data_1snp_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 1snp _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 ' 6' ' ' LYS . . . . . . . . . . . . . 22.8 tttm . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 111.141 0.052 . . . . 77.83 111.141 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 41.3 mt -79.68 152.07 30.14 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 108.57 -0.9 . . . . 54.74 108.57 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 -125.78 138.85 53.87 Favored 'General case' 0 C--O 1.214 -0.794 0 O-C-N 123.376 0.422 . . . . 67.13 111.323 -177.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -90.92 140.04 30.2 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 108.419 -0.956 . . . . 40.9 108.419 177.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -127.76 139.55 35.63 Favored Pre-proline 0 C--N 1.327 -0.385 0 N-CA-C 109.196 -0.668 . . . . 54.85 109.196 179.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -69.92 151.73 68.26 Favored 'Trans proline' 0 CA--C 1.49 -1.717 0 N-CA-C 110.485 -0.621 . . . . 32.59 110.485 -179.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -145.16 167.8 21.89 Favored 'General case' 0 C--O 1.248 1.009 0 N-CA-C 103.315 -2.846 . . . . 29.15 103.315 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 35.7 m -128.68 130.18 46.84 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 105.345 -2.094 . . . . 34.42 105.345 178.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.7 tp -63.9 136.05 57.05 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 120.078 -0.649 . . . . 34.34 110.598 179.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.5 mt -111.7 -61.3 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 N-CA-C 104.279 -2.489 . . . . 38.0 104.279 177.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.3 tttm -155.35 135.71 13.21 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.29 0.478 . . . . 62.85 112.29 -179.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -91.72 122.87 34.66 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 104.972 -2.233 . . . . 39.52 104.972 177.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.0 mp -83.31 -75.49 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 N-CA-C 108.528 -0.916 . . . . 49.34 108.528 -179.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 57.9 p-10 -136.87 -155.0 0.58 Allowed 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 119.709 -0.796 . . . . 47.37 111.969 176.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -59.24 -42.52 97.3 Favored Glycine 0 C--O 1.216 -0.976 0 N-CA-C 117.701 1.84 . . . . 34.09 117.701 -178.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 41.0 p30 -112.49 11.39 19.8 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 117.011 2.226 . . . . 48.6 117.011 -177.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 38.3 m -134.61 126.66 29.65 Favored 'General case' 0 C--O 1.245 0.848 0 O-C-N 123.625 0.578 . . . . 30.64 111.433 -178.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.7 t -132.26 144.04 38.2 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 C-N-CA 123.899 0.88 . . . . 38.54 110.381 -178.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -103.27 121.04 41.89 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 107.461 -1.311 . . . . 66.65 107.461 -179.803 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 35.6 mt -131.65 155.68 47.17 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.589 1.329 . . . . 36.96 114.589 -177.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 58.4 tpp -94.44 113.73 25.64 Favored 'General case' 0 N--CA 1.443 -0.804 1 N-CA-C 99.289 -4.337 . . . . 48.88 99.289 177.6 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -126.22 119.01 26.36 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.462 -1.31 . . . . 38.47 107.462 -178.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 76.6 mttt 56.95 43.12 25.19 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.994 1.109 . . . . 59.04 113.994 -179.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.89 23.14 77.1 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 117.161 1.624 . . . . 50.25 117.161 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -155.6 137.44 9.76 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 118.04 0.92 . . . . 74.77 110.277 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -67.96 144.48 64.4 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 120.922 1.081 . . . . 44.84 111.111 179.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 18.2 ttt -155.55 144.15 20.38 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.434 -0.803 . . . . 62.41 109.221 -177.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.8 m -95.51 131.58 41.53 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 107.659 -1.237 . . . . 38.02 107.659 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -114.95 141.0 48.56 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.584 -0.734 . . . . 31.11 110.464 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.5 tpt85 -109.11 125.91 52.65 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 101.495 -3.52 . . . . 31.71 101.495 177.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.93 127.13 30.84 Favored 'General case' 0 C--O 1.238 0.499 0 O-C-N 122.489 -0.132 . . . . 33.45 110.748 -179.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 mt -67.27 145.16 55.44 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 112.784 0.661 . . . . 26.19 112.784 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 18.9 mt 56.94 20.11 5.08 Favored 'General case' 0 CA--C 1.493 -1.231 0 N-CA-C 120.661 3.578 . . . . 34.37 120.661 176.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.8 m -130.85 146.8 33.