data_3j9a_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 3j9a _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.034 0 CA-C-O 120.852 0.358 . . . . 30.0 111.13 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . . . -104.63 -48.81 3.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.109 0.48 . . . . 30.0 111.502 168.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . . . -65.44 -42.16 92.7 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 116.253 1.946 . . . . 30.0 116.253 -177.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . . . -139.94 156.98 46.4 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 114.816 1.413 . . . . 30.0 114.816 -170.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . . . -73.51 158.06 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 N-CA-C 115.925 1.824 . . . . 30.0 115.925 177.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . . . -71.29 156.36 39.62 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.926 1.084 . . . . 30.0 113.926 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . . . -112.82 130.57 23.36 Favored Pre-proline 0 C--N 1.333 -0.15 0 CA-C-N 116.276 -0.42 . . . . 30.0 111.301 -173.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . . . -66.54 142.08 63.52 Favored 'Trans proline' 0 C--N 1.329 -0.46 0 C-N-CA 121.396 1.397 . . . . 30.0 111.61 -178.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . . . -61.45 138.61 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-O 121.123 0.487 . . . . 30.0 110.756 -175.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . . . -135.1 155.44 37.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 108.695 -0.854 . . . . 30.0 108.695 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . . . -62.55 137.74 58.33 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.26 -0.576 . . . . 30.0 109.694 -178.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . . . -71.1 137.6 49.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.896 -0.593 . . . . 30.0 111.847 179.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ARG . . . . . 0.485 ' O ' ' N ' ' A' ' 18' ' ' ASP . . . 54.07 43.43 30.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.267 -0.424 . . . . 30.0 112.094 171.964 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . . . -61.38 -41.74 97.6 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.548 -0.538 . . . . 30.0 109.548 -177.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . . . -63.97 -41.14 97.64 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.423 -0.584 . . . . 30.0 109.423 172.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . . . -63.58 -40.29 96.58 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-N 115.662 -0.699 . . . . 30.0 112.111 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 14' ' ' ARG . . . -62.61 -40.48 97.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.326 -0.397 . . . . 30.0 110.358 -178.516 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . . . -97.75 125.4 42.54 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.011 0.745 . . . . 30.0 113.011 177.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -113.51 -1.55 14.1 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.813 0.671 . . . . 30.0 112.813 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . . . -89.32 -4.11 58.23 Favored 'General case' 0 C--O 1.249 1.073 0 N-CA-C 113.154 0.798 . . . . 30.0 113.154 -175.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . . . -83.81 128.37 63.59 Favored Pre-proline 0 C--O 1.256 1.409 0 CA-C-N 116.206 -0.452 . . . . 30.0 111.97 -175.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . . . -63.67 -40.21 30.85 Favored 'Trans proline' 0 C--N 1.405 3.531 1 C-N-CA 112.851 -4.299 . . . . 30.0 111.68 178.103 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . . . -53.04 -38.2 62.21 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.867 1.062 . . . . 30.0 113.867 -175.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . . . -61.29 -39.39 82.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 113.546 0.943 . . . . 30.0 113.546 -171.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.89 -41.78 98.29 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.083 0.401 . . . . 30.0 112.083 -176.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . . . -63.69 -40.61 97.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.15 0.5 . . . . 30.0 110.963 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . . . -58.86 -38.7 79.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.536 -0.756 . . . . 30.0 111.212 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . . . -61.95 -37.35 84.41 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 113.186 0.81 . . . . 30.0 113.186 -177.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . 0.466 ' O ' ' C ' ' A' ' 31' ' ' LEU . . . -61.03 -40.76 94.82 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.307 0.854 . . . . 30.0 113.307 -172.895 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LEU . . . . . 0.466 ' C ' ' O ' ' A' ' 30' ' ' THR . . . -36.99 139.15 0.22 Allowed 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.044 -0.662 . . . . 30.0 110.907 178.785 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . . . -74.5 145.27 43.66 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.324 1.05 . . . . 30.0 113.55 -168.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . . . -62.56 -40.95 98.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.747 -0.66 . . . . 30.0 112.399 -178.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.5 179.74 51.48 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.372 -0.918 . . . . 30.0 113.134 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . . . -63.83 -40.81 97.48 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.692 0.997 . . . . 