data_5zvk_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 5zvk _Structure_validation_residue.Date_analyzed 2019-04-05 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 ' 986' ' ' THR . . . . . . . . . . . . . 2.1 t . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.672 0.272 . . . . 192.42 111.243 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 987' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -60.0 -50.78 72.4 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 116.146 -0.479 . . . . 207.37 111.087 -179.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 988' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -66.97 -28.79 68.55 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.509 -0.476 . . . . 189.36 111.64 179.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 989' ' ' VAL . . . . . . . . . . . . . 32.3 t -65.22 -40.53 88.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 C-N-CA 120.36 -0.536 . . . . 191.88 110.125 174.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -71.14 -34.0 70.62 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.232 -0.587 . . . . 201.51 111.516 178.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 991' ' ' SER . . . . . . . . . . . . . 39.0 t -66.27 -46.21 77.81 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.317 -0.553 . . . . 172.44 111.11 176.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 992' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -59.96 -47.67 84.86 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 120.916 0.389 . . . . 166.02 111.021 176.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 993' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 -51.98 -50.61 60.93 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.932 0.396 . . . . 153.71 111.089 174.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 994' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -60.66 -45.8 92.76 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 120.781 0.324 . . . . 142.32 111.529 -176.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 995' ' ' LYS . . . . . . . . . . . . . 37.5 tttt -58.95 -43.89 91.33 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.315 -0.554 . . . . 155.91 111.16 177.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 996' ' ' LEU . . . . . . . . . . . . . 28.2 tp -61.68 -41.18 97.22 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 120.059 -0.656 . . . . 144.68 111.398 177.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 997' ' ' ILE . . . . . . . . . . . . . 15.3 mm -55.21 -53.02 39.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-O 121.234 0.54 . . . . 138.05 110.224 176.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 998' ' ' ALA . . . . . . . . . . . . . . . -59.66 -39.57 84.86 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.504 -0.478 . . . . 121.88 111.209 -178.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 999' ' ' ASN . . . . . . . . . . . . . 23.8 m-20 -63.01 -54.08 43.81 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.903 -0.319 . . . . 136.73 111.088 -178.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1000 ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -59.74 -38.59 82.17 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 120.296 -0.562 . . . . 142.19 111.111 -179.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1001 ' ' PHE . . . . . . . . . . . . . 92.2 t80 -57.49 -52.79 63.94 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.856 -0.337 . . . . 126.78 111.122 175.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1002 ' ' ASN . . . . . . . . . . . . . 36.2 m-20 -58.36 -42.97 88.1 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 120.836 -0.346 . . . . 144.51 111.788 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1003 ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -59.58 -51.39 70.03 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 120.491 -0.484 . . . . 156.23 111.179 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1004 ' ' ALA . . . . . . . . . . . . . . . -55.94 -39.2 71.35 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.152 -0.619 . . . . 131.53 111.223 176.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1005 ' ' LEU . . . . . . . . . . . . . 1.3 tm? -59.43 -50.91 72.1 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.755 0.312 . . . . 119.32 111.214 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1006 ' ' GLY . . . . . . . . . . . . . . . -57.99 -44.98 94.32 Favored Glycine 0 C--N 1.336 0.528 0 C-N-CA 120.092 -1.051 . . . . 112.98 112.754 177.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1007 ' ' ALA . . . . . . . . . . . . . . . -56.76 -41.51 77.74 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.029 -0.668 . . . . 106.39 111.168 177.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1008 ' ' MET . . . . . . . . . . . . . 32.1 mtp -66.79 -43.1 84.84 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.58 -0.448 . . . . 98.13 111.709 -179.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1009 ' ' GLN . . . . . 0.41 ' NE2' ' OE1' ' A' ' 33' ' ' GLU . 46.6 mt-30 -57.24 -47.21 81.93 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 120.127 -0.629 . . . . 100.14 111.018 177.091 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1010 ' ' THR . . . . . . . . . . . . . 5.5 p -58.5 -41.51 85.53 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 119.824 -0.75 . . . . 96.34 111.078 175.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1011 ' ' GLY . . . . . . . . . . . . . . . -59.13 -56.12 27.0 Favored Glycine 0 N--CA 1.45 -0.429 0 N-CA-C 113.806 0.282 . . . . 83.81 113.806 179.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1012 ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -63.38 -39.25 94.01 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.723 -0.391 . . . . 79.73 111.635 -178.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1013 ' ' THR . . . . . . . . . . . . . 40.0 m -57.41 -49.04 77.49 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 120.007 -0.677 . . . . 80.28 110.814 175.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1014 ' ' THR . . . . . . . . . . . . . 52.8 m -59.09 -44.48 91.93 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.835 -0.346 . . . . 84.09 111.43 178.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1015 ' ' THR . . . . . . . . . . . . . 90.4 m -58.13 -38.63 76.91 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 120.722 -0.391 . . . . 79.76 111.269 177.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1016 ' ' ASN . . . . . . . . . . . . . 20.6 t30 -64.51 -46.65 82.05 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 120.748 -0.381 . . . . 90.31 110.856 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 90.5 mt-10 -57.84 -45.29 86.43 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 120.404 -0.519 . . . . 96.75 110.792 177.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1018 ' ' ALA . . . . . . . . . . . . . . . -57.75 -41.63 82.29 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 116.423 -0.353 . . . . 75.03 111.299 177.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -66.32 -34.16 77.36 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 119.708 -0.797 . . . . 71.79 111.555 178.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1020 ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.55 -50.92 71.5 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 120.327 -0.549 . . . . 76.44 111.161 171.031 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1021 ' ' LYS . . . . . . . . . . . . . 89.9 mttt -61.3 -42.79 99.25 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 119.97 -0.692 . . . . 80.96 111.507 -178.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1022 ' ' VAL . . . . . . . . . . . . . 70.3 t -61.17 -47.09 95.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 CA-C-O 121.077 0.465 . . . . 70.36 110.462 179.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1023 ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -58.83 -46.35 87.87 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.446 -0.502 . . . . 78.0 111.043 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1024 ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -67.5 -35.29 78.84 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 119.788 -0.765 . . . . 93.59 111.49 -176.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -70.15 -52.21 25.34 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 120.238 -0.585 . . . . 80.72 111.218 179.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1026 ' ' VAL . . . . . . . . . . . . . 67.1 t -56.36 -41.28 70.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 120.925 0.393 . . . . 70.77 110.643 177.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1027 ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -65.37 -45.77 82.78 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.241 -0.583 . . . . 71.34 111.281 179.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1028 ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -61.74 -41.88 98.23 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.066 -0.654 . . . . 84.73 111.525 -179.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -75.0 -34.99 62.02 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 119.357 -0.937 . . . . 80.37 111.991 -177.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1030 ' ' ALA . . . . . . . . . . . . . . . -60.13 -41.13 92.03 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 120.365 -0.534 . . . . 84.11 110.977 170.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1031 ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -63.05 -48.34 79.1 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 120.888 -0.325 . . . . 99.88 111.032 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -59.45 -44.0 93.04 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 120.382 -0.527 . . . . 83.22 111.329 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1033 ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.11 -46.3 85.79 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 120.66 -0.416 . . . . 82.57 111.194 177.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1034 ' ' SER . . . . . . . . . . . . . 8.5 t -63.83 -39.0 93.19 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 120.543 -0.463 . . . . 87.55 111.294 -178.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1035 ' ' LYS . . . . . . . . . . . . . 39.5 tttp -61.08 -44.09 97.9 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 120.503 -0.479 . . . . 100.43 111.114 175.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1036 ' ' LEU . . . . . . . . . . . . . 54.9 tp -58.45 -51.31 70.36 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.025 0.441 . . . . 88.48 111.1 179.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1037 ' ' ALA . . . . . . . . . . . . . . . -60.83 -44.18 97.27 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.604 -0.438 . . . . 86.06 111.551 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1038 ' ' SER . . . . . . . . . . . . . 78.2 p -61.19 -45.53 94.21 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 120.528 -0.469 . . . . 90.4 111.386 -178.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1039 ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -64.64 -46.31 83.07 Favored 'General case' 0 C--O 1.242 0.659 0 C-N-CA 119.946 -0.702 . . . . 100.64 111.107 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1040 ' ' LEU . . . . . . . . . . . . . 10.9 mt -57.32 -46.17 83.49 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.16 -0.616 . . . . 83.94 110.924 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1041 ' ' SER . . . . . . . . . . . . . 1.3 p -65.03 -45.31 85.99 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 120.492 -0.483 . . . . 83.94 111.299 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1042 ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -60.17 -47.61 85.2 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.476 -0.49 . . . . 86.13 111.123 -178.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1043 ' ' THR . . . . . . . . . . . . . 85.2 m -69.39 -36.35 76.7 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.155 -1.018 . . . . 84.69 111.727 -177.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1044 ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -68.16 -38.43 82.07 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 119.289 -0.964 . . . . 89.74 111.113 179.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1045 ' ' GLY . . . . . . . . . . . . . . . -62.43 -42.2 99.72 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 119.873 -1.156 . . . . 90.83 112.454 171.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1046 ' ' ALA . . . . . . . . . . . . . . . -57.62 -49.48 76.29 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 122.332 -0.511 . . . . 95.55 111.279 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 17.3 mm -65.58 -42.85 93.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 120.164 -0.614 . . . . 97.59 111.105 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 11.7 t -51.59 -45.6 63.22 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.154 -0.618 . . . . 102.86 110.727 175.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1049 ' ' ALA . . . . . . . . . . . . . . . -62.71 -52.41 63.36 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.936 -0.306 . . . . 111.86 111.67 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 2.6 p -65.68 -52.27 52.89 Favored 'General case' 0 C--O 1.237 0.435 0 O-C-N 122.048 -0.407 . . . . 114.68 111.632 -170.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1051 ' ' ILE . . . . . . . . . . . . . 7.7 pt -68.01 -26.42 34.5 Favored 'Isoleucine or valine' 0 C--O 1.24 0.59 0 C-N-CA 119.151 -1.02 . . . . 118.91 110.353 178.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1052 ' ' GLY . . . . . . . . . . . . . . . -54.27 -42.62 74.0 Favored Glycine 0 C--N 1.336 0.567 0 C-N-CA 119.382 -1.39 . . . . 125.89 111.442 166.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1053 ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -66.69 -31.07 71.5 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.305 -0.558 . . . . 129.24 110.667 175.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1054 ' ' ILE . . . . . . . . . . . . . 3.6 mt -59.36 -32.53 48.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 109.811 -0.44 . . . . 129.93 109.811 173.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1055 ' ' ILE . . . . . . . . . . . . . 41.0 mt . . . . . 0 C--N 1.33 -0.252 0 C-N-CA 119.917 -0.713 . . . . 136.37 109.193 170.083 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 986' ' ' THR . . . . . . . . . . . . . 19.6 p . . . . . 0 N--CA 1.458 -0.038 0 CA-C-O 120.663 0.268 . . . . 191.6 111.236 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 987' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -59.94 -41.65 92.3 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 116.096 -0.502 . . . . 197.57 111.594 -178.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 988' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 -61.01 -46.6 90.09 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 120.891 0.377 . . . . 188.18 111.27 -177.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 989' ' ' VAL . . . . . . . . . . . . . 37.3 t -60.86 -39.56 82.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 120.985 0.421 . . . . 181.18 110.589 -177.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 990' ' ' LEU . . . . . . . . . . . . . 9.7 mp -70.63 -34.44 72.08 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.136 -0.626 . . . . 183.64 111.751 179.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 991' ' ' SER . . . . . . . . . . . . . 27.4 p -65.85 -52.62 48.87 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 119.938 -0.705 . . . . 168.15 111.219 176.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 992' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -60.35 -40.24 90.04 Favored 'General case' 0 C--O 1.241 0.621 0 C-N-CA 120.397 -0.521 . . . . 159.25 111.2 178.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 993' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -58.48 -42.24 87.07 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.609 -0.436 . . . . 157.08 110.933 175.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 994' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -58.33 -41.92 85.62 Favored 'General case' 0 C--O 1.239 0.5 0 C-N-CA 120.547 -0.461 . . . . 168.42 111.148 174.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 995' ' ' LYS . . . . . . . . . . . . . 23.3 tttp -55.79 -44.53 77.85 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 120.023 -0.671 . . . . 157.21 110.94 175.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 996' ' ' LEU . . . . . . . . . . . . . 26.2 tp -60.61 -41.07 94.04 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 120.144 -0.622 . . . . 148.5 111.081 176.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 997' ' ' ILE . . . . . . . . . . . . . 14.5 mm -54.94 -54.04 27.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 121.303 0.573 . . . . 149.02 110.484 177.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 998' ' ' ALA . . . . . . . . . . . . . . . -61.4 -42.84 99.37 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 120.5 -0.48 . . . . 126.52 111.843 -177.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 999' ' ' ASN . . . . . . . . . . . . . 10.5 m-80 -63.58 -54.81 30.26 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 119.896 -0.722 . . . . 130.61 111.325 -177.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1000 ' ' LYS . . . . . . . . . . . . . 52.9 mttm -60.53 -36.72 79.09 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.065 -0.654 . . . . 125.08 111.443 -179.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1001 ' ' PHE . . . . . . . . . . . . . 92.2 t80 -57.9 -53.26 60.24 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.669 -0.413 . . . . 121.77 111.265 175.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1002 ' ' ASN . . . . . . . . . . . . . 36.8 m-20 -57.67 -42.58 83.86 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 120.272 -0.571 . . . . 129.77 111.387 179.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1003 ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -58.35 -49.47 77.1 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-O 121.068 0.461 . . . . 128.87 110.907 178.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1004 ' ' ALA . . . . . . . . . . . . . . . -55.34 -38.99 69.46 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.664 -0.414 . . . . 112.24 111.214 175.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1005 ' ' LEU . . . . . . . . . . . . . 6.0 mt -58.9 -49.4 77.93 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 120.768 -0.373 . . . . 115.34 111.102 178.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1006 ' ' GLY . . . . . . . . . . . . . . . -56.61 -43.81 91.1 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 119.718 -1.229 . . . . 100.84 112.339 176.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -56.46 -39.72 73.64 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.349 -0.54 . . . . 92.34 111.063 176.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1008 ' ' MET . . . . . . . . . . . . . 38.2 mtt -65.57 -43.37 90.0 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.937 -0.305 . . . . 98.2 111.08 179.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1009 ' ' GLN . . . . . 0.661 ' NE2' ' OE1' ' B' ' 33' ' ' GLU . 48.1 mt-30 -57.4 -47.87 80.58 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 120.49 -0.484 . . . . 107.75 111.028 176.943 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B 1010 ' ' THR . . . . . . . . . . . . . 3.1 m -59.46 -43.5 93.19 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 119.893 -0.723 . . . . 92.36 111.525 177.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1011 ' ' GLY . . . . . . . . . . . . . . . -59.81 -56.61 23.85 Favored Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 114.356 0.502 . . . . 83.25 114.356 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1012 ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -64.33 -38.92 92.73 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.268 -0.573 . . . . 84.8 111.566 -178.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1013 ' ' THR . . . . . . . . . . . . . 33.6 m -57.73 -49.1 77.67 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 120.125 -0.63 . . . . 79.15 111.019 175.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1014 ' ' THR . . . . . . . . . . . . . 53.1 m -59.04 -44.19 91.75 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.781 -0.367 . . . . 80.92 111.3 178.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1015 ' ' THR . . . . . . . . . . . . . 88.6 m -58.06 -38.31 76.07 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.519 -0.473 . . . . 78.92 111.19 176.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 19.3 t30 -64.7 -49.02 72.53 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 120.796 0.331 . . . . 98.81 111.229 179.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1017 ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -59.63 -45.76 91.02 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 120.267 -0.573 . . . . 92.19 111.166 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1018 ' ' ALA . . . . . . . . . . . . . . . -58.14 -42.48 85.98 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.777 -0.369 . . . . 74.98 111.39 178.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1019 ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -66.62 -33.1 74.9 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 119.683 -0.807 . . . . 73.22 111.766 178.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1020 ' ' ARG . . . . . . . . . . . . . 4.0 ttm180 -62.83 -44.0 97.3 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.172 -1.011 . . . . 100.22 111.446 172.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1021 ' ' LYS . . . . . . . . . . . . . 89.2 mttt -60.93 -42.99 99.21 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 119.749 -0.781 . . . . 79.73 111.436 177.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1022 ' ' VAL . . . . . . . . . . . . . 64.9 t -61.61 -46.6 96.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-O 121.096 0.474 . . . . 87.2 110.341 178.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1023 ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -59.48 -48.45 81.61 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 122.055 -0.403 . . . . 108.68 111.479 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1024 ' ' ASP . . . . . . . . . . . . . 3.1 p30 -68.65 -33.62 74.3 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.407 -0.917 . . . . 120.55 111.837 -177.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1025 ' ' ALA . . . . . . . . . . . . . . . -70.15 -52.16 25.69 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 119.983 -0.687 . . . . 99.48 111.113 179.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1026 ' ' VAL . . . . . . . . . . . . . 56.4 t -56.45 -41.97 73.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-O 120.964 0.411 . . . . 93.9 110.609 177.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1027 ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -65.47 -45.2 84.65 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.545 -0.462 . . . . 90.21 111.155 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1028 ' ' ASN . . . . . 0.482 ' ND2' ' O ' ' A' ' 12' ' ' ASN . 1.9 t30 -61.46 -41.81 97.8 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 120.715 -0.394 . . . . 86.1 111.421 -179.283 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B 1029 ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -75.35 -34.14 61.15 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 119.859 -0.736 . . . . 