 30.34 113.505 -177.946 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1395 ' ' ALA . . . . . . . . . . . . . . . -65.76 -42.21 91.17 Favored 'General case' 0 C--O 1.256 1.423 0 CA-C-O 121.019 0.438 . . . . 29.76 110.551 177.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1396 ' ' ILE . . . . . . . . . . . . . 68.0 mt -64.04 -44.75 97.84 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.451 0 N-CA-C 108.213 -1.032 . . . . 28.28 108.213 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1397 ' ' VAL . . . . . . . . . . . . . 48.5 t -58.13 -44.19 86.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 120.366 -0.534 . . . . 27.44 110.578 176.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1398 ' ' THR . . . . . 0.582 HG23 ' O ' ' A' 1394 ' ' GLY . 79.1 m -63.25 -39.48 94.72 Favored 'General case' 0 C--O 1.248 1.023 0 CA-C-O 121.511 0.672 . . . . 31.93 111.737 178.158 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1399 ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -63.77 -41.94 97.88 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 120.288 -0.565 . . . . 35.81 112.018 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1400 ' ' ILE . . . . . . . . . . . . . 96.1 mt -62.26 -43.9 98.51 Favored 'Isoleucine or valine' 0 C--O 1.244 0.788 0 O-C-N 121.17 -0.956 . . . . 32.19 109.891 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1401 ' ' THR . . . . . 0.579 HG23 ' O ' ' A' ' 60' ' ' HOH . 13.3 t -60.0 -39.57 86.21 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 119.626 -0.83 . . . . 35.0 110.191 -176.586 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1402 ' ' LYS . . . . . . . . . . . . . . . -63.92 -45.28 89.99 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 111.794 0.294 . . . . 40.92 111.794 175.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1403 ' ' VAL . . . . . 0.544 ' O ' HG21 ' A' 1340 ' ' VAL . 27.0 m -74.44 -21.99 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 120.433 -0.507 . . . . 46.95 111.511 -178.306 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1404 ' ' MSE . . . . . . . . . . . . . 93.9 mtp -68.46 -48.89 63.33 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 109.307 -0.627 . . . . 51.52 109.307 166.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1405 ' ' LEU . . . . . . . . . . . . . 20.5 tp -58.71 -44.6 90.41 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.397 0.679 . . . . 56.62 111.81 -179.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1406 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.29 0 N-CA-C 109.995 -1.242 . . . . 58.21 109.995 169.983 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' SO4 . . . . . 0.484 ' O1 ' ' NZ ' ' A' 1372 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1418 ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1419 ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1420 ' ' GOL . . . . . 1.022 ' H2 ' ' HB2' ' A' 1392 ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' HOH . . . . . 0.438 ' O ' HD23 ' A' 1387 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' HOH . . . . . 0.42 ' O ' ' NH1' ' A' 1297 ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' HOH . . . . . 0.579 ' O ' HG23 ' A' 1401 ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1421 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1422 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1423 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_