30.0 113.692 179.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . . . -84.4 124.09 30.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.11 0.481 . . . . 30.0 112.055 -176.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . . . -160.84 166.14 29.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.676 -0.693 . . . . 30.0 110.717 -179.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . . . -67.64 -40.21 84.59 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 123.608 0.763 . . . . 30.0 112.601 -13.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.26 -39.11 63.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.417 -0.81 . . . . 30.0 112.954 -169.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . . . -61.67 -39.62 92.05 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.757 -0.46 . . . . 30.0 109.757 179.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . . . -67.5 -41.68 84.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.095 -0.502 . . . . 30.0 111.723 179.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . . . -63.46 -40.98 98.56 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.109 0.481 . . . . 30.0 112.268 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . . . -65.29 -40.08 87.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 123.544 0.738 . . . . 30.0 110.228 -179.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . . . -62.85 -41.1 99.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.075 -0.511 . . . . 30.0 110.197 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . . . -63.36 -41.0 98.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 30.0 110.345 177.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . . . -63.32 -40.5 97.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.864 -0.607 . . . . 30.0 111.558 179.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . . . -71.42 -41.6 69.32 Favored 'General case' 0 C--O 1.25 1.091 0 N-CA-C 112.898 0.703 . . . . 30.0 112.898 -178.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . . . -64.59 -40.38 95.42 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 116.547 2.054 . . . . 30.0 116.547 -172.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . . . -59.03 -39.87 83.29 Favored 'General case' 0 C--O 1.243 0.729 0 N-CA-C 114.511 1.3 . . . . 30.0 114.511 -165.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . . . -61.23 -40.04 84.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.412 -0.358 . . . . 30.0 110.982 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . . . -62.74 -41.53 99.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.56 -0.291 . . . . 30.0 111.187 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . . . -63.48 -40.62 97.59 Favored 'General case' 0 C--O 1.245 0.858 0 CA-C-O 121.268 0.556 . . . . 30.0 110.303 177.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . . . -62.11 -41.97 93.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 119.945 -0.702 . . . . 30.0 109.625 178.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.9 95.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.136 -0.484 . . . . 30.0 110.25 179.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . . . -62.41 -40.64 97.19 Favored 'General case' 0 C--O 1.25 1.106 0 CA-C-N 115.653 -0.703 . . . . 30.0 111.758 179.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . . . -62.65 -39.63 94.48 Favored 'General case' 0 C--O 1.249 1.067 0 CA-C-O 121.863 0.839 . . . . 30.0 111.15 178.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . . . -68.36 -40.73 81.4 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 126.678 1.991 . . . . 30.0 110.081 -175.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . . . -62.85 -41.03 99.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 30.0 110.162 179.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . . . -63.29 -41.9 99.03 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.334 -0.393 . . . . 30.0 110.641 177.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.9 -40.54 96.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.005 -0.543 . . . . 30.0 111.818 178.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . . . -62.47 -40.66 97.38 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.532 0.938 . . . . 30.0 113.532 -176.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . . . -62.82 -41.54 99.36 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.201 0.445 . . . . 30.0 112.201 -175.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . . . -62.75 -40.65 97.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.093 0.473 . . . . 30.0 109.789 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . . . -63.36 -39.29 94.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.731 -0.668 . . . . 30.0 111.8 178.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . . . -62.25 -40.61 96.77 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.508 1.299 . . . . 30.0 114.508 -174.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.59 142.48 40.54 Favored Glycine 0 N--CA 1.451 -0.301 0 CA-C-O 121.223 0.346 . . . . 30.0 112.306 -175.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -67.48 152.92 52.86 Favored Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 114.608 0.603 . . . . 30.0 114.608 -174.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . . . -61.79 141.39 17.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.131 0.491 . . . . 30.0 110.651 -177.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . . . -74.85 139.41 43.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.568 -0.742 . . . . 30.0 112.05 -172.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . . . -63.75 -40.08 95.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.044 -0.525 . . . . 