80.31 111.66 -177.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1030 ' ' ALA . . . . . . . . . . . . . . . -59.57 -41.06 89.34 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 120.295 -0.562 . . . . 83.42 110.789 170.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1031 ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -62.91 -47.89 81.31 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.948 -0.301 . . . . 109.62 111.072 178.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1032 ' ' ALA . . . . . . . . . . . . . . . -59.4 -44.09 92.89 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 120.21 -0.596 . . . . 87.51 111.353 178.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1033 ' ' LEU . . . . . . . . . . . . . 51.0 tp -58.55 -45.99 87.78 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 120.709 -0.397 . . . . 89.81 111.151 177.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1034 ' ' SER . . . . . . . . . . . . . 8.5 t -63.71 -38.97 93.12 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.586 -0.446 . . . . 101.28 111.386 -178.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1035 ' ' LYS . . . . . . . . . . . . . 19.5 ttmt -61.98 -43.63 98.43 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.247 -0.581 . . . . 113.42 111.188 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1036 ' ' LEU . . . . . . . . . . . . . 1.1 tt -58.28 -52.59 64.94 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 120.945 0.403 . . . . 102.0 111.239 178.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1037 ' ' ALA . . . . . . . . . . . . . . . -58.1 -42.71 86.27 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.586 -0.446 . . . . 108.65 111.419 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1038 ' ' SER . . . . . . . . . . . . . 30.0 t -61.0 -43.32 99.05 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 120.638 -0.425 . . . . 116.34 111.373 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1039 ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -63.08 -48.69 77.55 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 120.729 -0.388 . . . . 121.08 110.838 179.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1040 ' ' LEU . . . . . . . . . . . . . 12.3 mt -59.06 -45.64 90.28 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.58 -0.448 . . . . 101.01 111.408 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1041 ' ' SER . . . . . . . . . . . . . 45.3 t -65.58 -47.03 77.14 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 120.408 -0.517 . . . . 106.41 111.375 -177.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1042 ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -61.38 -47.3 86.46 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.515 -0.474 . . . . 108.63 111.091 -179.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1043 ' ' THR . . . . . . . . . . . . . 5.4 p -68.97 -36.62 78.09 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 119.798 -0.761 . . . . 100.49 111.646 -176.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1044 ' ' PHE . . . . . 0.402 ' O ' ' OG ' ' B' 1048 ' ' SER . 7.9 m-85 -69.56 -39.01 77.65 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 119.856 -0.738 . . . . 96.6 111.284 179.56 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B 1045 ' ' GLY . . . . . . . . . . . . . . . -61.46 -42.02 99.68 Favored Glycine 0 C--N 1.336 0.563 0 C-N-CA 119.781 -1.2 . . . . 99.93 112.204 172.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1046 ' ' ALA . . . . . . . . . . . . . . . -58.01 -47.92 81.57 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 122.41 -0.465 . . . . 95.64 111.294 177.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1047 ' ' ILE . . . . . . . . . . . . . 73.3 mt -63.51 -45.11 98.67 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 C-N-CA 120.333 -0.547 . . . . 92.09 110.089 -178.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1048 ' ' SER . . . . . 0.402 ' OG ' ' O ' ' B' 1044 ' ' PHE . 1.4 m -51.75 -45.02 63.53 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.081 0.467 . . . . 101.39 110.897 175.627 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B 1049 ' ' ALA . . . . . . . . . . . . . . . -60.61 -51.06 70.99 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.465 -0.334 . . . . 113.31 111.11 177.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1050 ' ' SER . . . . . . . . . . . . . 2.9 p -67.28 -62.04 1.62 Allowed 'General case' 0 C--O 1.24 0.578 0 C-N-CA 120.41 -0.516 . . . . 117.95 111.592 -172.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1051 ' ' ILE . . . . . . . . . . . . . 46.8 pt -64.64 -27.93 43.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 119.15 -1.02 . . . . 119.1 110.445 -177.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1052 ' ' GLY . . . . . . . . . . . . . . . -56.19 -42.32 87.85 Favored Glycine 0 C--N 1.336 0.547 0 C-N-CA 119.724 -1.227 . . . . 140.8 112.307 166.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1053 ' ' ASP . . . . . . . . . . . . . 81.2 m-20 -66.77 -28.87 68.74 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.296 -0.532 . . . . 155.92 111.898 177.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1054 ' ' ILE . . . . . . . . . . . . . 1.6 mp -56.76 -36.84 50.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 C-N-CA 120.117 -0.633 . . . . 150.85 110.917 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1055 ' ' ILE . . . . . . . . . . . . . 5.6 tp . . . . . 0 C--N 1.33 -0.271 0 O-C-N 121.559 -0.713 . . . . 157.04 109.929 172.76 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 986' ' ' THR . . . . . . . . . . . . . 71.0 p . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.733 0.301 . . . . 198.28 111.078 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 987' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -60.41 -37.11 79.81 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.916 -0.584 . . . . 196.84 111.541 -179.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 988' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -69.57 -48.25 60.91 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.703 -0.399 . . . . 204.14 111.139 -178.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 989' ' ' VAL . . . . . . . . . . . . . 31.5 t -57.63 -38.27 63.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-O 121.097 0.475 . . . . 180.01 110.393 175.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 990' ' ' LEU . . . . . . . . . . . . . 3.4 mt -69.49 -35.66 75.77 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.386 -0.525 . . . . 168.09 111.101 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 991' ' ' SER . . . . . . . . . . . . . 25.1 p -67.33 -43.08 82.48 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.474 -0.49 . . . . 170.03 111.352 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 992' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -61.3 -51.88 67.04 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-O 121.093 0.473 . . . . 183.29 111.012 177.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 993' ' ' ASN . . . . . . . . . . . . . 18.2 m-20 -54.07 -41.43 68.16 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.529 -0.305 . . . . 147.15 110.932 176.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 994' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -57.51 -44.99 85.45 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 120.85 0.357 . . . . 141.65 111.17 176.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 995' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -58.99 -44.74 91.66 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 122.194 -0.316 . . . . 153.64 111.301 177.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 996' ' ' LEU . . . . . . . . . . . . . 3.5 tt -61.26 -42.43 98.61 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 119.761 -0.776 . . . . 140.68 111.287 178.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 997' ' ' ILE . . . . . . . . . . . . . 16.5 mm -55.2 -51.3 56.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-O 121.144 0.497 . . . . 139.98 110.257 175.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 998' ' ' ALA . . . . . . . . . . . . . . . -59.9 -41.31 91.38 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.508 -0.477 . . . . 141.87 111.622 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 999' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -63.87 -54.38 35.8 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 120.363 -0.535 . . . . 160.27 111.365 -178.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1000 ' ' LYS . . . . . . . . . . . . . 52.1 mttm -59.37 -36.73 76.29 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 119.84 -0.744 . . . . 145.09 111.038 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1001 ' ' PHE . . . . . . . . . . . . . 91.3 t80 -57.54 -53.1 61.93 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.602 0.239 . . . . 127.99 111.36 175.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1002 ' ' ASN . . . . . . . . . . . . . 36.1 m-20 -58.48 -43.03 88.81 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 120.592 -0.443 . . . . 138.89 111.717 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1003 ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -59.24 -49.41 77.94 Favored 'General case' 0 C--O 1.241 0.654 0 C-N-CA 120.257 -0.577 . . . . 135.78 110.877 178.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1004 ' ' ALA . . . . . . . . . . . . . . . -55.42 -38.03 68.42 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.571 -0.452 . . . . 113.42 111.269 174.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1005 ' ' LEU . . . . . . . . . . . . . 5.3 mt -58.62 -50.27 74.45 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.828 0.346 . . . . 111.27 110.894 177.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1006 ' ' GLY . . . . . . . . . . . . . . . -57.71 -44.63 94.02 Favored Glycine 0 C--N 1.336 0.534 0 C-N-CA 119.783 -1.199 . . . . 106.9 112.777 176.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1007 ' ' ALA . . . . . . . . . . . . . . . -57.84 -42.91 85.37 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 120.128 -0.629 . . . . 103.17 111.755 178.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1008 ' ' MET . . . . . . . . . . . . . 5.3 mtm -67.57 -41.93 83.4 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.151 -0.619 . . . . 102.14 111.406 -179.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1009 ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -56.68 -45.94 81.44 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 120.293 -0.563 . . . . 116.46 110.921 175.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1010 ' ' THR . . . . . . . . . . . . . 75.4 m -57.85 -42.43 84.44 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.197 -0.601 . . . . 116.72 110.866 175.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1011 ' ' GLY . . . . . . . . . . . . . . . -59.84 -56.22 26.02 Favored Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 114.372 0.509 . . . . 100.36 114.372 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1012 ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -64.42 -40.03 94.99 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 117.031 0.416 . . . . 98.95 111.783 -178.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1013 ' ' THR . . . . . . . . . . . . . 31.0 m -58.19 -48.66 79.62 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 120.05 -0.66 . . . . 112.94 110.847 175.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1014 ' ' THR . . . . . . . . . . . . . 59.3 m -58.67 -44.23 90.13 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 116.572 -0.285 . . . . 105.35 111.32 178.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 89.6 m -58.47 -38.34 77.37 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.885 -0.326 . . . . 99.11 111.199 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1016 ' ' ASN . . . . . . . . . . . . . 18.3 t30 -65.09 -48.2 74.56 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 120.82 -0.352 . . . . 110.07 111.032 -179.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -59.7 -44.7 93.58 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 120.266 -0.574 . . . . 121.48 111.098 177.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1018 ' ' ALA . . . . . . . . . . . . . . . -57.53 -41.99 82.01 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.898 -0.321 . . . . 96.38 111.244 178.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1019 ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -66.79 -33.47 75.69 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.918 -0.713 . . . . 85.34 111.396 177.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1020 ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 -55.76 -52.62 63.31 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.245 -0.582 . . . . 109.24 110.721 170.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1021 ' ' LYS . . . . . . . . . . . . . 90.7 mttt -61.88 -42.25 98.84 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.491 -0.484 . . . . 100.72 111.522 -177.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1022 ' ' VAL . . . . . . . . . . . . . 64.7 t -60.7 -47.06 94.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-O 121.153 0.501 . . . . 76.46 110.375 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1023 ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -58.85 -46.21 88.28 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.666 -0.414 . . . . 89.81 111.084 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1024 ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -67.29 -35.45 79.51 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 119.879 -0.728 . . . . 97.57 111.434 -176.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1025 ' ' ALA . . . . . . . . . . . . . . . -70.08 -51.74 29.45 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 120.254 -0.579 . . . . 88.12 111.188 179.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1026 ' ' VAL . . . . . . . . . . . . . 62.8 t -56.24 -41.28 69.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 120.911 0.386 . . . . 94.02 110.642 177.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1027 ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -65.63 -45.84 81.56 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.441 -0.503 . . . . 110.01 111.379 -179.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1028 ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -61.86 -41.81 98.29 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.184 -0.606 . . . . 124.96 111.478 -179.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1029 ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -75.15 -34.86 61.67 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.565 -0.854 . . . . 104.51 112.133 -177.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1030 ' ' ALA . . . . . . . . . . . . . . . -60.47 -40.82 92.64 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.252 -0.579 . . . . 92.95 111.006 170.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1031 ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -63.01 -48.72 77.59 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.884 -0.326 . . . . 107.59 111.164 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1032 ' ' ALA . . . . . . . . . . . . . . . -59.8 -43.97 94.21 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 120.547 -0.461 . . . . 87.9 111.399 178.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1033 ' ' LEU . . . . . . . . . . . . . 50.9 tp -58.57 -46.14 87.52 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.807 -0.357 . . . . 76.26 111.184 177.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1034 ' ' SER . . . . . . . . . . . . . 8.3 t -63.77 -39.18 93.64 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.371 -0.532 . . . . 84.79 111.226 -178.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1035 ' ' LYS . . . . . . . . . . . . . 15.6 mmmt -60.52 -43.87 96.66 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.28 -0.568 . . . . 110.16 110.871 175.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1036 ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.99 -50.79 72.35 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-O 120.831 0.348 . . . . 91.42 110.937 179.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1037 ' ' ALA . . . . . . . . . . . . . . . -60.18 -43.99 95.43 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 120.277 -0.569 . . . . 92.24 111.336 -179.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1038 ' ' SER . . . . . . . . . . . . . 77.9 p -60.19 -42.6 95.4 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.238 -0.585 . . . . 104.85 110.978 179.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1039 ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -63.05 -47.95 80.8 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 120.427 -0.509 . . . . 124.32 111.089 -179.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1040 ' ' LEU . . . . . . . . . . . . . 1.6 mm? -59.16 -47.06 86.69 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.295 -0.562 . . . . 111.28 111.454 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1041 ' ' SER . . . . . . . . . . . . . 31.2 t -65.58 -46.98 77.33 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 120.172 -0.611 . . . . 119.14 111.357 -176.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1042 ' ' ASN . . . . . . . . . . . . . 10.1 t30 -61.16 -46.86 88.76 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.463 -0.495 . . . . 141.74 111.09 -179.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1043 ' ' THR . . . . . . . . . . . . . 1.4 t -67.85 -35.58 78.81 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.773 -0.771 . . . . 114.11 111.381 -176.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1044 ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -70.45 -35.99 73.68 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.212 -0.595 . . . . 96.42 111.253 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1045 ' ' GLY . . . . . . . . . . . . . . . -61.96 -42.83 99.77 Favored Glycine 0 C--N 1.335 0.495 0 C-N-CA 119.327 -1.416 . . . . 92.28 112.086 170.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1046 ' ' ALA . . . . . . . . . . . . . . . -57.74 -49.53 76.24 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 122.357 -0.496 . . . . 101.73 111.274 177.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1047 ' ' ILE . . . . . . . . . . . . . 15.8 mm -64.92 -41.39 92.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 C-N-CA 120.114 -0.635 . . . . 83.73 110.773 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1048 ' ' SER . . . . . . . . . . . . . 11.1 t -51.09 -46.85 61.94 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 121.95 -0.469 . . . . 88.61 110.995 175.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1049 ' ' ALA . . . . . . . . . . . . . . . -64.1 -53.27 52.22 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.347 -0.541 . . . . 112.49 111.615 177.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1050 ' ' SER . . . . . . . . . . . . . 2.7 p -67.06 -26.86 66.95 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 112.63 0.604 . . . . 137.61 112.63 -169.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1051 ' ' ILE . . . . . . . . . . . . . 44.8 mt -88.46 -29.12 5.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 120.453 -0.499 . . . . 152.19 110.709 174.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1052 ' ' GLY . . . . . . . . . . . . . . . -55.63 -40.88 80.51 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.783 -0.722 . . . . 178.32 113.889 169.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1053 ' ' ASP . . . . . . . . . . . . . 3.0 p30 -64.65 -28.17 69.43 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.874 0.694 . . . . 203.19 112.874 -178.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1054 ' ' ILE . . . . . . . . . . . . . 5.7 mt -55.78 -37.03 45.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-N 118.102 0.41 . . . . 200.09 110.933 -178.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1055 ' ' ILE . . . . . . . . . . . . . 14.4 mt . . . . . 0 C--N 1.329 -0.3 0 O-C-N 121.709 -0.619 . . . . 191.38 110.375 174.822 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' a' a ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.736 0.303 . . . . 111.82 111.046 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' a' a ' 13' ' ' VAL . . . . . . . . . . . . . 98.4 t -99.77 127.6 52.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 108.318 -0.993 . . . . 106.42 108.318 177.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 14' ' ' THR . . . . . . . . . . . . . 41.1 p -121.08 153.95 36.77 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.213 0.53 . . . . 110.18 110.802 -176.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 15' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -102.44 176.1 5.29 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.426 -0.806 . . . . 109.39 109.349 177.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 tt -130.09 123.17 29.78 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.941 -1.133 . . . . 93.29 107.941 -171.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 17' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -127.08 108.18 10.69 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.102 -0.703 . . . . 92.08 109.102 -177.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 18' ' ' LEU . . . . . . . . . . . . . 54.0 mt -112.28 12.92 20.35 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 113.35 0.87 . . . . 78.73 113.35 177.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 19' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -59.98 -43.63 94.99 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 118.527 0.603 . . . . 89.4 111.428 -172.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 20' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -58.84 -47.7 83.95 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 120.86 0.362 . . . . 87.8 111.137 177.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 21' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -60.26 -40.89 91.94 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.744 -0.383 . . . . 69.84 111.238 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 22' ' ' MET . . . . . . . . . . . . . 59.4 mtt -65.74 -36.71 84.36 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.205 -0.598 . . . . 73.97 111.431 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 23' ' ' LYS . . . . . . . . . . . . . 62.9 mttt -67.56 -34.93 78.05 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.468 -0.893 . . . . 89.62 111.343 174.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 24' ' ' LYS . . . . . . . . . . . . . 17.8 mttt -60.02 -39.94 87.58 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 119.883 -0.727 . . . . 85.48 110.774 173.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 25' ' ' LEU . . . . . . . . . . . . . 19.3 mt -66.31 -43.19 86.94 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 120.312 -0.555 . . . . 80.79 110.931 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 26' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -54.45 -46.53 73.31 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.022 0.439 . . . . 96.41 110.984 175.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 27' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -64.32 -44.44 91.53 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.393 -0.523 . . . . 104.91 111.283 -178.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.97 -39.49 85.84 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 119.815 -0.754 . . . . 