30.0 109.936 175.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . . . -67.76 -42.37 81.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.737 -0.665 . . . . 30.0 111.229 -178.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . . . -63.88 -40.55 96.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.031 -0.532 . . . . 30.0 110.535 177.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . . . -71.92 -43.4 65.37 Favored 'General case' 0 C--O 1.251 1.172 0 CA-C-N 115.52 -0.764 . . . . 30.0 112.964 -179.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . . . -64.54 -39.95 94.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.908 -0.587 . . . . 30.0 111.149 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . . . -75.09 -42.76 55.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.318 -0.855 . . . . 30.0 111.31 -173.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . . . -64.21 -40.56 96.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.799 -0.637 . . . . 30.0 111.616 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . . . -66.45 -40.84 89.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.776 -0.647 . . . . 30.0 111.521 -175.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . . . -62.87 -40.82 98.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.03 0.443 . . . . 30.0 110.28 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . . . -64.61 -40.09 94.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.852 -0.613 . . . . 30.0 111.271 177.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . . . -62.67 -40.73 98.0 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.532 0.567 . . . . 30.0 112.532 -176.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . . . -58.29 -39.58 76.52 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 110.123 -0.325 . . . . 30.0 110.123 -179.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.427 0 C-N-CA 120.715 0.943 . . . . 30.0 111.696 -179.781 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.034 0 CA-C-O 120.852 0.358 . . . . 30.0 111.13 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . . . -104.63 -48.81 3.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.109 0.48 . . . . 30.0 111.502 168.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . . . -65.44 -42.16 92.7 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 116.253 1.946 . . . . 30.0 116.253 -177.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . . . -139.94 156.98 46.4 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 114.816 1.413 . . . . 30.0 114.816 -170.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . . . -73.51 158.06 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 N-CA-C 115.925 1.824 . . . . 30.0 115.925 177.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . . . -71.29 156.36 39.62 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.926 1.084 . . . . 30.0 113.926 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . . . -112.82 130.57 23.36 Favored Pre-proline 0 C--N 1.333 -0.15 0 CA-C-N 116.276 -0.42 . . . . 30.0 111.301 -173.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . . . -66.54 142.08 63.52 Favored 'Trans proline' 0 C--N 1.329 -0.46 0 C-N-CA 121.396 1.397 . . . . 30.0 111.61 -178.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . . . -61.45 138.61 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-O 121.123 0.487 . . . . 30.0 110.756 -175.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . . . -135.1 155.44 37.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 108.695 -0.854 . . . . 30.0 108.695 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . . . -62.55 137.74 58.33 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.26 -0.576 . . . . 30.0 109.694 -178.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . . . -71.1 137.6 49.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.896 -0.593 . . . . 30.0 111.847 179.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ARG . . . . . 0.438 ' O ' ' N ' ' A' ' 18' ' ' ASP . . . 54.07 43.43 30.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.267 -0.424 . . . . 30.0 112.094 171.964 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . . . -61.38 -41.74 97.6 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.548 -0.538 . . . . 30.0 109.548 -177.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . . . -63.97 -41.14 97.64 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.423 -0.584 . . . . 30.0 109.423 172.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . . . -63.58 -40.29 96.58 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-N 115.662 -0.699 . . . . 30.0 112.111 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . 0.438 ' N ' ' O ' ' A' ' 14' ' ' ARG . . . -62.61 -40.48 97.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.326 -0.397 . . . . 30.0 110.358 -178.516 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . . . -97.75 125.4 42.54 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.011 0.745 . . . . 30.0 113.011 177.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -113.51 -1.55 14.1 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.813 0.671 . . . . 30.0 112.813 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . . . -89.32 -4.11 58.23 Favored 'General case' 0 C--O 1.249 1.073 0 N-CA-C 113.154 0.798 . . . . 30.0 113.154 -175.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . . . -83.81 128.37 63.59 Favored Pre-proline 0 C--O 1.256 1.409 0 CA-C-N 116.206 -0.452 . . . . 30.0 111.97 -175.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . . . -63.67 -40.21 30.85 Favored 'Trans proline' 0 C--N 1.405 3.531 1 C-N-CA 112.851 -4.299 . . . . 30.0 111.68 178.103 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . . . -53.04 -38.2 62.21 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.867 1.062 . . . . 