102.91 111.221 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 29' ' ' ILE . . . . . . . . . . . . . 81.7 mt -64.62 -34.91 72.93 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 120.575 -0.45 . . . . 113.0 110.343 176.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 30' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.29 -43.71 90.25 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 119.883 -0.727 . . . . 133.85 111.455 175.833 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' a' a ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -58.4 -42.47 87.2 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 119.801 -0.76 . . . . 128.27 111.143 174.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 32' ' ' LEU . . . . . . . . . . . . . 54.7 mt -58.78 -44.05 90.57 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.042 -0.663 . . . . 114.88 111.049 176.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 33' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -60.83 -33.78 73.55 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.573 -0.451 . . . . 122.07 111.372 175.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 34' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -82.11 3.56 26.54 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 112.72 0.637 . . . . 127.81 112.72 177.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 35' ' ' SER . . . . . . . . . . . . . 73.6 m -109.83 21.05 17.37 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 118.337 0.517 . . . . 124.49 112.389 -179.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 36' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -76.81 141.55 40.67 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.741 -0.466 . . . . 135.82 109.741 177.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 37' ' ' ILE . . . . . . . . . . . . . 3.4 mt -98.95 110.4 26.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 N-CA-C 106.927 -1.509 . . . . 144.57 106.927 -170.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 38' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -80.91 146.1 30.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.233 0.54 . . . . 154.71 109.93 178.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 39' ' ' LEU . . . . . . . . . . . . . 27.1 mt -59.05 -55.79 30.62 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.552 -0.749 . . . . 171.76 111.22 -173.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 40' ' ' LYS . . . . . . . . . . . . . 97.7 mttt 55.65 60.07 3.51 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.983 0.896 . . . . 166.92 111.13 177.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 41' ' ' GLU . . . . . . . . . . . . . 11.9 tm-20 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 115.043 -0.981 . . . . 205.94 109.91 178.471 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' b' b ' 10' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.776 0.322 . . . . 246.52 111.052 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' b' b ' 11' ' ' ILE . . . . . . . . . . . . . 3.0 mt -121.58 156.36 25.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 N-CA-C 108.625 -0.88 . . . . 184.99 108.625 -179.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 12' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -152.71 165.73 34.39 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.432 -0.803 . . . . 195.68 109.108 173.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 13' ' ' VAL . . . . . . . . . . . . . 99.0 t -67.52 129.99 32.48 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 CA-C-N 115.059 -0.973 . . . . 154.68 109.7 -178.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 14' ' ' THR . . . . . . . . . . . . . 40.6 p -118.41 151.75 37.18 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.449 -0.574 . . . . 130.46 109.449 -178.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 15' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -103.74 176.25 5.21 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 122.098 0.951 . . . . 111.87 110.7 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 tt -130.46 124.02 31.07 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 107.768 -1.197 . . . . 101.32 107.768 -170.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 17' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -125.94 107.92 10.92 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.31 -0.626 . . . . 116.72 109.31 -176.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 18' ' ' LEU . . . . . . . . . . . . . 50.3 mt -112.67 13.62 19.93 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 113.278 0.844 . . . . 109.58 113.278 176.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 19' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -60.87 -37.42 82.08 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.198 -0.601 . . . . 119.56 111.139 -173.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 20' ' ' TYR . . . . . . . . . . . . . 45.2 t80 -65.14 -48.38 73.77 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.908 0.385 . . . . 132.85 111.006 177.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 21' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -60.81 -42.38 97.55 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.648 -0.421 . . . . 105.96 111.47 179.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 22' ' ' MET . . . . . . . . . . . . . 67.4 mtm -66.64 -35.72 80.86 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.678 -0.809 . . . . 96.11 111.221 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 23' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -56.73 -45.49 81.9 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 120.242 -0.583 . . . . 127.56 110.603 171.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -36.22 79.8 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.648 -0.421 . . . . 124.12 111.798 176.365 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' b' b ' 25' ' ' LEU . . . . . . . . . . . . . 17.8 mt -65.75 -44.93 84.46 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 119.712 -0.795 . . . . 98.96 111.359 178.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 26' ' ' GLU . . . . . . . . . . . . . 80.7 mt-10 -61.74 -40.71 96.05 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.161 -0.616 . . . . 114.28 110.957 176.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 27' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -55.63 -42.65 75.26 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 120.755 0.312 . . . . 134.43 111.181 173.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.33 -38.36 78.15 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.919 -0.313 . . . . 110.88 111.455 -177.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 29' ' ' ILE . . . . . . . . . . . . . 10.7 pt -70.87 -26.46 27.88 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 C-N-CA 118.691 -1.203 . . . . 115.4 110.343 177.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 30' ' ' LYS . . . . . . . . . . . . . 15.8 mtmt -67.52 -46.65 72.25 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 119.911 -0.716 . . . . 145.67 110.888 172.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 31' ' ' LYS . . . . . . . . . . . . . 43.7 mttt -70.96 -10.51 59.83 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 112.745 0.646 . . . . 166.9 112.745 177.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 32' ' ' LEU . . . . . . . . . . . . . 53.0 mt -82.18 -43.04 18.21 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 118.272 0.487 . . . . 164.59 110.759 166.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 33' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -59.95 -24.21 64.2 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 112.042 0.386 . . . . 173.43 112.042 174.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 34' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -80.86 2.38 26.72 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 113.788 1.032 . . . . 187.53 113.788 -179.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 35' ' ' SER . . . . . . . . . . . . . 75.1 m -113.03 20.63 16.17 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 119.277 0.944 . . . . 172.0 113.243 -178.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 36' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -77.48 143.0 38.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 118.33 0.514 . . . . 170.82 110.886 179.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 37' ' ' ILE . . . . . . . . . . . . . 12.3 mt -111.79 114.27 46.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 108.144 -1.058 . . . . 168.88 108.144 -170.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 38' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -75.87 153.34 36.84 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.277 0.561 . . . . 166.49 109.715 170.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 mp -61.69 -65.82 0.63 Allowed 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.778 -0.647 . . . . 151.58 111.244 -176.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 40' ' ' LYS . . . . . . . . . . . . . 75.1 mttt . . . . . 0 N--CA 1.463 0.201 0 C-N-CA 122.876 0.47 . . . . 157.73 111.848 -179.404 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' c' c ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tt . . . . . 0 N--CA 1.456 -0.137 0 N-CA-C 109.779 -0.452 . . . . 197.98 109.779 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' c' c ' 12' ' ' ASN . . . . . . . . . . . . . 28.3 p30 -157.12 156.14 32.22 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.411 -0.589 . . . . 167.65 109.411 -176.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 13' ' ' VAL . . . . . . . . . . . . . 86.3 t -100.44 126.51 54.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 N-CA-C 107.847 -1.168 . . . . 154.37 107.847 170.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 14' ' ' THR . . . . . . . . . . . . . 40.4 p -121.45 153.1 38.34 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.102 0.477 . . . . 141.55 110.219 -176.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 15' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -103.09 175.67 5.4 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.662 0.744 . . . . 123.59 109.399 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 16' ' ' LEU . . . . . . . . . . . . . 2.9 tt -130.74 124.3 31.16 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.265 -0.643 . . . . 106.66 109.265 -169.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 17' ' ' ASP . . . . . . . . . . . . . 46.8 t0 -126.96 108.18 10.73 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 123.403 0.681 . . . . 111.78 109.163 -178.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 18' ' ' LEU . . . . . . . . . . . . . 51.2 mt -112.84 12.98 19.61 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 113.515 0.932 . . . . 106.74 113.515 176.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 19' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -72.46 -25.67 61.53 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 119.358 -0.937 . . . . 124.0 112.579 -170.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 20' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -61.92 -48.08 82.02 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 119.555 -0.858 . . . . 117.96 110.478 167.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 21' ' ' GLU . . . . . . . . . . . . . 39.0 mp0 -60.31 -40.84 92.01 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.876 -0.33 . . . . 100.98 111.283 178.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 22' ' ' MET . . . . . . . . . . . . . 58.5 mtt -66.51 -37.27 84.69 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.038 -0.665 . . . . 106.92 111.247 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 23' ' ' LYS . . . . . . . . . . . . . 63.4 mttt -58.55 -51.59 69.23 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.994 0.426 . . . . 126.96 110.765 173.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 24' ' ' LYS . . . . . . . . . . . . . 1.8 mmmm -59.81 -37.53 79.4 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.6 -0.273 . . . . 115.96 111.227 179.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 25' ' ' LEU . . . . . . . . . . . . . 18.5 mt -66.13 -44.81 83.13 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.949 -0.3 . . . . 119.1 111.61 179.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 26' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -66.78 -34.07 77.02 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 118.987 -1.085 . . . . 137.36 111.747 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 27' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -57.85 -43.71 86.05 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.96 -0.696 . . . . 140.2 110.84 170.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.65 -37.7 88.48 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.745 -0.382 . . . . 125.03 111.55 179.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 29' ' ' ILE . . . . . . . . . . . . . 83.4 mt -65.6 -46.56 89.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 CA-C-O 121.046 0.451 . . . . 128.63 110.612 179.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 30' ' ' LYS . . . . . . . . . . . . . 15.0 mtmt -59.41 -44.0 92.92 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 119.752 -0.779 . . . . 145.29 110.948 176.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 31' ' ' LYS . . . . . . . . . . . . . 43.9 mttt -62.35 -24.65 67.47 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.439 -0.504 . . . . 133.48 111.995 175.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 32' ' ' LEU . . . . . . . . . . . . . 50.3 mt -72.27 -43.3 64.49 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.492 -0.483 . . . . 130.52 111.127 173.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 33' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -67.61 -25.69 65.88 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 119.856 -0.738 . . . . 148.33 112.04 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 34' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -79.99 3.5 19.92 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 113.017 0.747 . . . . 149.15 113.017 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 35' ' ' SER . . . . . . . . . . . . . 74.2 m -111.94 23.4 13.83 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.142 0.577 . . . . 151.17 112.5 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 36' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -74.97 143.79 43.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.268 0.556 . . . . 175.99 111.177 -179.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 37' ' ' ILE . . . . . . . . . . . . . 3.9 tp -77.17 -18.35 14.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 114.262 1.208 . . . . 194.65 114.262 -168.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 38' ' ' ASP . . . . . . . . . . . . . 25.8 t0 62.84 2.33 0.97 Allowed 'General case' 0 C--O 1.237 0.421 0 C-N-CA 125.744 1.618 . . . . 214.96 113.105 178.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 41.51 71.81 0.19 Allowed 'General case' 0 C--O 1.236 0.343 0 C-N-CA 125.995 1.718 . . . . 217.34 114.191 178.487 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' c' c ' 40' ' ' LYS . . . . . . . . . . . . . 96.3 mttt . . . . . 0 C--N 1.331 -0.236 0 CA-C-O 120.91 0.386 . . . . 209.69 110.991 175.7 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 986' ' ' THR . . . . . . . . . . . . . 2.1 t . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.672 0.272 . . . . 192.42 111.243 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 987' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -60.0 -50.78 72.4 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 116.146 -0.479 . . . . 207.37 111.087 -179.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 988' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -66.97 -28.79 68.55 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.509 -0.476 . . . . 189.36 111.64 179.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 989' ' ' VAL . . . . . . . . . . . . . 32.3 t -65.22 -40.53 88.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 C-N-CA 120.36 -0.536 . . . . 191.88 110.125 174.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -71.14 -34.0 70.62 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.232 -0.587 . . . . 201.51 111.516 178.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 991' ' ' SER . . . . . . . . . . . . . 39.0 t -66.27 -46.21 77.81 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.317 -0.553 . . . . 172.44 111.11 176.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 992' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -59.96 -47.67 84.86 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 120.916 0.389 . . . . 166.02 111.021 176.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 993' ' ' ASN . . . . . 0.481 ' O ' HG12 ' A' ' 997' ' ' ILE . 18.0 m-20 -51.98 -50.61 60.93 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.932 0.396 . . . . 153.71 111.089 174.967 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 994' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -60.66 -45.8 92.76 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 120.781 0.324 . . . . 142.32 111.529 -176.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 995' ' ' LYS . . . . . . . . . . . . . 37.5 tttt -58.95 -43.89 91.33 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.315 -0.554 . . . . 155.91 111.16 177.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 996' ' ' LEU . . . . . . . . . . . . . 28.2 tp -61.68 -41.18 97.22 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 120.059 -0.656 . . . . 144.68 111.398 177.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 997' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 993' ' ' ASN . 15.3 mm -55.21 -53.02 39.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-O 121.234 0.54 . . . . 138.05 110.224 176.039 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 998' ' ' ALA . . . . . . . . . . . . . . . -59.66 -39.57 84.86 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.504 -0.478 . . . . 121.88 111.209 -178.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 999' ' ' ASN . . . . . . . . . . . . . 23.8 m-20 -63.01 -54.08 43.81 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.903 -0.319 . . . . 136.73 111.088 -178.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1000 ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -59.74 -38.59 82.17 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 120.296 -0.562 . . . . 142.19 111.111 -179.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1001 ' ' PHE . . . . . . . . . . . . . 92.2 t80 -57.49 -52.79 63.94 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.856 -0.337 . . . . 126.78 111.122 175.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1002 ' ' ASN . . . . . . . . . . . . . 36.2 m-20 -58.36 -42.97 88.1 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 120.836 -0.346 . . . . 144.51 111.788 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1003 ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -59.58 -51.39 70.03 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 120.491 -0.484 . . . . 156.23 111.179 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1004 ' ' ALA . . . . . . . . . . . . . . . -55.94 -39.2 71.35 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.152 -0.619 . . . . 131.53 111.223 176.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1005 ' ' LEU . . . . . 0.442 HD11 ' O ' ' A' ' 32' ' ' LEU . 1.3 tm? -59.43 -50.91 72.1 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.755 0.312 . . . . 119.32 111.214 179.354 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1006 ' ' GLY . . . . . . . . . . . . . . . -57.99 -44.98 94.32 Favored Glycine 0 C--N 1.336 0.528 0 C-N-CA 120.092 -1.051 . . . . 112.98 112.754 177.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1007 ' ' ALA . . . . . . . . . . . . . . . -56.76 -41.51 77.74 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.029 -0.668 . . . . 106.39 111.168 177.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1008 ' ' MET . . . . . . . . . . . . . 32.1 mtp -66.79 -43.1 84.84 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.58 -0.448 . . . . 98.13 111.709 -179.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1009 ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -57.24 -47.21 81.93 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 120.127 -0.629 . . . . 100.14 111.018 177.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1010 ' ' THR . . . . . . . . . . . . . 5.5 p -58.5 -41.51 85.53 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 119.824 -0.75 . . . . 96.34 111.078 175.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1011 ' ' GLY . . . . . . . . . . . . . . . -59.13 -56.12 27.0 Favored Glycine 0 N--CA 1.45 -0.429 0 N-CA-C 113.806 0.282 . . . . 83.81 113.806 179.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1012 ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -63.38 -39.25 94.01 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.723 -0.391 . . . . 79.73 111.635 -178.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1013 ' ' THR . . . . . . . . . . . . . 40.0 m -57.41 -49.04 77.49 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 120.007 -0.677 . . . . 80.28 110.814 175.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1014 ' ' THR . . . . . . . . . . . . . 52.8 m -59.09 -44.48 91.93 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.835 -0.346 . . . . 84.09 111.43 178.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1015 ' ' THR . . . . . 0.445 HG23 ' HE2' ' C' 1019 ' ' PHE . 90.4 m -58.13 -38.63 76.91 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 120.722 -0.391 . . . . 79.76 111.269 177.106 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1016 ' ' ASN . . . . . . . . . . . . . 20.6 t30 -64.51 -46.65 82.05 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 120.748 -0.381 . . . . 90.31 110.856 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 90.5 mt-10 -57.84 -45.29 86.43 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 120.404 -0.519 . . . . 96.75 110.792 177.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1018 ' ' ALA . . . . . . . . . . . . . . . -57.75 -41.63 82.29 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 116.423 -0.353 . . . . 75.03 111.299 177.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -66.32 -34.16 77.36 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 119.708 -0.797 . . . . 71.79 111.555 178.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1020 ' ' ARG . . . . . 0.537 ' HA ' ' HE1' ' A' ' 22' ' ' MET . 0.7 OUTLIER -57.55 -50.92 71.5 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 120.327 -0.549 . . . . 76.44 111.161 171.031 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A 1021 ' ' LYS . . . . . . . . . . . . . 89.9 mttt -61.3 -42.79 99.25 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 119.97 -0.692 . . . . 80.96 111.507 -178.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1022 ' ' VAL . . . . . . . . . . . . . 70.3 t -61.17 -47.09 95.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 CA-C-O 121.077 0.465 . . . . 70.36 110.462 179.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1023 ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -58.83 -46.35 87.87 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.446 -0.502 . . . . 78.0 111.043 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1024 ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -67.5 -35.29 78.84 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 119.788 -0.765 . . . . 93.59 111.49 -176.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -70.15 -52.21 25.34 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 120.238 -0.585 . . . . 80.72 111.218 179.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1026 ' ' VAL . . . . . 0.411 HG11 HD12 ' A' ' 16' ' ' LEU . 67.1 t -56.36 -41.28 70.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 120.925 0.393 . . . . 70.77 110.643 177.869 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1027 ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -65.37 -45.77 82.78 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.241 -0.583 . . . . 71.34 111.281 179.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1028 ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -61.74 -41.88 98.23 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.066 -0.654 . . . . 84.73 111.525 -179.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -75.0 -34.99 62.02 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 119.357 -0.937 . . . . 80.37 111.991 -177.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1030 ' ' ALA . . . . . . . . . . . . . . . -60.13 -41.13 92.03 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 120.365 -0.534 . . . . 84.11 110.977 170.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1031 ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -63.05 -48.34 79.1 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 120.888 -0.325 . . . . 99.88 111.032 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -59.45 -44.0 93.04 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 120.382 -0.527 . . . . 83.22 111.329 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1033 ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.11 -46.3 85.79 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 120.66 -0.416 . . . . 82.57 111.194 177.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1034 ' ' SER . . . . . . . . . . . . . 8.5 t -63.83 -39.0 93.19 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 120.543 -0.463 . . . . 87.55 111.294 -178.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1035 ' ' LYS . . . . . . . . . . . . . 39.5 tttp -61.08 -44.09 97.9 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 120.503 -0.479 . . . . 100.43 111.114 175.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1036 ' ' LEU . . . . . 0.478 HD21 HD12 ' C' 1036 ' ' LEU . 54.9 tp -58.45 -51.31 70.36 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.025 0.441 . . . . 88.48 111.1 179.163 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1037 ' ' ALA . . . . . . . . . . . . . . . -60.83 -44.18 97.27 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.604 -0.438 . . . . 86.06 111.551 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1038 ' ' SER . . . . . . . . . . . . . 78.2 p -61.19 -45.53 94.21 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 120.528 -0.469 . . . . 90.4 111.386 -178.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1039 ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -64.64 -46.31 83.07 Favored 'General case' 0 C--O 1.242 0.659 0 C-N-CA 119.946 -0.702 . . . . 100.64 111.107 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1040 ' ' LEU . . . . . . . . . . . . . 10.9 mt -57.32 -46.17 83.49 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.16 -0.616 . . . . 83.94 110.924 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1041 ' ' SER . . . . . . . . . . . . . 1.3 p -65.03 -45.31 85.99 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 120.492 -0.483 . . . . 83.94 111.299 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1042 ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -60.17 -47.61 85.2 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.476 -0.49 . . . . 86.13 111.123 -178.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1043 ' ' THR . . . . . . . . . . . . . 85.2 m -69.39 -36.35 76.7 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.155 -1.018 . . . . 84.69 111.727 -177.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1044 ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -68.16 -38.43 82.07 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 119.289 -0.964 . . . . 89.74 111.113 179.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1045 ' ' GLY . . . . . . . . . . . . . . . -62.43 -42.2 99.72 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 119.873 -1.156 . . . . 90.83 112.454 171.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1046 ' ' ALA . . . . . . . . . . . . . . . -57.62 -49.48 76.29 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 122.332 -0.511 . . . . 95.55 111.279 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 17.3 mm -65.58 -42.85 93.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 120.164 -0.614 . . . . 97.59 111.105 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 11.7 t -51.59 -45.6 63.22 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.154 -0.618 . . . . 102.86 110.727 175.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1049 ' ' ALA . . . . . . . . . . . . . . . -62.71 -52.41 63.36 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.936 -0.306 . . . . 111.86 111.67 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 2.6 p -65.68 -52.27 52.89 Favored 'General case' 0 C--O 1.237 0.435 0 O-C-N 122.048 -0.407 . . . . 114.68 111.632 -170.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1051 ' ' ILE . . . . . 0.421 ' HA ' ' HB ' ' A' 1054 ' ' ILE . 7.7 pt -68.01 -26.42 34.5 Favored 'Isoleucine or valine' 0 C--O 1.24 0.59 0 C-N-CA 119.151 -1.02 . . . . 118.91 110.353 178.07 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1052 ' ' GLY . . . . . . . . . . . . . . . -54.27 -42.62 74.0 Favored Glycine 0 C--N 1.336 0.567 0 C-N-CA 119.382 -1.39 . . . . 125.89 111.442 166.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1053 ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -66.69 -31.07 71.5 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.305 -0.558 . . . . 129.24 110.667 175.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1054 ' ' ILE . . . . . 0.421 ' HB ' ' HA ' ' A' 1051 ' ' ILE . 3.6 mt -59.36 -32.53 48.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 109.811 -0.44 . . . . 129.93 109.811 173.69 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1055 ' ' ILE . . . . . . . . . . . . . 41.0 mt . . . . . 0 C--N 1.33 -0.252 0 C-N-CA 119.917 -0.713 . . . . 136.37 109.193 170.083 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 986' ' ' THR . . . . . . . . . . . . . 19.6 p . . . . . 0 N--CA 1.458 -0.038 0 CA-C-O 120.663 0.268 . . . . 191.6 111.236 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 987' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -59.94 -41.65 92.3 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 116.096 -0.502 . . . . 197.57 111.594 -178.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 988' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 -61.01 -46.6 90.09 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 120.891 0.377 . . . . 188.18 111.27 -177.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 989' ' ' VAL . . . . . . . . . . . . . 37.3 t -60.86 -39.56 82.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 120.985 0.421 . . . . 181.18 110.589 -177.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 990' ' ' LEU . . . . . . . . . . . . . 9.7 mp -70.63 -34.44 72.08 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.136 -0.626 . . . . 183.64 111.751 179.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 991' ' ' SER . . . . . . . . . . . . . 27.4 p -65.85 -52.62 48.87 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 119.938 -0.705 . . . . 168.15 111.219 176.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 992' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -60.35 -40.24 90.04 Favored 'General case' 0 C--O 1.241 0.621 0 C-N-CA 120.397 -0.521 . . . . 159.25 111.2 178.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 993' ' ' ASN . . . . . 0.455 ' O ' HG12 ' B' ' 997' ' ' ILE . 16.0 m-20 -58.48 -42.24 87.07 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.609 -0.436 . . . . 157.08 110.933 175.626 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 994' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -58.33 -41.92 85.62 Favored 'General case' 0 C--O 1.239 0.5 0 C-N-CA 120.547 -0.461 . . . . 168.42 111.148 174.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 995' ' ' LYS . . . . . . . . . . . . . 23.3 tttp -55.79 -44.53 77.85 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 120.023 -0.671 . . . . 157.21 110.94 175.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 996' ' ' LEU . . . . . 0.449 HD22 ' HD2' ' A' ' 40' ' ' LYS . 26.2 tp -60.61 -41.07 94.04 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 120.144 -0.622 . . . . 148.5 111.081 176.688 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 997' ' ' ILE . . . . . 0.696 HD13 HD13 ' A' ' 37' ' ' ILE . 14.5 mm -54.94 -54.04 27.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 121.303 0.573 . . . . 149.02 110.484 177.378 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 998' ' ' ALA . . . . . . . . . . . . . . . -61.4 -42.84 99.37 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 120.5 -0.48 . . . . 126.52 111.843 -177.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 999' ' ' ASN . . . . . . . . . . . . . 10.5 m-80 -63.58 -54.81 30.26 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 119.896 -0.722 . . . . 130.61 111.325 -177.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1000 ' ' LYS . . . . . . . . . . . . . 52.9 mttm -60.53 -36.72 79.09 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.065 -0.654 . . . . 125.08 111.443 -179.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1001 ' ' PHE . . . . . . . . . . . . . 92.2 t80 -57.9 -53.26 60.24 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.669 -0.413 . . . . 121.77 111.265 175.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1002 ' ' ASN . . . . . . . . . . . . . 36.8 m-20 -57.67 -42.58 83.86 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 120.272 -0.571 . . . . 129.77 111.387 179.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1003 ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -58.35 -49.47 77.1 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-O 121.068 0.461 . . . . 128.87 110.907 178.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1004 ' ' ALA . . . . . 0.472 ' O ' ' HG3' ' B' 1008 ' ' MET . . . -55.34 -38.99 69.46 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.664 -0.414 . . . . 112.24 111.214 175.664 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B 1005 ' ' LEU . . . . . . . . . . . . . 6.0 mt -58.9 -49.4 77.93 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 120.768 -0.373 . . . . 115.34 111.102 178.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1006 ' ' GLY . . . . . . . . . . . . . . . -56.61 -43.81 91.1 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 119.718 -1.229 . . . . 100.84 112.339 176.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -56.46 -39.72 73.64 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.349 -0.54 . . . . 92.34 111.063 176.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1008 ' ' MET . . . . . 0.472 ' HG3' ' O ' ' B' 1004 ' ' ALA . 38.2 mtt -65.57 -43.37 90.0 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.937 -0.305 . . . . 98.2 111.08 179.943 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B 1009 ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -57.4 -47.87 80.58 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 120.49 -0.484 . . . . 107.75 111.028 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1010 ' ' THR . . . . . . . . . . . . . 3.1 m -59.46 -43.5 93.19 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 119.893 -0.723 . . . . 92.36 111.525 177.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1011 ' ' GLY . . . . . . . . . . . . . . . -59.81 -56.61 23.85 Favored Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 114.356 0.502 . . . . 83.25 114.356 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1012 ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -64.33 -38.92 92.73 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.268 -0.573 . . . . 84.8 111.566 -178.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1013 ' ' THR . . . . . . . . . . . . . 33.6 m -57.73 -49.1 77.67 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 120.125 -0.63 . . . . 79.15 111.019 175.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1014 ' ' THR . . . . . . . . . . . . . 53.1 m -59.04 -44.19 91.75 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.781 -0.367 . . . . 80.92 111.3 178.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1015 ' ' THR . . . . . . . . . . . . . 88.6 m -58.06 -38.31 76.07 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.519 -0.473 . . . . 78.92 111.19 176.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 19.3 t30 -64.7 -49.02 72.53 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 120.796 0.331 . . . . 98.81 111.229 179.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1017 ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -59.63 -45.76 91.02 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 120.267 -0.573 . . . . 92.19 111.166 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1018 ' ' ALA . . . . . . . . . . . . . . . -58.14 -42.48 85.98 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.777 -0.369 . . . . 74.98 111.39 178.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1019 ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -66.62 -33.1 74.9 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 119.683 -0.807 . . . . 73.22 111.766 178.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1020 ' ' ARG . . . . . . . . . . . . . 4.0 ttm180 -62.83 -44.0 97.3 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.172 -1.011 . . . . 100.22 111.446 172.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1021 ' ' LYS . . . . . . . . . . . . . 89.2 mttt -60.93 -42.99 99.21 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 119.749 -0.781 . . . . 79.73 111.436 177.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1022 ' ' VAL . . . . . . . . . . . . . 64.9 t -61.61 -46.6 96.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-O 121.096 0.474 . . . . 87.2 110.341 178.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1023 ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -59.48 -48.45 81.61 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 122.055 -0.403 . . . . 108.68 111.479 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1024 ' ' ASP . . . . . . . . . . . . . 3.1 p30 -68.65 -33.62 74.3 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.407 -0.917 . . . . 120.55 111.837 -177.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1025 ' ' ALA . . . . . . . . . . . . . . . -70.15 -52.16 25.69 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 119.983 -0.687 . . . . 99.48 111.113 179.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1026 ' ' VAL . . . . . . . . . . . . . 56.4 t -56.45 -41.97 73.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-O 120.964 0.411 . . . . 93.9 110.609 177.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1027 ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -65.47 -45.2 84.65 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.545 -0.462 . . . . 90.21 111.155 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1028 ' ' ASN . . . . . 0.482 ' ND2' ' O ' ' A' ' 12' ' ' ASN . 1.9 t30 -61.46 -41.81 97.8 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 120.715 -0.394 . . . . 86.1 111.421 -179.283 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B 1029 ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -75.35 -34.14 61.15 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 119.859 -0.736 . . . . 80.31 111.66 -177.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1030 ' ' ALA . . . . . . . . . . . . . . . -59.57 -41.06 89.34 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 120.295 -0.562 . . . . 83.42 110.789 170.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1031 ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -62.91 -47.89 81.31 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.948 -0.301 . . . . 109.62 111.072 178.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1032 ' ' ALA . . . . . . . . . . . . . . . -59.4 -44.09 92.89 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 120.21 -0.596 . . . . 87.51 111.353 178.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1033 ' ' LEU . . . . . . . . . . . . . 51.0 tp -58.55 -45.99 87.78 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 120.709 -0.397 . . . . 89.81 111.151 177.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1034 ' ' SER . . . . . . . . . . . . . 8.5 t -63.71 -38.97 93.12 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.586 -0.446 . . . . 101.28 111.386 -178.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1035 ' ' LYS . . . . . . . . . . . . . 19.5 ttmt -61.98 -43.63 98.43 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.247 -0.581 . . . . 113.42 111.188 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1036 ' ' LEU . . . . . . . . . . . . . 1.1 tt -58.28 -52.59 64.94 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 120.945 0.403 . . . . 102.0 111.239 178.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1037 ' ' ALA . . . . . . . . . . . . . . . -58.1 -42.71 86.27 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.586 -0.446 . . . . 108.65 111.419 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1038 ' ' SER . . . . . . . . . . . . . 30.0 t -61.0 -43.32 99.05 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 120.638 -0.425 . . . . 116.34 111.373 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1039 ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -63.08 -48.69 77.55 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 120.729 -0.388 . . . . 121.08 110.838 179.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1040 ' ' LEU . . . . . . . . . . . . . 12.3 mt -59.06 -45.64 90.28 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.58 -0.448 . . . . 101.01 111.408 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1041 ' ' SER . . . . . . . . . . . . . 45.3 t -65.58 -47.03 77.14 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 120.408 -0.517 . . . . 106.41 111.375 -177.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1042 ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -61.38 -47.3 86.46 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.515 -0.474 . . . . 108.63 111.091 -179.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1043 ' ' THR . . . . . . . . . . . . . 5.4 p -68.97 -36.62 78.09 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 119.798 -0.761 . . . . 100.49 111.646 -176.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1044 ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -69.56 -39.01 77.65 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 119.856 -0.738 . . . . 96.6 111.284 179.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1045 ' ' GLY . . . . . . . . . . . . . . . -61.46 -42.02 99.68 Favored Glycine 0 C--N 1.336 0.563 0 C-N-CA 119.781 -1.2 . . . . 99.93 112.204 172.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1046 ' ' ALA . . . . . . . . . . . . . . . -58.01 -47.92 81.57 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 122.41 -0.465 . . . . 95.64 111.294 177.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1047 ' ' ILE . . . . . 0.554 ' O ' HG12 ' B' 1051 ' ' ILE . 73.3 mt -63.51 -45.11 98.67 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 C-N-CA 120.333 -0.547 . . . . 92.09 110.089 -178.565 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B 1048 ' ' SER . . . . . . . . . . . . . 1.4 m -51.75 -45.02 63.53 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.081 0.467 . . . . 101.39 110.897 175.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1049 ' ' ALA . . . . . . . . . . . . . . . -60.61 -51.06 70.99 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.465 -0.334 . . . . 113.31 111.11 177.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1050 ' ' SER . . . . . . . . . . . . . 2.9 p -67.28 -62.04 1.62 Allowed 'General case' 0 C--O 1.24 0.578 0 C-N-CA 120.41 -0.516 . . . . 117.95 111.592 -172.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1051 ' ' ILE . . . . . 0.554 HG12 ' O ' ' B' 1047 ' ' ILE . 46.8 pt -64.64 -27.93 43.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 119.15 -1.02 . . . . 119.1 110.445 -177.507 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B 1052 ' ' GLY . . . . . . . . . . . . . . . -56.19 -42.32 87.85 Favored Glycine 0 C--N 1.336 0.547 0 C-N-CA 119.724 -1.227 . . . . 140.8 112.307 166.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1053 ' ' ASP . . . . . . . . . . . . . 81.2 m-20 -66.77 -28.87 68.74 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.296 -0.532 . . . . 155.92 111.898 177.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1054 ' ' ILE . . . . . . . . . . . . . 1.6 mp -56.76 -36.84 50.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 C-N-CA 120.117 -0.633 . . . . 150.85 110.917 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1055 ' ' ILE . . . . . . . . . . . . . 5.6 tp . . . . . 0 C--N 1.33 -0.271 0 O-C-N 121.559 -0.713 . . . . 157.04 109.929 172.76 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 986' ' ' THR . . . . . . . . . . . . . 71.0 p . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.733 0.301 . . . . 198.28 111.078 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 987' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -60.41 -37.11 79.81 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.916 -0.584 . . . . 196.84 111.541 -179.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 988' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -69.57 -48.25 60.91 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.703 -0.399 . . . . 204.14 111.139 -178.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 989' ' ' VAL . . . . . . . . . . . . . 31.5 t -57.63 -38.27 63.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-O 121.097 0.475 . . . . 180.01 110.393 175.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 990' ' ' LEU . . . . . . . . . . . . . 3.4 mt -69.49 -35.66 75.77 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.386 -0.525 . . . . 168.09 111.101 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 991' ' ' SER . . . . . . . . . . . . . 25.1 p -67.33 -43.08 82.48 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.474 -0.49 . . . . 170.03 111.352 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 992' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -61.3 -51.88 67.04 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-O 121.093 0.473 . . . . 183.29 111.012 177.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 993' ' ' ASN . . . . . 0.448 ' O ' HG12 ' C' ' 997' ' ' ILE . 18.2 m-20 -54.07 -41.43 68.16 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.529 -0.305 . . . . 147.15 110.932 176.104 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 994' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -57.51 -44.99 85.45 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 120.85 0.357 . . . . 141.65 111.17 176.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 995' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -58.99 -44.74 91.66 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 122.194 -0.316 . . . . 153.64 111.301 177.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 996' ' ' LEU . . . . . . . . . . . . . 3.5 tt -61.26 -42.43 98.61 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 119.761 -0.776 . . . . 140.68 111.287 178.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 997' ' ' ILE . . . . . 0.467 HD13 HD13 ' B' ' 37' ' ' ILE . 16.5 mm -55.2 -51.3 56.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-O 121.144 0.497 . . . . 139.98 110.257 175.