30.0 113.867 -175.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . . . -61.29 -39.39 82.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 113.546 0.943 . . . . 30.0 113.546 -171.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.89 -41.78 98.29 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.083 0.401 . . . . 30.0 112.083 -176.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . . . -63.69 -40.61 97.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.15 0.5 . . . . 30.0 110.963 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . . . -58.86 -38.7 79.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.536 -0.756 . . . . 30.0 111.212 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . . . -61.95 -37.35 84.41 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 113.186 0.81 . . . . 30.0 113.186 -177.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . 0.466 ' O ' ' C ' ' A' ' 31' ' ' LEU . . . -61.03 -40.76 94.82 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.307 0.854 . . . . 30.0 113.307 -172.895 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LEU . . . . . 0.466 ' C ' ' O ' ' A' ' 30' ' ' THR . . . -36.99 139.15 0.22 Allowed 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.044 -0.662 . . . . 30.0 110.907 178.785 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . . . -74.5 145.27 43.66 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.324 1.05 . . . . 30.0 113.55 -168.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . . . -62.56 -40.95 98.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.747 -0.66 . . . . 30.0 112.399 -178.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.5 179.74 51.48 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.372 -0.918 . . . . 30.0 113.134 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . . . -63.83 -40.81 97.48 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.692 0.997 . . . . 30.0 113.692 179.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . . . -84.4 124.09 30.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.11 0.481 . . . . 30.0 112.055 -176.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . . . -160.84 166.14 29.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.676 -0.693 . . . . 30.0 110.717 -179.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . . . -67.64 -40.21 84.59 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 123.608 0.763 . . . . 30.0 112.601 -13.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.26 -39.11 63.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.417 -0.81 . . . . 30.0 112.954 -169.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . . . -61.67 -39.62 92.05 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.757 -0.46 . . . . 30.0 109.757 179.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . . . -67.5 -41.68 84.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.095 -0.502 . . . . 30.0 111.723 179.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . . . -63.46 -40.98 98.56 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.109 0.481 . . . . 30.0 112.268 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . . . -65.29 -40.08 87.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 123.544 0.738 . . . . 30.0 110.228 -179.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . . . -62.85 -41.1 99.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.075 -0.511 . . . . 30.0 110.197 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . . . -63.36 -41.0 98.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 30.0 110.345 177.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . . . -63.32 -40.5 97.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.864 -0.607 . . . . 30.0 111.558 179.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . . . -71.42 -41.6 69.32 Favored 'General case' 0 C--O 1.25 1.091 0 N-CA-C 112.898 0.703 . . . . 30.0 112.898 -178.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . . . -64.59 -40.38 95.42 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 116.547 2.054 . . . . 30.0 116.547 -172.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . . . -59.03 -39.87 83.29 Favored 'General case' 0 C--O 1.243 0.729 0 N-CA-C 114.511 1.3 . . . . 30.0 114.511 -165.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . . . -61.23 -40.04 84.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.412 -0.358 . . . . 30.0 110.982 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . . . -62.74 -41.53 99.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.56 -0.291 . . . . 30.0 111.187 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . . . -63.48 -40.62 97.59 Favored 'General case' 0 C--O 1.245 0.858 0 CA-C-O 121.268 0.556 . . . . 30.0 110.303 177.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . . . -62.11 -41.97 93.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 119.945 -0.702 . . . . 30.0 109.625 178.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.9 95.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.136 -0.484 . . . . 30.0 110.25 179.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . . . -62.41 -40.64 97.19 Favored 'General case' 0 C--O 1.25 1.106 0 CA-C-N 115.653 -0.703 . . . . 30.0 111.758 179.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . . . -62.65 -39.63 94.48 Favored 'General case' 0 C--O 1.249 1.067 0 CA-C-O 121.863 0.839 . . . . 30.0 111.15 178.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . . . -68.36 -40.73 81.4 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 126.678 1.991 . . . . 30.0 110.081 -175.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . . . -62.85 -41.03 99.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 30.0 110.162 179.