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 998' ' ' ALA . . . . . 0.698 ' HB1' HG21 ' C' ' 37' ' ' ILE . . . -59.9 -41.31 91.38 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.508 -0.477 . . . . 141.87 111.622 -178.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 999' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -63.87 -54.38 35.8 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 120.363 -0.535 . . . . 160.27 111.365 -178.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1000 ' ' LYS . . . . . 0.439 ' HD2' HG12 ' B' ' 37' ' ' ILE . 52.1 mttm -59.37 -36.73 76.29 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 119.84 -0.744 . . . . 145.09 111.038 179.653 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C 1001 ' ' PHE . . . . . . . . . . . . . 91.3 t80 -57.54 -53.1 61.93 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.602 0.239 . . . . 127.99 111.36 175.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1002 ' ' ASN . . . . . 0.408 HD21 HG22 ' C' ' 37' ' ' ILE . 36.1 m-20 -58.48 -43.03 88.81 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 120.592 -0.443 . . . . 138.89 111.717 180.0 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C 1003 ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -59.24 -49.41 77.94 Favored 'General case' 0 C--O 1.241 0.654 0 C-N-CA 120.257 -0.577 . . . . 135.78 110.877 178.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1004 ' ' ALA . . . . . . . . . . . . . . . -55.42 -38.03 68.42 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.571 -0.452 . . . . 113.42 111.269 174.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1005 ' ' LEU . . . . . 0.598 ' HA ' ' HE2' ' C' 1008 ' ' MET . 5.3 mt -58.62 -50.27 74.45 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.828 0.346 . . . . 111.27 110.894 177.966 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C 1006 ' ' GLY . . . . . . . . . . . . . . . -57.71 -44.63 94.02 Favored Glycine 0 C--N 1.336 0.534 0 C-N-CA 119.783 -1.199 . . . . 106.9 112.777 176.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1007 ' ' ALA . . . . . . . . . . . . . . . -57.84 -42.91 85.37 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 120.128 -0.629 . . . . 103.17 111.755 178.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1008 ' ' MET . . . . . 0.598 ' HE2' ' HA ' ' C' 1005 ' ' LEU . 5.3 mtm -67.57 -41.93 83.4 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.151 -0.619 . . . . 102.14 111.406 -179.358 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C 1009 ' ' GLN . . . . . 0.562 HE22 ' HB2' ' C' ' 33' ' ' GLU . 46.6 mt-30 -56.68 -45.94 81.44 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 120.293 -0.563 . . . . 116.46 110.921 175.824 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C 1010 ' ' THR . . . . . . . . . . . . . 75.4 m -57.85 -42.43 84.44 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.197 -0.601 . . . . 116.72 110.866 175.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1011 ' ' GLY . . . . . . . . . . . . . . . -59.84 -56.22 26.02 Favored Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 114.372 0.509 . . . . 100.36 114.372 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1012 ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -64.42 -40.03 94.99 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 117.031 0.416 . . . . 98.95 111.783 -178.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1013 ' ' THR . . . . . . . . . . . . . 31.0 m -58.19 -48.66 79.62 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 120.05 -0.66 . . . . 112.94 110.847 175.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1014 ' ' THR . . . . . . . . . . . . . 59.3 m -58.67 -44.23 90.13 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 116.572 -0.285 . . . . 105.35 111.32 178.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 89.6 m -58.47 -38.34 77.37 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.885 -0.326 . . . . 99.11 111.199 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1016 ' ' ASN . . . . . . . . . . . . . 18.3 t30 -65.09 -48.2 74.56 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 120.82 -0.352 . . . . 110.07 111.032 -179.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -59.7 -44.7 93.58 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 120.266 -0.574 . . . . 121.48 111.098 177.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1018 ' ' ALA . . . . . . . . . . . . . . . -57.53 -41.99 82.01 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.898 -0.321 . . . . 96.38 111.244 178.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1019 ' ' PHE . . . . . 0.445 ' HE2' HG23 ' A' 1015 ' ' THR . 4.2 m-85 -66.79 -33.47 75.69 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.918 -0.713 . . . . 85.34 111.396 177.995 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C 1020 ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 -55.76 -52.62 63.31 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.245 -0.582 . . . . 109.24 110.721 170.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1021 ' ' LYS . . . . . . . . . . . . . 90.7 mttt -61.88 -42.25 98.84 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.491 -0.484 . . . . 100.72 111.522 -177.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1022 ' ' VAL . . . . . . . . . . . . . 64.7 t -60.7 -47.06 94.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-O 121.153 0.501 . . . . 76.46 110.375 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1023 ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -58.85 -46.21 88.28 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.666 -0.414 . . . . 89.81 111.084 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1024 ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -67.29 -35.45 79.51 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 119.879 -0.728 . . . . 97.57 111.434 -176.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1025 ' ' ALA . . . . . . . . . . . . . . . -70.08 -51.74 29.45 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 120.254 -0.579 . . . . 88.12 111.188 179.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1026 ' ' VAL . . . . . . . . . . . . . 62.8 t -56.24 -41.28 69.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 120.911 0.386 . . . . 94.02 110.642 177.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1027 ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -65.63 -45.84 81.56 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.441 -0.503 . . . . 110.01 111.379 -179.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1028 ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -61.86 -41.81 98.29 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.184 -0.606 . . . . 124.96 111.478 -179.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1029 ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -75.15 -34.86 61.67 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.565 -0.854 . . . . 104.51 112.133 -177.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1030 ' ' ALA . . . . . . . . . . . . . . . -60.47 -40.82 92.64 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.252 -0.579 . . . . 92.95 111.006 170.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1031 ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -63.01 -48.72 77.59 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.884 -0.326 . . . . 107.59 111.164 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1032 ' ' ALA . . . . . . . . . . . . . . . -59.8 -43.97 94.21 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 120.547 -0.461 . . . . 87.9 111.399 178.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1033 ' ' LEU . . . . . . . . . . . . . 50.9 tp -58.57 -46.14 87.52 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.807 -0.357 . . . . 76.26 111.184 177.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1034 ' ' SER . . . . . . . . . . . . . 8.3 t -63.77 -39.18 93.64 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.371 -0.532 . . . . 84.79 111.226 -178.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1035 ' ' LYS . . . . . . . . . . . . . 15.6 mmmt -60.52 -43.87 96.66 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.28 -0.568 . . . . 110.16 110.871 175.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1036 ' ' LEU . . . . . 0.478 HD12 HD21 ' A' 1036 ' ' LEU . 3.2 tm? -59.99 -50.79 72.35 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-O 120.831 0.348 . . . . 91.42 110.937 179.546 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C 1037 ' ' ALA . . . . . . . . . . . . . . . -60.18 -43.99 95.43 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 120.277 -0.569 . . . . 92.24 111.336 -179.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1038 ' ' SER . . . . . . . . . . . . . 77.9 p -60.19 -42.6 95.4 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.238 -0.585 . . . . 104.85 110.978 179.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1039 ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -63.05 -47.95 80.8 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 120.427 -0.509 . . . . 124.32 111.089 -179.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1040 ' ' LEU . . . . . 0.435 HD23 ' O ' ' C' 1036 ' ' LEU . 1.6 mm? -59.16 -47.06 86.69 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.295 -0.562 . . . . 111.28 111.454 179.329 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C 1041 ' ' SER . . . . . . . . . . . . . 31.2 t -65.58 -46.98 77.33 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 120.172 -0.611 . . . . 119.14 111.357 -176.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1042 ' ' ASN . . . . . . . . . . . . . 10.1 t30 -61.16 -46.86 88.76 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.463 -0.495 . . . . 141.74 111.09 -179.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1043 ' ' THR . . . . . . . . . . . . . 1.4 t -67.85 -35.58 78.81 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.773 -0.771 . . . . 114.11 111.381 -176.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1044 ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -70.45 -35.99 73.68 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.212 -0.595 . . . . 96.42 111.253 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1045 ' ' GLY . . . . . . . . . . . . . . . -61.96 -42.83 99.77 Favored Glycine 0 C--N 1.335 0.495 0 C-N-CA 119.327 -1.416 . . . . 92.28 112.086 170.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1046 ' ' ALA . . . . . . . . . . . . . . . -57.74 -49.53 76.24 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 122.357 -0.496 . . . . 101.73 111.274 177.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1047 ' ' ILE . . . . . . . . . . . . . 15.8 mm -64.92 -41.39 92.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 C-N-CA 120.114 -0.635 . . . . 83.73 110.773 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1048 ' ' SER . . . . . . . . . . . . . 11.1 t -51.09 -46.85 61.94 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 121.95 -0.469 . . . . 88.61 110.995 175.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1049 ' ' ALA . . . . . . . . . . . . . . . -64.1 -53.27 52.22 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.347 -0.541 . . . . 112.49 111.615 177.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1050 ' ' SER . . . . . . . . . . . . . 2.7 p -67.06 -26.86 66.95 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 112.63 0.604 . . . . 137.61 112.63 -169.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1051 ' ' ILE . . . . . . . . . . . . . 44.8 mt -88.46 -29.12 5.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 120.453 -0.499 . . . . 152.19 110.709 174.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1052 ' ' GLY . . . . . . . . . . . . . . . -55.63 -40.88 80.51 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.783 -0.722 . . . . 178.32 113.889 169.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1053 ' ' ASP . . . . . . . . . . . . . 3.0 p30 -64.65 -28.17 69.43 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.874 0.694 . . . . 203.19 112.874 -178.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1054 ' ' ILE . . . . . . . . . . . . . 5.7 mt -55.78 -37.03 45.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-N 118.102 0.41 . . . . 200.09 110.933 -178.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1055 ' ' ILE . . . . . . . . . . . . . 14.4 mt . . . . . 0 C--N 1.329 -0.3 0 O-C-N 121.709 -0.619 . . . . 191.38 110.375 174.822 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' a' a ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.736 0.303 . . . . 111.82 111.046 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' a' a ' 13' ' ' VAL . . . . . . . . . . . . . 98.4 t -99.77 127.6 52.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 108.318 -0.993 . . . . 106.42 108.318 177.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 14' ' ' THR . . . . . . . . . . . . . 41.1 p -121.08 153.95 36.77 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.213 0.53 . . . . 110.18 110.802 -176.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 15' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -102.44 176.1 5.29 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.426 -0.806 . . . . 109.39 109.349 177.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 tt -130.09 123.17 29.78 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.941 -1.133 . . . . 93.29 107.941 -171.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 17' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -127.08 108.18 10.69 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.102 -0.703 . . . . 92.08 109.102 -177.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 18' ' ' LEU . . . . . . . . . . . . . 54.0 mt -112.28 12.92 20.35 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 113.35 0.87 . . . . 78.73 113.35 177.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 19' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -59.98 -43.63 94.99 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 118.527 0.603 . . . . 89.4 111.428 -172.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 20' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -58.84 -47.7 83.95 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 120.86 0.362 . . . . 87.8 111.137 177.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 21' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -60.26 -40.89 91.94 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.744 -0.383 . . . . 69.84 111.238 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 22' ' ' MET . . . . . . . . . . . . . 59.4 mtt -65.74 -36.71 84.36 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.205 -0.598 . . . . 73.97 111.431 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 23' ' ' LYS . . . . . . . . . . . . . 62.9 mttt -67.56 -34.93 78.05 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.468 -0.893 . . . . 89.62 111.343 174.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 24' ' ' LYS . . . . . . . . . . . . . 17.8 mttt -60.02 -39.94 87.58 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 119.883 -0.727 . . . . 85.48 110.774 173.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 25' ' ' LEU . . . . . . . . . . . . . 19.3 mt -66.31 -43.19 86.94 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 120.312 -0.555 . . . . 80.79 110.931 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 26' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -54.45 -46.53 73.31 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.022 0.439 . . . . 96.41 110.984 175.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 27' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -64.32 -44.44 91.53 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.393 -0.523 . . . . 104.91 111.283 -178.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.97 -39.49 85.84 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 119.815 -0.754 . . . . 102.91 111.221 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 29' ' ' ILE . . . . . . . . . . . . . 81.7 mt -64.62 -34.91 72.93 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 120.575 -0.45 . . . . 113.0 110.343 176.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 30' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.29 -43.71 90.25 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 119.883 -0.727 . . . . 133.85 111.455 175.833 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' a' a ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -58.4 -42.47 87.2 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 119.801 -0.76 . . . . 128.27 111.143 174.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 32' ' ' LEU . . . . . . . . . . . . . 54.7 mt -58.78 -44.05 90.57 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.042 -0.663 . . . . 114.88 111.049 176.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 33' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -60.83 -33.78 73.55 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.573 -0.451 . . . . 122.07 111.372 175.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 34' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -82.11 3.56 26.54 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 112.72 0.637 . . . . 127.81 112.72 177.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 35' ' ' SER . . . . . . . . . . . . . 73.6 m -109.83 21.05 17.37 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 118.337 0.517 . . . . 124.49 112.389 -179.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 36' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -76.81 141.55 40.67 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.741 -0.466 . . . . 135.82 109.741 177.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 37' ' ' ILE . . . . . . . . . . . . . 3.4 mt -98.95 110.4 26.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 N-CA-C 106.927 -1.509 . . . . 144.57 106.927 -170.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 38' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -80.91 146.1 30.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.233 0.54 . . . . 154.71 109.93 178.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 39' ' ' LEU . . . . . . . . . . . . . 27.1 mt -59.05 -55.79 30.62 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.552 -0.749 . . . . 171.76 111.22 -173.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 40' ' ' LYS . . . . . . . . . . . . . 97.7 mttt 55.65 60.07 3.51 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.983 0.896 . . . . 166.92 111.13 177.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 41' ' ' GLU . . . . . . . . . . . . . 11.9 tm-20 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 115.043 -0.981 . . . . 205.94 109.91 178.471 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' b' b ' 10' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.776 0.322 . . . . 246.52 111.052 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' b' b ' 11' ' ' ILE . . . . . . . . . . . . . 3.0 mt -121.58 156.36 25.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 N-CA-C 108.625 -0.88 . . . . 184.99 108.625 -179.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 12' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -152.71 165.73 34.39 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.432 -0.803 . . . . 195.68 109.108 173.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 13' ' ' VAL . . . . . . . . . . . . . 99.0 t -67.52 129.99 32.48 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 CA-C-N 115.059 -0.973 . . . . 154.68 109.7 -178.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 14' ' ' THR . . . . . . . . . . . . . 40.6 p -118.41 151.75 37.18 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.449 -0.574 . . . . 130.46 109.449 -178.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 15' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -103.74 176.25 5.21 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 122.098 0.951 . . . . 111.87 110.7 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 tt -130.46 124.02 31.07 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 107.768 -1.197 . . . . 101.32 107.768 -170.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 17' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -125.94 107.92 10.92 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.31 -0.626 . . . . 116.72 109.31 -176.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 18' ' ' LEU . . . . . . . . . . . . . 50.3 mt -112.67 13.62 19.93 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 113.278 0.844 . . . . 109.58 113.278 176.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 19' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -60.87 -37.42 82.08 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.198 -0.601 . . . . 119.56 111.139 -173.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 20' ' ' TYR . . . . . . . . . . . . . 45.2 t80 -65.14 -48.38 73.77 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.908 0.385 . . . . 132.85 111.006 177.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 21' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -60.81 -42.38 97.55 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.648 -0.421 . . . . 105.96 111.47 179.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 22' ' ' MET . . . . . . . . . . . . . 67.4 mtm -66.64 -35.72 80.86 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.678 -0.809 . . . . 96.11 111.221 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 23' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -56.73 -45.49 81.9 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 120.242 -0.583 . . . . 127.56 110.603 171.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -36.22 79.8 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.648 -0.421 . . . . 124.12 111.798 176.365 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' b' b ' 25' ' ' LEU . . . . . . . . . . . . . 17.8 mt -65.75 -44.93 84.46 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 119.712 -0.795 . . . . 98.96 111.359 178.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 26' ' ' GLU . . . . . . . . . . . . . 80.7 mt-10 -61.74 -40.71 96.05 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.161 -0.616 . . . . 114.28 110.957 176.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 27' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -55.63 -42.65 75.26 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 120.755 0.312 . . . . 134.43 111.181 173.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.33 -38.36 78.15 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.919 -0.313 . . . . 110.88 111.455 -177.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 29' ' ' ILE . . . . . . . . . . . . . 10.7 pt -70.87 -26.46 27.88 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 C-N-CA 118.691 -1.203 . . . . 115.4 110.343 177.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 30' ' ' LYS . . . . . . . . . . . . . 15.8 mtmt -67.52 -46.65 72.25 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 119.911 -0.716 . . . . 145.67 110.888 172.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 31' ' ' LYS . . . . . . . . . . . . . 43.7 mttt -70.96 -10.51 59.83 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 112.745 0.646 . . . . 166.9 112.745 177.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 32' ' ' LEU . . . . . . . . . . . . . 53.0 mt -82.18 -43.04 18.21 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 118.272 0.487 . . . . 164.59 110.759 166.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 33' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -59.95 -24.21 64.2 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 112.042 0.386 . . . . 173.43 112.042 174.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 34' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -80.86 2.38 26.72 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 113.788 1.032 . . . . 