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . . . -63.29 -41.9 99.03 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.334 -0.393 . . . . 30.0 110.641 177.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.9 -40.54 96.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.005 -0.543 . . . . 30.0 111.818 178.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . . . -62.47 -40.66 97.38 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.532 0.938 . . . . 30.0 113.532 -176.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . . . -62.82 -41.54 99.36 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.201 0.445 . . . . 30.0 112.201 -175.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . . . -62.75 -40.65 97.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.093 0.473 . . . . 30.0 109.789 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . . . -63.36 -39.29 94.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.731 -0.668 . . . . 30.0 111.8 178.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . . . -62.25 -40.61 96.77 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.508 1.299 . . . . 30.0 114.508 -174.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.59 142.48 40.54 Favored Glycine 0 N--CA 1.451 -0.301 0 CA-C-O 121.223 0.346 . . . . 30.0 112.306 -175.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -67.48 152.92 52.86 Favored Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 114.608 0.603 . . . . 30.0 114.608 -174.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . . . -61.79 141.39 17.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.131 0.491 . . . . 30.0 110.651 -177.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . . . -74.85 139.41 43.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.568 -0.742 . . . . 30.0 112.05 -172.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . . . -63.75 -40.08 95.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.044 -0.525 . . . . 30.0 109.936 175.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . . . -67.76 -42.37 81.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.737 -0.665 . . . . 30.0 111.229 -178.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . . . -63.88 -40.55 96.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.031 -0.532 . . . . 30.0 110.535 177.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . . . -71.92 -43.4 65.37 Favored 'General case' 0 C--O 1.251 1.172 0 CA-C-N 115.52 -0.764 . . . . 30.0 112.964 -179.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . . . -64.54 -39.95 94.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.908 -0.587 . . . . 30.0 111.149 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . . . -75.09 -42.76 55.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.318 -0.855 . . . . 30.0 111.31 -173.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . . . -64.21 -40.56 96.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.799 -0.637 . . . . 30.0 111.616 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . . . -66.45 -40.84 89.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.776 -0.647 . . . . 30.0 111.521 -175.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . . . -62.87 -40.82 98.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.03 0.443 . . . . 30.0 110.28 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . . . -64.61 -40.09 94.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.852 -0.613 . . . . 30.0 111.271 177.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . . . -62.67 -40.73 98.0 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.532 0.567 . . . . 30.0 112.532 -176.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . . . -58.29 -39.58 76.52 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 110.123 -0.325 . . . . 30.0 110.123 -179.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.427 0 C-N-CA 120.715 0.943 . . . . 30.0 111.696 -179.781 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.034 0 CA-C-O 120.852 0.358 . . . . 30.0 111.13 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . . . -104.63 -48.81 3.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.109 0.48 . . . . 30.0 111.502 168.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . . . -65.44 -42.16 92.7 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 116.253 1.946 . . . . 30.0 116.253 -177.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . . . -139.94 156.98 46.4 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 114.816 1.413 . . . . 30.0 114.816 -170.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . . . -73.51 158.06 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 N-CA-C 115.925 1.824 . . . . 30.0 115.925 177.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . . . -71.29 156.36 39.62 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.926 1.084 . . . . 30.0 113.926 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . . . -112.82 130.57 23.36 Favored Pre-proline 0 C--N 1.333 -0.15 0 CA-C-N 116.276 -0.42 . . . . 30.0 111.301 -173.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . . . -66.54 142.08 63.52 Favored 'Trans proline' 0 C--N 1.329 -0.46 0 C-N-CA 121.396 1.397 . . . . 30.0 111.61 -178.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . . . -61.45 138.61 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-O 121.123 0.487 . . . . 30.0 110.756 -175.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . . . -135.1 155.44 37.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 108.695 -0.854 . . . . 30.0 108.695 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . . . -62.55 137.74 58.33 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.26 -0.576 . . . . 30.0 109.694 -178.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . . . -71.1 137.6 49.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.896 -0.593 . . . . 30.0 111.847 179.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.438 ' O ' ' N ' ' A' ' 18' ' ' ASP . . . 54.07 43.43 30.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.267 -0.424 . . . . 30.0 112.094 171.964 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . . . -61.38 -41.74 97.6 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.548 -0.538 . . . . 30.0 109.548 -177.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . . . -63.97 -41.14 97.64 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.423 -0.584 . . . . 30.0 109.423 172.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . . . -63.58 -40.29 96.58 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-N 115.662 -0.699 . . . . 30.0 112.111 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.438 ' N ' ' O ' ' A' ' 14' ' ' ARG . . . -62.61 -40.48 97.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.326 -0.397 . . . . 30.0 110.358 -178.516 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . . . -97.75 125.4 42.54 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.011 0.745 . . . . 30.0 113.011 177.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -113.51 -1.55 14.1 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.813 0.671 . . . . 30.0 112.813 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . . . -89.32 -4.11 58.23 Favored 'General case' 0 C--O 1.249 1.073 0 N-CA-C 113.154 0.798 . . . . 30.0 113.154 -175.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . . . -83.81 128.37 63.59 Favored Pre-proline 0 C--O 1.256 1.409 0 CA-C-N 116.206 -0.452 . . . . 30.0 111.97 -175.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . . . -63.67 -40.21 30.85 Favored 'Trans proline' 0 C--N 1.405 3.531 1 C-N-CA 112.851 -4.299 . . . . 30.0 111.68 178.103 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . . . -53.04 -38.2 62.21 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.867 1.062 . . . . 30.0 113.867 -175.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . . . -61.29 -39.39 82.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 113.546 0.943 . . . . 30.0 113.546 -171.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.89 -41.78 98.29 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.083 0.401 . . . . 30.0 112.083 -176.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . . . -63.69 -40.61 97.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.15 0.5 . . . . 30.0 110.963 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . . . -58.86 -38.7 79.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.536 -0.756 . . . . 30.0 111.212 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . . . -61.95 -37.35 84.41 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 113.186 0.81 . . . . 30.0 113.186 -177.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . 0.466 ' O ' ' C ' ' A' ' 31' ' ' LEU . . . -61.03 -40.76 94.82 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.307 0.854 . . . . 30.0 113.307 -172.895 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.466 ' C ' ' O ' ' A' ' 30' ' ' THR . . . -36.99 139.15 0.22 Allowed 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.044 -0.662 . . . . 30.0 110.907 178.785 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . . . -74.5 145.27 43.66 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.324 1.05 . . . . 30.0 113.55 -168.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . . . -62.56 -40.95 98.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.747 -0.66 . . . . 30.0 112.399 -178.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.5 179.74 51.48 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.372 -0.918 . . . . 30.0 113.134 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . . . -63.83 -40.81 97.48 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.692 0.997 . . . . 30.0 113.692 179.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . . . -84.4 124.09 30.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.11 0.481 . . . . 30.0 112.055 -176.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . . . -160.84 166.14 29.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.676 -0.693 . . . . 30.0 110.717 -179.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . . . -67.64 -40.21 84.59 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 123.608 0.763 . . . . 30.0 112.601 -13.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.26 -39.11 63.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.417 -0.81 . . . . 30.0 112.954 -169.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . . . -61.67 -39.62 92.05 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.757 -0.46 . . . . 30.0 109.757 179.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . . . -67.5 -41.68 84.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.095 -0.502 . . . . 30.0 111.723 179.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . . . -63.46 -40.98 98.56 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.109 0.481 . . . . 30.0 112.268 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . . . -65.29 -40.08 87.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 123.544 0.738 . . . . 30.0 110.228 -179.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . . . -62.85 -41.1 99.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.075 -0.511 . . . . 30.0 110.197 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . . . -63.36 -41.0 98.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 30.0 110.345 177.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . . . -63.32 -40.5 97.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.864 -0.607 . . . . 30.0 111.558 179.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . . . -71.42 -41.6 69.32 Favored 'General case' 0 C--O 1.25 1.091 0 N-CA-C 112.898 0.703 . . . . 