187.53 113.788 -179.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 35' ' ' SER . . . . . . . . . . . . . 75.1 m -113.03 20.63 16.17 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 119.277 0.944 . . . . 172.0 113.243 -178.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 36' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -77.48 143.0 38.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 118.33 0.514 . . . . 170.82 110.886 179.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 37' ' ' ILE . . . . . . . . . . . . . 12.3 mt -111.79 114.27 46.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 108.144 -1.058 . . . . 168.88 108.144 -170.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 38' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -75.87 153.34 36.84 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.277 0.561 . . . . 166.49 109.715 170.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 mp -61.69 -65.82 0.63 Allowed 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.778 -0.647 . . . . 151.58 111.244 -176.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 40' ' ' LYS . . . . . . . . . . . . . 75.1 mttt . . . . . 0 N--CA 1.463 0.201 0 C-N-CA 122.876 0.47 . . . . 157.73 111.848 -179.404 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' c' c ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tt . . . . . 0 N--CA 1.456 -0.137 0 N-CA-C 109.779 -0.452 . . . . 197.98 109.779 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' c' c ' 12' ' ' ASN . . . . . . . . . . . . . 28.3 p30 -157.12 156.14 32.22 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.411 -0.589 . . . . 167.65 109.411 -176.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 13' ' ' VAL . . . . . . . . . . . . . 86.3 t -100.44 126.51 54.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 N-CA-C 107.847 -1.168 . . . . 154.37 107.847 170.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 14' ' ' THR . . . . . . . . . . . . . 40.4 p -121.45 153.1 38.34 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.102 0.477 . . . . 141.55 110.219 -176.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 15' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -103.09 175.67 5.4 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.662 0.744 . . . . 123.59 109.399 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 16' ' ' LEU . . . . . . . . . . . . . 2.9 tt -130.74 124.3 31.16 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.265 -0.643 . . . . 106.66 109.265 -169.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 17' ' ' ASP . . . . . . . . . . . . . 46.8 t0 -126.96 108.18 10.73 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 123.403 0.681 . . . . 111.78 109.163 -178.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 18' ' ' LEU . . . . . . . . . . . . . 51.2 mt -112.84 12.98 19.61 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 113.515 0.932 . . . . 106.74 113.515 176.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 19' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -72.46 -25.67 61.53 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 119.358 -0.937 . . . . 124.0 112.579 -170.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 20' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -61.92 -48.08 82.02 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 119.555 -0.858 . . . . 117.96 110.478 167.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 21' ' ' GLU . . . . . . . . . . . . . 39.0 mp0 -60.31 -40.84 92.01 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.876 -0.33 . . . . 100.98 111.283 178.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 22' ' ' MET . . . . . . . . . . . . . 58.5 mtt -66.51 -37.27 84.69 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.038 -0.665 . . . . 106.92 111.247 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 23' ' ' LYS . . . . . . . . . . . . . 63.4 mttt -58.55 -51.59 69.23 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.994 0.426 . . . . 126.96 110.765 173.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 24' ' ' LYS . . . . . . . . . . . . . 1.8 mmmm -59.81 -37.53 79.4 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.6 -0.273 . . . . 115.96 111.227 179.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 25' ' ' LEU . . . . . . . . . . . . . 18.5 mt -66.13 -44.81 83.13 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.949 -0.3 . . . . 119.1 111.61 179.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 26' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -66.78 -34.07 77.02 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 118.987 -1.085 . . . . 137.36 111.747 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 27' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -57.85 -43.71 86.05 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.96 -0.696 . . . . 140.2 110.84 170.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.65 -37.7 88.48 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.745 -0.382 . . . . 125.03 111.55 179.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 29' ' ' ILE . . . . . . . . . . . . . 83.4 mt -65.6 -46.56 89.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 CA-C-O 121.046 0.451 . . . . 128.63 110.612 179.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 30' ' ' LYS . . . . . . . . . . . . . 15.0 mtmt -59.41 -44.0 92.92 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 119.752 -0.779 . . . . 145.29 110.948 176.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 31' ' ' LYS . . . . . . . . . . . . . 43.9 mttt -62.35 -24.65 67.47 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.439 -0.504 . . . . 133.48 111.995 175.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 32' ' ' LEU . . . . . . . . . . . . . 50.3 mt -72.27 -43.3 64.49 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.492 -0.483 . . . . 130.52 111.127 173.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 33' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -67.61 -25.69 65.88 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 119.856 -0.738 . . . . 148.33 112.04 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 34' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -79.99 3.5 19.92 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 113.017 0.747 . . . . 149.15 113.017 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 35' ' ' SER . . . . . . . . . . . . . 74.2 m -111.94 23.4 13.83 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.142 0.577 . . . . 151.17 112.5 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 36' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -74.97 143.79 43.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.268 0.556 . . . . 175.99 111.177 -179.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 37' ' ' ILE . . . . . . . . . . . . . 3.9 tp -77.17 -18.35 14.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 114.262 1.208 . . . . 194.65 114.262 -168.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 38' ' ' ASP . . . . . . . . . . . . . 25.8 t0 62.84 2.33 0.97 Allowed 'General case' 0 C--O 1.237 0.421 0 C-N-CA 125.744 1.618 . . . . 214.96 113.105 178.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 41.51 71.81 0.19 Allowed 'General case' 0 C--O 1.236 0.343 0 C-N-CA 125.995 1.718 . . . . 217.34 114.191 178.487 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' c' c ' 40' ' ' LYS . . . . . . . . . . . . . 96.3 mttt . . . . . 0 C--N 1.331 -0.236 0 CA-C-O 120.91 0.386 . . . . 209.69 110.991 175.7 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 986' ' ' THR . . . . . . . . . . . . . 2.1 t . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.672 0.272 . . . . 192.42 111.243 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 987' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -60.0 -50.78 72.4 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 116.146 -0.479 . . . . 207.37 111.087 -179.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 988' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -66.97 -28.79 68.55 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.509 -0.476 . . . . 189.36 111.64 179.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 989' ' ' VAL . . . . . . . . . . . . . 32.3 t -65.22 -40.53 88.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 C-N-CA 120.36 -0.536 . . . . 191.88 110.125 174.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -71.14 -34.0 70.62 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 120.232 -0.587 . . . . 201.51 111.516 178.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 991' ' ' SER . . . . . . . . . . . . . 39.0 t -66.27 -46.21 77.81 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.317 -0.553 . . . . 172.44 111.11 176.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 992' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -59.96 -47.67 84.86 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 120.916 0.389 . . . . 166.02 111.021 176.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 993' ' ' ASN . . . . . 0.481 ' O ' HG12 ' A' ' 997' ' ' ILE . 18.0 m-20 -51.98 -50.61 60.93 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.932 0.396 . . . . 153.71 111.089 174.967 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 994' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -60.66 -45.8 92.76 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 120.781 0.324 . . . . 142.32 111.529 -176.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 995' ' ' LYS . . . . . . . . . . . . . 37.5 tttt -58.95 -43.89 91.33 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.315 -0.554 . . . . 155.91 111.16 177.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 996' ' ' LEU . . . . . . . . . . . . . 28.2 tp -61.68 -41.18 97.22 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 120.059 -0.656 . . . . 144.68 111.398 177.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 997' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 993' ' ' ASN . 15.3 mm -55.21 -53.02 39.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-O 121.234 0.54 . . . . 138.05 110.224 176.039 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 998' ' ' ALA . . . . . . . . . . . . . . . -59.66 -39.57 84.86 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.504 -0.478 . . . . 121.88 111.209 -178.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 999' ' ' ASN . . . . . . . . . . . . . 23.8 m-20 -63.01 -54.08 43.81 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.903 -0.319 . . . . 136.73 111.088 -178.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1000 ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -59.74 -38.59 82.17 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 120.296 -0.562 . . . . 142.19 111.111 -179.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1001 ' ' PHE . . . . . . . . . . . . . 92.2 t80 -57.49 -52.79 63.94 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.856 -0.337 . . . . 126.78 111.122 175.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1002 ' ' ASN . . . . . . . . . . . . . 36.2 m-20 -58.36 -42.97 88.1 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 120.836 -0.346 . . . . 144.51 111.788 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1003 ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -59.58 -51.39 70.03 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 120.491 -0.484 . . . . 156.23 111.179 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1004 ' ' ALA . . . . . . . . . . . . . . . -55.94 -39.2 71.35 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.152 -0.619 . . . . 131.53 111.223 176.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1005 ' ' LEU . . . . . 0.442 HD11 ' O ' ' A' ' 32' ' ' LEU . 1.3 tm? -59.43 -50.91 72.1 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.755 0.312 . . . . 119.32 111.214 179.354 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1006 ' ' GLY . . . . . . . . . . . . . . . -57.99 -44.98 94.32 Favored Glycine 0 C--N 1.336 0.528 0 C-N-CA 120.092 -1.051 . . . . 112.98 112.754 177.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1007 ' ' ALA . . . . . . . . . . . . . . . -56.76 -41.51 77.74 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.029 -0.668 . . . . 106.39 111.168 177.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1008 ' ' MET . . . . . . . . . . . . . 32.1 mtp -66.79 -43.1 84.84 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.58 -0.448 . . . . 98.13 111.709 -179.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1009 ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -57.24 -47.21 81.93 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 120.127 -0.629 . . . . 100.14 111.018 177.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1010 ' ' THR . . . . . . . . . . . . . 5.5 p -58.5 -41.51 85.53 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 119.824 -0.75 . . . . 96.34 111.078 175.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1011 ' ' GLY . . . . . . . . . . . . . . . -59.13 -56.12 27.0 Favored Glycine 0 N--CA 1.45 -0.429 0 N-CA-C 113.806 0.282 . . . . 83.81 113.806 179.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1012 ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -63.38 -39.25 94.01 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.723 -0.391 . . . . 79.73 111.635 -178.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1013 ' ' THR . . . . . . . . . . . . . 40.0 m -57.41 -49.04 77.49 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 120.007 -0.677 . . . . 80.28 110.814 175.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1014 ' ' THR . . . . . . . . . . . . . 52.8 m -59.09 -44.48 91.93 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.835 -0.346 . . . . 84.09 111.43 178.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1015 ' ' THR . . . . . 0.445 HG23 ' HE2' ' C' 1019 ' ' PHE . 90.4 m -58.13 -38.63 76.91 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 120.722 -0.391 . . . . 79.76 111.269 177.106 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1016 ' ' ASN . . . . . . . . . . . . . 20.6 t30 -64.51 -46.65 82.05 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 120.748 -0.381 . . . . 90.31 110.856 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1017 ' ' GLU . . . . . . . . . . . . . 90.5 mt-10 -57.84 -45.29 86.43 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 120.404 -0.519 . . . . 96.75 110.792 177.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1018 ' ' ALA . . . . . . . . . . . . . . . -57.75 -41.63 82.29 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 116.423 -0.353 . . . . 75.03 111.299 177.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1019 ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -66.32 -34.16 77.36 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 119.708 -0.797 . . . . 71.79 111.555 178.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1020 ' ' ARG . . . . . 0.537 ' HA ' ' HE1' ' A' ' 22' ' ' MET . 0.7 OUTLIER -57.55 -50.92 71.5 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 120.327 -0.549 . . . . 76.44 111.161 171.031 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A 1021 ' ' LYS . . . . . . . . . . . . . 89.9 mttt -61.3 -42.79 99.25 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 119.97 -0.692 . . . . 80.96 111.507 -178.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1022 ' ' VAL . . . . . . . . . . . . . 70.3 t -61.17 -47.09 95.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 CA-C-O 121.077 0.465 . . . . 70.36 110.462 179.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1023 ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -58.83 -46.35 87.87 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.446 -0.502 . . . . 78.0 111.043 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1024 ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -67.5 -35.29 78.84 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 119.788 -0.765 . . . . 93.59 111.49 -176.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -70.15 -52.21 25.34 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 120.238 -0.585 . . . . 80.72 111.218 179.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1026 ' ' VAL . . . . . 0.411 HG11 HD12 ' A' ' 16' ' ' LEU . 67.1 t -56.36 -41.28 70.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 120.925 0.393 . . . . 70.77 110.643 177.869 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1027 ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -65.37 -45.77 82.78 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.241 -0.583 . . . . 71.34 111.281 179.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1028 ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -61.74 -41.88 98.23 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.066 -0.654 . . . . 84.73 111.525 -179.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1029 ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -75.0 -34.99 62.02 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 119.357 -0.937 . . . . 80.37 111.991 -177.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1030 ' ' ALA . . . . . . . . . . . . . . . -60.13 -41.13 92.03 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 120.365 -0.534 . . . . 84.11 110.977 170.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1031 ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -63.05 -48.34 79.1 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 120.888 -0.325 . . . . 99.88 111.032 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -59.45 -44.0 93.04 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 120.382 -0.527 . . . . 83.22 111.329 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1033 ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.11 -46.3 85.79 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 120.66 -0.416 . . . . 82.57 111.194 177.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1034 ' ' SER . . . . . . . . . . . . . 8.5 t -63.83 -39.0 93.19 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 120.543 -0.463 . . . . 87.55 111.294 -178.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1035 ' ' LYS . . . . . . . . . . . . . 39.5 tttp -61.08 -44.09 97.9 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 120.503 -0.479 . . . . 100.43 111.114 175.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1036 ' ' LEU . . . . . 0.478 HD21 HD12 ' C' 1036 ' ' LEU . 54.9 tp -58.45 -51.31 70.36 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.025 0.441 . . . . 88.48 111.1 179.163 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1037 ' ' ALA . . . . . . . . . . . . . . . -60.83 -44.18 97.27 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.604 -0.438 . . . . 86.06 111.551 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1038 ' ' SER . . . . . . . . . . . . . 78.2 p -61.19 -45.53 94.21 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 120.528 -0.469 . . . . 90.4 111.386 -178.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1039 ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -64.64 -46.31 83.07 Favored 'General case' 0 C--O 1.242 0.659 0 C-N-CA 119.946 -0.702 . . . . 100.64 111.107 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1040 ' ' LEU . . . . . . . . . . . . . 10.9 mt -57.32 -46.17 83.49 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.16 -0.616 . . . . 83.94 110.924 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1041 ' ' SER . . . . . . . . . . . . . 1.3 p -65.03 -45.31 85.99 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 120.492 -0.483 . . . . 83.94 111.299 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1042 ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -60.17 -47.61 85.2 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.476 -0.49 . . . . 86.13 111.123 -178.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1043 ' ' THR . . . . . . . . . . . . . 85.2 m -69.39 -36.35 76.7 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.155 -1.018 . . . . 84.69 111.727 -177.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1044 ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -68.16 -38.43 82.07 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 119.289 -0.964 . . . . 89.74 111.113 179.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1045 ' ' GLY . . . . . . . . . . . . . . . -62.43 -42.2 99.72 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 119.873 -1.156 . . . . 90.83 112.454 171.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1046 ' ' ALA . . . . . . . . . . . . . . . -57.62 -49.48 76.29 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 122.332 -0.511 . . . . 95.55 111.279 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 17.3 mm -65.58 -42.85 93.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 120.164 -0.614 . . . . 97.59 111.105 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 11.7 t -51.59 -45.6 63.22 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.154 -0.618 . . . . 102.86 110.727 175.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1049 ' ' ALA . . . . . . . . . . . . . . . -62.71 -52.41 63.36 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.936 -0.306 . . . . 111.86 111.67 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 2.6 p -65.68 -52.27 52.89 Favored 'General case' 0 C--O 1.237 0.435 0 O-C-N 122.048 -0.407 . . . . 114.68 111.632 -170.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1051 ' ' ILE . . . . . 0.421 ' HA ' ' HB ' ' A' 1054 ' ' ILE . 7.7 pt -68.01 -26.42 34.5 Favored 'Isoleucine or valine' 0 C--O 1.24 0.59 0 C-N-CA 119.151 -1.02 . . . . 118.91 110.353 178.07 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1052 ' ' GLY . . . . . . . . . . . . . . . -54.27 -42.62 74.0 Favored Glycine 0 C--N 1.336 0.567 0 C-N-CA 119.382 -1.39 . . . . 125.89 111.442 166.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1053 ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -66.69 -31.07 71.5 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.305 -0.558 . . . . 129.24 110.667 175.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1054 ' ' ILE . . . . . 0.421 ' HB ' ' HA ' ' A' 1051 ' ' ILE . 3.6 mt -59.36 -32.53 48.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 109.811 -0.44 . . . . 129.93 109.811 173.69 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1055 ' ' ILE . . . . . . . . . . . . . 41.0 mt . . . . . 0 C--N 1.33 -0.252 0 C-N-CA 119.917 -0.713 . . . . 136.37 109.193 170.083 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 986' ' ' THR . . . . . . . . . . . . . 19.6 p . . . . . 0 N--CA 1.458 -0.038 0 CA-C-O 120.663 0.268 . . . . 191.6 111.236 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 987' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -59.94 -41.65 92.3 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 116.096 -0.502 . . . . 197.57 111.594 -178.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 988' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 -61.01 -46.6 90.09 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 120.891 0.377 . . . . 188.18 111.27 -177.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 989' ' ' VAL . . . . . . . . . . . . . 37.3 t -60.86 -39.56 82.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 120.985 0.421 . . . . 181.18 110.589 -177.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 990' ' ' LEU . . . . . . . . . . . . . 9.7 mp -70.63 -34.44 72.08 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.136 -0.626 . . . . 183.64 111.751 179.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 991' ' ' SER . . . . . . . . . . . . . 27.4 p -65.85 -52.62 48.87 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 119.938 -0.705 . . . . 168.15 111.219 176.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 992' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -60.35 -40.24 90.04 Favored 'General case' 0 C--O 1.241 0.621 0 C-N-CA 120.397 -0.521 . . . . 159.25 111.2 178.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 993' ' ' ASN . . . . . 0.455 ' O ' HG12 ' B' ' 997' ' ' ILE . 16.0 m-20 -58.48 -42.24 87.07 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.609 -0.436 . . . . 157.08 110.933 175.626 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 994' ' ' GLN . . . . . 0.503 ' NE2' HD22 ' C' ' 990' ' ' LEU . 8.3 tt0 -58.33 -41.92 85.62 Favored 'General case' 0 C--O 1.239 0.5 0 C-N-CA 120.547 -0.461 . . . . 168.42 111.148 174.473 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 995' ' ' LYS . . . . . . . . . . . . . 23.3 tttp -55.79 -44.53 77.85 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 120.023 -0.671 . . . . 157.21 110.94 175.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 996' ' ' LEU . . . . . 0.449 HD22 ' HD2' ' A' ' 40' ' ' LYS . 26.2 tp -60.61 -41.07 94.04 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 120.144 -0.622 . . . . 148.5 111.081 176.688 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 997' ' ' ILE . . . . . 0.696 HD13 HD13 ' A' ' 37' ' ' ILE . 14.5 mm -54.94 -54.04 27.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 121.303 0.573 . . . . 149.02 110.484 177.378 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 998' ' ' ALA . . . . . . . . . . . . . . . -61.4 -42.84 99.37 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 120.5 -0.48 . . . . 126.52 111.843 -177.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 999' ' ' ASN . . . . . . . . . . . . . 10.5 m-80 -63.58 -54.81 30.26 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 119.896 -0.722 . . . . 130.61 111.325 -177.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1000 ' ' LYS . . . . . . . . . . . . . 52.9 mttm -60.53 -36.72 79.09 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.065 -0.654 . . . . 125.08 111.443 -179.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1001 ' ' PHE . . . . . . . . . . . . . 92.2 t80 -57.9 -53.26 60.24 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.669 -0.413 . . . . 121.77 111.265 175.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1002 ' ' ASN . . . . . . . . . . . . . 36.8 m-20 -57.67 -42.58 83.86 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 120.272 -0.571 . . . . 129.77 111.387 179.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1003 ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -58.35 -49.47 77.1 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-O 121.068 0.461 . . . . 128.87 110.907 178.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1004 ' ' ALA . . . . . 0.472 ' O ' ' HG3' ' B' 1008 ' ' MET . . . -55.34 -38.99 69.46 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.664 -0.414 . . . . 112.24 111.214 175.664 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B 1005 ' ' LEU . . . . . . . . . . . . . 6.0 mt -58.9 -49.4 77.93 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 120.768 -0.373 . . . . 115.34 111.102 178.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1006 ' ' GLY . . . . . . . . . . . . . . . -56.61 -43.81 91.1 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 119.718 -1.229 . . . . 100.84 112.339 176.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -56.46 -39.72 73.64 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.349 -0.54 . . . . 92.34 111.063 176.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1008 ' ' MET . . . . . 0.472 ' HG3' ' O ' ' B' 1004 ' ' ALA . 38.2 mtt -65.57 -43.37 90.0 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.937 -0.305 . . . . 98.2 111.08 179.943 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B 1009 ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -57.4 -47.87 80.58 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 120.49 -0.484 . . . . 107.75 111.028 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1010 ' ' THR . . . . . . . . . . . . . 3.1 m -59.46 -43.5 93.19 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 119.893 -0.723 . . . . 92.36 111.525 177.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1011 ' ' GLY . . . . . . . . . . . . . . . -59.81 -56.61 23.85 Favored Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 114.356 0.502 . . . . 83.25 114.356 179.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1012 ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -64.33 -38.92 92.73 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.268 -0.573 . . . . 84.8 111.566 -178.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1013 ' ' THR . . . . . . . . . . . . . 33.6 m -57.73 -49.1 77.67 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 120.125 -0.63 . . . . 79.15 111.019 175.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1014 ' ' THR . . . . . . . . . . . . . 53.1 m -59.04 -44.19 91.75 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.781 -0.367 . . . . 80.92 111.3 178.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1015 ' ' THR . . . . . . . . . . . . . 88.6 m -58.06 -38.31 76.07 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.519 -0.473 . . . . 78.92 111.19 176.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 19.3 t30 -64.7 -49.02 72.53 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 120.796 0.331 . . . . 98.81 111.229 179.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1017 ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -59.63 -45.76 91.02 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 120.267 -0.573 . . . . 92.19 111.166 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1018 ' ' ALA . . . . . . . . . . . . . . . -58.14 -42.48 85.98 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.777 -0.369 . . . . 74.98 111.39 178.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1019 ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -66.62 -33.1 74.9 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 119.683 -0.807 . . . . 73.22 111.766 178.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1020 ' ' ARG . . . . . . . . . . . . . 4.0 ttm180 -62.83 -44.0 97.3 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.172 -1.011 . . . . 100.22 111.446 172.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1021 ' ' LYS . . . . . . . . . . . . . 89.2 mttt -60.93 -42.99 99.21 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 119.749 -0.781 . . . . 79.73 111.436 177.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1022 ' ' VAL . . . . . . . . . . . . . 64.9 t -61.61 -46.6 96.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-O 121.096 0.474 . . . . 87.2 110.341 178.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1023 ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -59.48 -48.45 81.61 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 122.055 -0.403 . . . . 108.68 111.479 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1024 ' ' ASP . . . . . . . . . . . . . 3.1 p30 -68.65 -33.62 74.3 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.407 -0.917 . . . . 120.55 111.837 -177.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1025 ' ' ALA . . . . . . . . . . . . . . . -70.15 -52.16 25.69 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 119.983 -0.687 . . . . 99.48 111.113 179.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1026 ' ' VAL . . . . . . . . . . . . . 56.4 t -56.45 -41.97 73.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-O 120.964 0.411 . . . . 93.9 110.609 177.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1027 ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -65.47 -45.2 84.65 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.545 -0.462 . . . . 90.21 111.155 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1028 ' ' ASN . . . . . 0.482 ' ND2' ' O ' ' A' ' 12' ' ' ASN . 1.9 t30 -61.46 -41.81 97.8 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 120.715 -0.394 . . . . 86.1 111.421 -179.283 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B 1029 ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -75.35 -34.14 61.15 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 119.859 -0.736 . . . . 80.31 111.66 -177.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1030 ' ' ALA . . . . . . . . . . . . . . . -59.57 -41.06 89.34 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 120.295 -0.562 . . . . 83.42 110.789 170.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1031 ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -62.91 -47.89 81.31 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.948 -0.301 . . . . 109.62 111.072 178.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1032 ' ' ALA . . . . . . . . . . . . . . . -59.4 -44.09 92.89 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 120.21 -0.596 . . . . 87.51 111.353 178.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1033 ' ' LEU . . . . . . . . . . . . . 51.0 tp -58.55 -45.99 87.78 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 120.709 -0.397 . . . . 89.81 111.151 177.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1034 ' ' SER . . . . . . . . . . . . . 8.5 t -63.71 -38.97 93.12 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.586 -0.446 . . . . 101.28 111.386 -178.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1035 ' ' LYS . . . . . . . . . . . . . 19.5 ttmt -61.98 -43.63 98.43 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.247 -0.581 . . . . 113.42 111.188 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1036 ' ' LEU . . . . . . . . . . . . . 1.1 tt -58.28 -52.59 64.94 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 120.945 0.403 . . . . 102.0 111.239 178.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1037 ' ' ALA . . . . . . . . . . . . . . . -58.1 -42.71 86.27 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.586 -0.446 . . . . 108.65 111.419 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1038 ' ' SER . . . . . . . . . . . . . 30.0 t -61.0 -43.32 99.05 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 120.638 -0.425 . . . . 116.34 111.373 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1039 ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -63.08 -48.69 77.55 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 120.729 -0.388 . . . . 121.08 110.838 179.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1040 ' ' LEU . . . . . . . . . . . . . 12.3 mt -59.06 -45.64 90.28 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.58 -0.448 . . . . 101.01 111.408 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1041 ' ' SER . . . . . . . . . . . . . 45.3 t -65.58 -47.03 77.14 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 120.408 -0.517 . . . . 106.41 111.375 -177.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1042 ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -61.38 -47.3 86.46 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.515 -0.474 . . . . 108.63 111.091 -179.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1043 ' ' THR . . . . . . . . . . . . . 5.4 p -68.97 -36.62 78.09 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 119.798 -0.761 . . . . 100.49 111.646 -176.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1044 ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -69.56 -39.01 77.65 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 119.856 -0.738 . . . . 96.6 111.284 179.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1045 ' ' GLY . . . . . . . . . . . . . . . -61.46 -42.02 99.68 Favored Glycine 0 C--N 1.336 0.563 0 C-N-CA 119.781 -1.2 . . . . 99.93 112.204 172.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1046 ' ' ALA . . . . . . . . . . . . . . . -58.01 -47.92 81.57 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 122.41 -0.465 . . . . 95.64 111.294 177.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1047 ' ' ILE . . . . . 0.554 ' O ' HG12 ' B' 1051 ' ' ILE . 73.3 mt -63.51 -45.11 98.67 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 C-N-CA 120.333 -0.547 . . . . 92.09 110.089 -178.565 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B 1048 ' ' SER . . . . . . . . . . . . . 1.4 m -51.75 -45.02 63.53 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.081 0.467 . . . . 101.39 110.897 175.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1049 ' ' ALA . . . . . . . . . . . . . . . -60.61 -51.06 70.99 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.465 -0.334 . . . . 113.31 111.11 177.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1050 ' ' SER . . . . . . . . . . . . . 2.9 p -67.28 -62.04 1.62 Allowed 'General case' 0 C--O 1.24 0.578 0 C-N-CA 120.41 -0.516 . . . . 117.95 111.592 -172.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1051 ' ' ILE . . . . . 0.554 HG12 ' O ' ' B' 1047 ' ' ILE . 46.8 pt -64.64 -27.93 43.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 119.15 -1.02 . . . . 119.1 110.445 -177.507 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B 1052 ' ' GLY . . . . . . . . . . . . . . . -56.19 -42.32 87.85 Favored Glycine 0 C--N 1.336 0.547 0 C-N-CA 119.724 -1.227 . . . . 140.8 112.307 166.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1053 ' ' ASP . . . . . . . . . . . . . 81.2 m-20 -66.77 -28.87 68.74 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.296 -0.532 . . . . 155.92 111.898 177.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1054 ' ' ILE . . . . . . . . . . . . . 1.6 mp -56.76 -36.84 50.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 C-N-CA 120.117 -0.633 . . . . 150.85 110.917 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1055 ' ' ILE . . . . . . . . . . . . . 5.6 tp . . . . . 0 C--N 1.33 -0.271 0 O-C-N 121.559 -0.713 . . . . 157.04 109.929 172.76 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 986' ' ' THR . . . . . . . . . . . . . 71.0 p . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.733 0.301 . . . . 198.28 111.078 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 987' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -60.41 -37.11 79.81 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.916 -0.584 . . . . 196.84 111.541 -179.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 988' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -69.57 -48.25 60.91 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.703 -0.399 . . . . 204.14 111.139 -178.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 989' ' ' VAL . . . . . . . . . . . . . 31.5 t -57.63 -38.27 63.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-O 121.097 0.475 . . . . 180.01 110.393 175.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 990' ' ' LEU . . . . . 0.503 HD22 ' NE2' ' B' ' 994' ' ' GLN . 3.4 mt -69.49 -35.66 75.77 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.386 -0.525 . . . . 168.09 111.101 -179.305 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 991' ' ' SER . . . . . . . . . . . . . 25.1 p -67.33 -43.08 82.48 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.474 -0.49 . . . . 170.03 111.352 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 992' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -61.3 -51.88 67.04 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-O 121.093 0.473 . . . . 183.29 111.012 177.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 993' ' ' ASN . . . . . 0.448 ' O ' HG12 ' C' ' 997' ' ' ILE . 18.2 m-20 -54.07 -41.43 68.16 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.529 -0.305 . . . . 147.15 110.932 176.104 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 994' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -57.51 -44.99 85.45 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 120.85 0.357 . . . . 141.65 111.17 176.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 995' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -58.99 -44.74 91.66 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 122.194 -0.316 . . . . 153.64 111.301 177.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 996' ' ' LEU . . . . . . . . . . . . . 3.5 tt -61.26 -42.43 98.61 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 119.761 -0.776 . . . . 140.68 111.287 178.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 997' ' ' ILE . . . . . 0.467 HD13 HD13 ' B' ' 37' ' ' ILE . 16.5 mm -55.2 -51.3 56.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-O 121.144 0.497 . . . . 139.98 110.257 175.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 998' ' ' ALA . . . . . 0.698 ' HB1' HG21 ' C' ' 37' ' ' ILE . . . -59.9 -41.31 91.38 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.508 -0.477 . . . . 141.87 111.622 -178.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 999' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -63.87 -54.38 35.8 Favored 'General case' 0 C--O 1.241 0.617 0 C-N-CA 120.363 -0.535 . . . . 160.27 111.365 -178.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1000 ' ' LYS . . . . . 0.439 ' HD2' HG12 ' B' ' 37' ' ' ILE . 52.1 mttm -59.37 -36.73 76.29 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 119.84 -0.744 . . . . 145.09 111.038 179.653 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C 1001 ' ' PHE . . . . . . . . . . . . . 91.3 t80 -57.54 -53.1 61.93 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.602 0.239 . . . . 127.99 111.36 175.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1002 ' ' ASN . . . . . 0.408 HD21 HG22 ' C' ' 37' ' ' ILE . 36.1 m-20 -58.48 -43.03 88.81 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 120.592 -0.443 . . . . 138.89 111.717 180.0 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C 1003 ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -59.24 -49.41 77.94 Favored 'General case' 0 C--O 1.241 0.654 0 C-N-CA 120.257 -0.577 . . . . 135.78 110.877 178.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1004 ' ' ALA . . . . . . . . . . . . . . . -55.42 -38.03 68.42 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.571 -0.452 . . . . 113.42 111.269 174.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1005 ' ' LEU . . . . . 0.598 ' HA ' ' HE2' ' C' 1008 ' ' MET . 5.3 mt -58.62 -50.27 74.45 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.828 0.346 . . . . 111.27 110.894 177.966 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C 1006 ' ' GLY . . . . . . . . . . . . . . . -57.71 -44.63 94.02 Favored Glycine 0 C--N 1.336 0.534 0 C-N-CA 119.783 -1.199 . . . . 106.9 112.777 176.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1007 ' ' ALA . . . . . . . . . . . . . . . -57.84 -42.91 85.37 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 120.128 -0.629 . . . . 103.17 111.755 178.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1008 ' ' MET . . . . . 0.598 ' HE2' ' HA ' ' C' 1005 ' ' LEU . 5.3 mtm -67.57 -41.93 83.4 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.151 -0.619 . . . . 102.14 111.406 -179.358 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C 1009 ' ' GLN . . . . . 0.562 HE22 ' HB2' ' C' ' 33' ' ' GLU . 46.6 mt-30 -56.68 -45.94 81.44 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 120.293 -0.563 . . . . 116.46 110.921 175.824 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C 1010 ' ' THR . . . . . . . . . . . . . 75.4 m -57.85 -42.43 84.44 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.197 -0.601 . . . . 116.72 110.866 175.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1011 ' ' GLY . . . . . . . . . . . . . . . -59.84 -56.22 26.02 Favored Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 114.372 0.509 . . . . 100.36 114.372 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1012 ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -64.42 -40.03 94.99 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 117.031 0.416 . . . . 98.95 111.783 -178.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1013 ' ' THR . . . . . . . . . . . . . 31.0 m -58.19 -48.66 79.62 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 120.05 -0.66 . . . . 112.94 110.847 175.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1014 ' ' THR . . . . . . . . . . . . . 59.3 m -58.67 -44.23 90.13 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 116.572 -0.285 . . . . 105.35 111.32 178.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1015 ' ' THR . . . . . . . . . . . . . 89.6 m -58.47 -38.34 77.37 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.885 -0.326 . . . . 99.11 111.199 176.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1016 ' ' ASN . . . . . . . . . . . . . 18.3 t30 -65.09 -48.2 74.56 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 120.82 -0.352 . . . . 110.07 111.032 -179.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1017 ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -59.7 -44.7 93.58 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 120.266 -0.574 . . . . 121.48 111.098 177.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1018 ' ' ALA . . . . . . . . . . . . . . . -57.53 -41.99 82.01 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.898 -0.321 . . . . 96.38 111.244 178.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1019 ' ' PHE . . . . . 0.445 ' HE2' HG23 ' A' 1015 ' ' THR . 4.2 m-85 -66.79 -33.47 75.69 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.918 -0.713 . . . . 85.34 111.396 177.995 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C 1020 ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 -55.76 -52.62 63.31 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.245 -0.582 . . . . 109.24 110.721 170.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1021 ' ' LYS . . . . . . . . . . . . . 90.7 mttt -61.88 -42.25 98.84 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.491 -0.484 . . . . 100.72 111.522 -177.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1022 ' ' VAL . . . . . . . . . . . . . 64.7 t -60.7 -47.06 94.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-O 121.153 0.501 . . . . 76.46 110.375 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1023 ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -58.85 -46.21 88.28 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.666 -0.414 . . . . 89.81 111.084 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1024 ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -67.29 -35.45 79.51 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 119.879 -0.728 . . . . 97.57 111.434 -176.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1025 ' ' ALA . . . . . . . . . . . . . . . -70.08 -51.74 29.45 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 120.254 -0.579 . . . . 88.12 111.188 179.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1026 ' ' VAL . . . . . . . . . . . . . 62.8 t -56.24 -41.28 69.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 120.911 0.386 . . . . 94.02 110.642 177.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1027 ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -65.63 -45.84 81.56 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.441 -0.503 . . . . 110.01 111.379 -179.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1028 ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -61.86 -41.81 98.29 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.184 -0.606 . . . . 124.96 111.478 -179.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1029 ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -75.15 -34.86 61.67 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.565 -0.854 . . . . 104.51 112.133 -177.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1030 ' ' ALA . . . . . . . . . . . . . . . -60.47 -40.82 92.64 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.252 -0.579 . . . . 92.95 111.006 170.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1031 ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -63.01 -48.72 77.59 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.884 -0.326 . . . . 107.59 111.164 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1032 ' ' ALA . . . . . . . . . . . . . . . -59.8 -43.97 94.21 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 120.547 -0.461 . . . . 87.9 111.399 178.