30.0 112.898 -178.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . . . -64.59 -40.38 95.42 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 116.547 2.054 . . . . 30.0 116.547 -172.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . . . -59.03 -39.87 83.29 Favored 'General case' 0 C--O 1.243 0.729 0 N-CA-C 114.511 1.3 . . . . 30.0 114.511 -165.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . . . -61.23 -40.04 84.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.412 -0.358 . . . . 30.0 110.982 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . . . -62.74 -41.53 99.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.56 -0.291 . . . . 30.0 111.187 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . . . -63.48 -40.62 97.59 Favored 'General case' 0 C--O 1.245 0.858 0 CA-C-O 121.268 0.556 . . . . 30.0 110.303 177.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . . . -62.11 -41.97 93.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 119.945 -0.702 . . . . 30.0 109.625 178.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.9 95.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.136 -0.484 . . . . 30.0 110.25 179.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . . . -62.41 -40.64 97.19 Favored 'General case' 0 C--O 1.25 1.106 0 CA-C-N 115.653 -0.703 . . . . 30.0 111.758 179.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . . . -62.65 -39.63 94.48 Favored 'General case' 0 C--O 1.249 1.067 0 CA-C-O 121.863 0.839 . . . . 30.0 111.15 178.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . . . -68.36 -40.73 81.4 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 126.678 1.991 . . . . 30.0 110.081 -175.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . . . -62.85 -41.03 99.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 30.0 110.162 179.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . . . -63.29 -41.9 99.03 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.334 -0.393 . . . . 30.0 110.641 177.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.9 -40.54 96.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.005 -0.543 . . . . 30.0 111.818 178.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . . . -62.47 -40.66 97.38 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.532 0.938 . . . . 30.0 113.532 -176.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . . . -62.82 -41.54 99.36 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.201 0.445 . . . . 30.0 112.201 -175.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . . . -62.75 -40.65 97.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.093 0.473 . . . . 30.0 109.789 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . . . -63.36 -39.29 94.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.731 -0.668 . . . . 30.0 111.8 178.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . . . -62.25 -40.61 96.77 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.508 1.299 . . . . 30.0 114.508 -174.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.59 142.48 40.54 Favored Glycine 0 N--CA 1.451 -0.301 0 CA-C-O 121.223 0.346 . . . . 30.0 112.306 -175.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -67.48 152.92 52.86 Favored Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 114.608 0.603 . . . . 30.0 114.608 -174.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . . . -61.79 141.39 17.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.131 0.491 . . . . 30.0 110.651 -177.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . . . -74.85 139.41 43.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.568 -0.742 . . . . 30.0 112.05 -172.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . . . -63.75 -40.08 95.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.044 -0.525 . . . . 30.0 109.936 175.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . . . -67.76 -42.37 81.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.737 -0.665 . . . . 30.0 111.229 -178.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . . . -63.88 -40.55 96.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.031 -0.532 . . . . 30.0 110.535 177.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . . . -71.92 -43.4 65.37 Favored 'General case' 0 C--O 1.251 1.172 0 CA-C-N 115.52 -0.764 . . . . 30.0 112.964 -179.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . . . -64.54 -39.95 94.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.908 -0.587 . . . . 30.0 111.149 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . . . -75.09 -42.76 55.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.318 -0.855 . . . . 30.0 111.31 -173.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . . . -64.21 -40.56 96.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.799 -0.637 . . . . 30.0 111.616 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . . . -66.45 -40.84 89.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.776 -0.647 . . . . 30.0 111.521 -175.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . . . -62.87 -40.82 98.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.03 0.443 . . . . 30.0 110.28 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . . . -64.61 -40.09 94.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.852 -0.613 . . . . 30.0 111.271 177.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . . . -62.67 -40.73 98.0 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.532 0.567 . . . . 30.0 112.532 -176.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . . . -58.29 -39.58 76.52 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 110.123 -0.325 . . . . 30.0 110.123 -179.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.427 0 C-N-CA 120.715 0.943 . . . . 30.0 111.696 -179.781 . . . . . . . . 0 0 . 1 stop_ save_