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1033 ' ' LEU . . . . . . . . . . . . . 50.9 tp -58.57 -46.14 87.52 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.807 -0.357 . . . . 76.26 111.184 177.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1034 ' ' SER . . . . . . . . . . . . . 8.3 t -63.77 -39.18 93.64 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.371 -0.532 . . . . 84.79 111.226 -178.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1035 ' ' LYS . . . . . . . . . . . . . 15.6 mmmt -60.52 -43.87 96.66 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.28 -0.568 . . . . 110.16 110.871 175.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1036 ' ' LEU . . . . . 0.478 HD12 HD21 ' A' 1036 ' ' LEU . 3.2 tm? -59.99 -50.79 72.35 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-O 120.831 0.348 . . . . 91.42 110.937 179.546 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C 1037 ' ' ALA . . . . . . . . . . . . . . . -60.18 -43.99 95.43 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 120.277 -0.569 . . . . 92.24 111.336 -179.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1038 ' ' SER . . . . . . . . . . . . . 77.9 p -60.19 -42.6 95.4 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.238 -0.585 . . . . 104.85 110.978 179.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1039 ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -63.05 -47.95 80.8 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 120.427 -0.509 . . . . 124.32 111.089 -179.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1040 ' ' LEU . . . . . 0.435 HD23 ' O ' ' C' 1036 ' ' LEU . 1.6 mm? -59.16 -47.06 86.69 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.295 -0.562 . . . . 111.28 111.454 179.329 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C 1041 ' ' SER . . . . . . . . . . . . . 31.2 t -65.58 -46.98 77.33 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 120.172 -0.611 . . . . 119.14 111.357 -176.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1042 ' ' ASN . . . . . . . . . . . . . 10.1 t30 -61.16 -46.86 88.76 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.463 -0.495 . . . . 141.74 111.09 -179.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1043 ' ' THR . . . . . . . . . . . . . 1.4 t -67.85 -35.58 78.81 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.773 -0.771 . . . . 114.11 111.381 -176.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1044 ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -70.45 -35.99 73.68 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.212 -0.595 . . . . 96.42 111.253 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1045 ' ' GLY . . . . . . . . . . . . . . . -61.96 -42.83 99.77 Favored Glycine 0 C--N 1.335 0.495 0 C-N-CA 119.327 -1.416 . . . . 92.28 112.086 170.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1046 ' ' ALA . . . . . . . . . . . . . . . -57.74 -49.53 76.24 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 122.357 -0.496 . . . . 101.73 111.274 177.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1047 ' ' ILE . . . . . . . . . . . . . 15.8 mm -64.92 -41.39 92.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 C-N-CA 120.114 -0.635 . . . . 83.73 110.773 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1048 ' ' SER . . . . . . . . . . . . . 11.1 t -51.09 -46.85 61.94 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 121.95 -0.469 . . . . 88.61 110.995 175.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1049 ' ' ALA . . . . . . . . . . . . . . . -64.1 -53.27 52.22 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 120.347 -0.541 . . . . 112.49 111.615 177.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1050 ' ' SER . . . . . . . . . . . . . 2.7 p -67.06 -26.86 66.95 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 112.63 0.604 . . . . 137.61 112.63 -169.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1051 ' ' ILE . . . . . . . . . . . . . 44.8 mt -88.46 -29.12 5.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 120.453 -0.499 . . . . 152.19 110.709 174.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1052 ' ' GLY . . . . . . . . . . . . . . . -55.63 -40.88 80.51 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.783 -0.722 . . . . 178.32 113.889 169.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1053 ' ' ASP . . . . . . . . . . . . . 3.0 p30 -64.65 -28.17 69.43 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.874 0.694 . . . . 203.19 112.874 -178.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1054 ' ' ILE . . . . . . . . . . . . . 5.7 mt -55.78 -37.03 45.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-N 118.102 0.41 . . . . 200.09 110.933 -178.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1055 ' ' ILE . . . . . . . . . . . . . 14.4 mt . . . . . 0 C--N 1.329 -0.3 0 O-C-N 121.709 -0.619 . . . . 191.38 110.375 174.822 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' a' a ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.736 0.303 . . . . 111.82 111.046 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' a' a ' 13' ' ' VAL . . . . . . . . . . . . . 98.4 t -99.77 127.6 52.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 108.318 -0.993 . . . . 106.42 108.318 177.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 14' ' ' THR . . . . . . . . . . . . . 41.1 p -121.08 153.95 36.77 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.213 0.53 . . . . 110.18 110.802 -176.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 15' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -102.44 176.1 5.29 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.426 -0.806 . . . . 109.39 109.349 177.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 tt -130.09 123.17 29.78 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.941 -1.133 . . . . 93.29 107.941 -171.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 17' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -127.08 108.18 10.69 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.102 -0.703 . . . . 92.08 109.102 -177.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 18' ' ' LEU . . . . . . . . . . . . . 54.0 mt -112.28 12.92 20.35 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 113.35 0.87 . . . . 78.73 113.35 177.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 19' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -59.98 -43.63 94.99 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 118.527 0.603 . . . . 89.4 111.428 -172.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 20' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -58.84 -47.7 83.95 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 120.86 0.362 . . . . 87.8 111.137 177.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 21' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -60.26 -40.89 91.94 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.744 -0.383 . . . . 69.84 111.238 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 22' ' ' MET . . . . . . . . . . . . . 59.4 mtt -65.74 -36.71 84.36 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.205 -0.598 . . . . 73.97 111.431 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 23' ' ' LYS . . . . . . . . . . . . . 62.9 mttt -67.56 -34.93 78.05 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.468 -0.893 . . . . 89.62 111.343 174.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 24' ' ' LYS . . . . . . . . . . . . . 17.8 mttt -60.02 -39.94 87.58 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 119.883 -0.727 . . . . 85.48 110.774 173.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 25' ' ' LEU . . . . . . . . . . . . . 19.3 mt -66.31 -43.19 86.94 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 120.312 -0.555 . . . . 80.79 110.931 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 26' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -54.45 -46.53 73.31 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.022 0.439 . . . . 96.41 110.984 175.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 27' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -64.32 -44.44 91.53 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.393 -0.523 . . . . 104.91 111.283 -178.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.97 -39.49 85.84 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 119.815 -0.754 . . . . 102.91 111.221 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 29' ' ' ILE . . . . . . . . . . . . . 81.7 mt -64.62 -34.91 72.93 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 120.575 -0.45 . . . . 113.0 110.343 176.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 30' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.29 -43.71 90.25 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 119.883 -0.727 . . . . 133.85 111.455 175.833 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' a' a ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -58.4 -42.47 87.2 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 119.801 -0.76 . . . . 128.27 111.143 174.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 32' ' ' LEU . . . . . . . . . . . . . 54.7 mt -58.78 -44.05 90.57 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.042 -0.663 . . . . 114.88 111.049 176.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 33' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -60.83 -33.78 73.55 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.573 -0.451 . . . . 122.07 111.372 175.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 34' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -82.11 3.56 26.54 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 112.72 0.637 . . . . 127.81 112.72 177.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 35' ' ' SER . . . . . . . . . . . . . 73.6 m -109.83 21.05 17.37 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 118.337 0.517 . . . . 124.49 112.389 -179.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 36' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -76.81 141.55 40.67 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.741 -0.466 . . . . 135.82 109.741 177.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 37' ' ' ILE . . . . . . . . . . . . . 3.4 mt -98.95 110.4 26.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 N-CA-C 106.927 -1.509 . . . . 144.57 106.927 -170.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 38' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -80.91 146.1 30.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.233 0.54 . . . . 154.71 109.93 178.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 39' ' ' LEU . . . . . . . . . . . . . 27.1 mt -59.05 -55.79 30.62 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.552 -0.749 . . . . 171.76 111.22 -173.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 40' ' ' LYS . . . . . . . . . . . . . 97.7 mttt 55.65 60.07 3.51 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.983 0.896 . . . . 166.92 111.13 177.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 41' ' ' GLU . . . . . . . . . . . . . 11.9 tm-20 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 115.043 -0.981 . . . . 205.94 109.91 178.471 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' b' b ' 10' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.776 0.322 . . . . 246.52 111.052 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' b' b ' 11' ' ' ILE . . . . . . . . . . . . . 3.0 mt -121.58 156.36 25.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 N-CA-C 108.625 -0.88 . . . . 184.99 108.625 -179.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 12' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -152.71 165.73 34.39 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.432 -0.803 . . . . 195.68 109.108 173.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 13' ' ' VAL . . . . . . . . . . . . . 99.0 t -67.52 129.99 32.48 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 CA-C-N 115.059 -0.973 . . . . 154.68 109.7 -178.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 14' ' ' THR . . . . . . . . . . . . . 40.6 p -118.41 151.75 37.18 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.449 -0.574 . . . . 130.46 109.449 -178.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 15' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -103.74 176.25 5.21 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 122.098 0.951 . . . . 111.87 110.7 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 tt -130.46 124.02 31.07 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 107.768 -1.197 . . . . 101.32 107.768 -170.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 17' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -125.94 107.92 10.92 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.31 -0.626 . . . . 116.72 109.31 -176.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 18' ' ' LEU . . . . . . . . . . . . . 50.3 mt -112.67 13.62 19.93 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 113.278 0.844 . . . . 109.58 113.278 176.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 19' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -60.87 -37.42 82.08 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.198 -0.601 . . . . 119.56 111.139 -173.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 20' ' ' TYR . . . . . . . . . . . . . 45.2 t80 -65.14 -48.38 73.77 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.908 0.385 . . . . 132.85 111.006 177.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 21' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -60.81 -42.38 97.55 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.648 -0.421 . . . . 105.96 111.47 179.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 22' ' ' MET . . . . . . . . . . . . . 67.4 mtm -66.64 -35.72 80.86 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.678 -0.809 . . . . 96.11 111.221 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 23' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -56.73 -45.49 81.9 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 120.242 -0.583 . . . . 127.56 110.603 171.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -36.22 79.8 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.648 -0.421 . . . . 124.12 111.798 176.365 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' b' b ' 25' ' ' LEU . . . . . . . . . . . . . 17.8 mt -65.75 -44.93 84.46 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 119.712 -0.795 . . . . 98.96 111.359 178.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 26' ' ' GLU . . . . . . . . . . . . . 80.7 mt-10 -61.74 -40.71 96.05 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.161 -0.616 . . . . 114.28 110.957 176.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 27' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -55.63 -42.65 75.26 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 120.755 0.312 . . . . 134.43 111.181 173.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.33 -38.36 78.15 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.919 -0.313 . . . . 110.88 111.455 -177.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 29' ' ' ILE . . . . . . . . . . . . . 10.7 pt -70.87 -26.46 27.88 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 C-N-CA 118.691 -1.203 . . . . 115.4 110.343 177.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 30' ' ' LYS . . . . . . . . . . . . . 15.8 mtmt -67.52 -46.65 72.25 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 119.911 -0.716 . . . . 145.67 110.888 172.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 31' ' ' LYS . . . . . . . . . . . . . 43.7 mttt -70.96 -10.51 59.83 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 112.745 0.646 . . . . 166.9 112.745 177.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 32' ' ' LEU . . . . . . . . . . . . . 53.0 mt -82.18 -43.04 18.21 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 118.272 0.487 . . . . 164.59 110.759 166.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 33' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -59.95 -24.21 64.2 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 112.042 0.386 . . . . 173.43 112.042 174.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 34' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -80.86 2.38 26.72 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 113.788 1.032 . . . . 187.53 113.788 -179.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 35' ' ' SER . . . . . . . . . . . . . 75.1 m -113.03 20.63 16.17 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 119.277 0.944 . . . . 172.0 113.243 -178.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 36' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -77.48 143.0 38.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 118.33 0.514 . . . . 170.82 110.886 179.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 37' ' ' ILE . . . . . . . . . . . . . 12.3 mt -111.79 114.27 46.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 108.144 -1.058 . . . . 168.88 108.144 -170.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 38' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -75.87 153.34 36.84 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.277 0.561 . . . . 166.49 109.715 170.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 mp -61.69 -65.82 0.63 Allowed 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.778 -0.647 . . . . 151.58 111.244 -176.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 40' ' ' LYS . . . . . . . . . . . . . 75.1 mttt . . . . . 0 N--CA 1.463 0.201 0 C-N-CA 122.876 0.47 . . . . 157.73 111.848 -179.404 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' c' c ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tt . . . . . 0 N--CA 1.456 -0.137 0 N-CA-C 109.779 -0.452 . . . . 197.98 109.779 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' c' c ' 12' ' ' ASN . . . . . . . . . . . . . 28.3 p30 -157.12 156.14 32.22 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.411 -0.589 . . . . 167.65 109.411 -176.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 13' ' ' VAL . . . . . . . . . . . . . 86.3 t -100.44 126.51 54.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 N-CA-C 107.847 -1.168 . . . . 154.37 107.847 170.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 14' ' ' THR . . . . . . . . . . . . . 40.4 p -121.45 153.1 38.34 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.102 0.477 . . . . 141.55 110.219 -176.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 15' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -103.09 175.67 5.4 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.662 0.744 . . . . 123.59 109.399 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 16' ' ' LEU . . . . . . . . . . . . . 2.9 tt -130.74 124.3 31.16 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.265 -0.643 . . . . 106.66 109.265 -169.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 17' ' ' ASP . . . . . . . . . . . . . 46.8 t0 -126.96 108.18 10.73 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 123.403 0.681 . . . . 111.78 109.163 -178.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 18' ' ' LEU . . . . . . . . . . . . . 51.2 mt -112.84 12.98 19.61 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 113.515 0.932 . . . . 106.74 113.515 176.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 19' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -72.46 -25.67 61.53 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 119.358 -0.937 . . . . 124.0 112.579 -170.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 20' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -61.92 -48.08 82.02 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 119.555 -0.858 . . . . 117.96 110.478 167.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 21' ' ' GLU . . . . . . . . . . . . . 39.0 mp0 -60.31 -40.84 92.01 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.876 -0.33 . . . . 100.98 111.283 178.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 22' ' ' MET . . . . . . . . . . . . . 58.5 mtt -66.51 -37.27 84.69 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.038 -0.665 . . . . 106.92 111.247 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 23' ' ' LYS . . . . . . . . . . . . . 63.4 mttt -58.55 -51.59 69.23 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.994 0.426 . . . . 126.96 110.765 173.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 24' ' ' LYS . . . . . . . . . . . . . 1.8 mmmm -59.81 -37.53 79.4 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 116.6 -0.273 . . . . 115.96 111.227 179.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 25' ' ' LEU . . . . . . . . . . . . . 18.5 mt -66.13 -44.81 83.13 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.949 -0.3 . . . . 119.1 111.61 179.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 26' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -66.78 -34.07 77.02 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 118.987 -1.085 . . . . 137.36 111.747 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 27' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -57.85 -43.71 86.05 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.96 -0.696 . . . . 140.2 110.84 170.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.65 -37.7 88.48 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.745 -0.382 . . . . 125.03 111.55 179.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 29' ' ' ILE . . . . . . . . . . . . . 83.4 mt -65.6 -46.56 89.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 CA-C-O 121.046 0.451 . . . . 128.63 110.612 179.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 30' ' ' LYS . . . . . . . . . . . . . 15.0 mtmt -59.41 -44.0 92.92 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 119.752 -0.779 . . . . 145.29 110.948 176.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 31' ' ' LYS . . . . . . . . . . . . . 43.9 mttt -62.35 -24.65 67.47 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.439 -0.504 . . . . 133.48 111.995 175.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 32' ' ' LEU . . . . . . . . . . . . . 50.3 mt -72.27 -43.3 64.49 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.492 -0.483 . . . . 130.52 111.127 173.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 33' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -67.61 -25.69 65.88 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 119.856 -0.738 . . . . 148.33 112.04 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 34' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -79.99 3.5 19.92 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 113.017 0.747 . . . . 149.15 113.017 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 35' ' ' SER . . . . . . . . . . . . . 74.2 m -111.94 23.4 13.83 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.142 0.577 . . . . 151.17 112.5 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 36' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -74.97 143.79 43.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.268 0.556 . . . . 175.99 111.177 -179.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 37' ' ' ILE . . . . . . . . . . . . . 3.9 tp -77.17 -18.35 14.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 114.262 1.208 . . . . 194.65 114.262 -168.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 38' ' ' ASP . . . . . . . . . . . . . 25.8 t0 62.84 2.33 0.97 Allowed 'General case' 0 C--O 1.237 0.421 0 C-N-CA 125.744 1.618 . . . . 214.96 113.105 178.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 41.51 71.81 0.19 Allowed 'General case' 0 C--O 1.236 0.343 0 C-N-CA 125.995 1.718 . . . . 217.34 114.191 178.487 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' c' c ' 40' ' ' LYS . . . . . . . . . . . . . 96.3 mttt . . . . . 0 C--N 1.331 -0.236 0 CA-C-O 120.91 0.386 . . . . 209.69 110.991 175.7 . . . . . . . . 0 0 . 1 stop_ save_