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 C-N-CA 119.695 -0.802 . . . . 34.74 109.631 178.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -125.81 100.65 6.5 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 107.157 -1.423 . . . . 51.02 107.157 177.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 40.5 p -90.61 159.88 40.08 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.516 -0.55 . . . . 44.41 109.516 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -72.35 136.54 26.63 Favored 'Trans proline' 0 CA--C 1.55 1.307 0 N-CA-C 107.729 -1.681 . . . . 53.88 107.729 179.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.4 136.14 42.41 Favored 'General case' 0 CA--C 1.51 -0.562 0 O-C-N 122.29 -0.256 . . . . 72.52 110.702 -179.927 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.326 -0.424 0 N-CA-C 109.017 -0.734 . . . . 92.51 109.017 177.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 78.3 t . . . . . 0 CA--C 1.532 0.255 0 N-CA-C 113.182 0.808 . . . . 101.17 113.182 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -92.0 161.26 14.87 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 107.047 -1.464 . . . . 84.58 107.047 178.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.8 tptp -58.49 127.16 30.75 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 105.227 -2.138 . . . . 72.89 105.227 178.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 77.0 -3.95 2.43 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 116.269 1.951 . . . . 54.26 116.269 -178.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -59.67 -49.81 74.57 Favored Glycine 0 C--O 1.221 -0.714 0 C-N-CA 120.013 -1.089 . . . . 42.26 110.704 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -60.95 -32.96 92.99 Favored 'Trans proline' 0 C--O 1.222 -0.294 0 C-N-CA 122.711 2.274 . . . . 35.5 112.907 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -72.99 -38.3 66.7 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.033 -0.53 . . . . 53.61 112.223 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.45 -40.49 73.68 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.634 -0.876 . . . . 31.17 108.634 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.8 m -60.63 -50.24 74.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.348 -0.387 . . . . 36.59 110.601 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.97 -43.0 95.36 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 115.621 -0.718 . . . . 32.91 112.69 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -61.89 -48.49 80.24 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.208 -0.905 . . . . 34.43 110.717 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 93.3 m -62.06 -46.0 91.04 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 116.539 -0.3 . . . . 30.38 111.236 179.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -57.9 -51.4 69.77 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 122.32 1.057 . . . . 54.18 112.13 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.2 ttpp -58.7 -45.23 89.97 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 114.265 -1.334 . . . . 55.41 110.259 -179.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 9.9 ttt -60.97 -42.28 98.01 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 113.171 0.804 . . . . 36.12 113.171 -179.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 m -84.67 -23.94 7.37 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 N-CA-C 115.603 1.705 . . . . 32.72 115.603 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -76.8 -37.5 55.65 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.172 -1.011 . . . . 53.8 112.41 179.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -82.2 -3.03 54.19 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.562 0.949 . . . . 50.04 113.562 -179.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -76.79 143.89 39.53 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 112.528 0.566 . . . . 40.85 112.528 -178.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -87.67 -32.93 18.97 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 106.245 -1.761 . . . . 46.38 106.245 177.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -132.71 129.84 39.25 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.457 -0.792 . . . . 54.48 112.378 -179.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 45.3 mm -111.98 138.3 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 N-CA-C 104.155 -2.535 . . . . 32.83 104.155 176.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -135.15 145.8 48.16 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 107.771 -1.196 . . . . 44.09 107.771 177.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.2 m -116.76 145.62 22.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 107.498 -1.297 . . . . 35.48 107.498 177.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -138.33 110.6 7.39 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.456 -0.942 . . . . 32.46 108.456 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -78.05 151.46 33.47 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 119.954 -0.698 . . . . 25.61 109.232 179.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -91.94 -173.43 3.48 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.779 -1.563 . . . . 28.93 106.779 178.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -81.56 -14.81 56.39 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 116.004 1.853 . . . . 57.87 116.004 -177.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -88.56 -151.32 23.03 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 120.052 -1.071 . . . . 30.75 112.903 179.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -63.28 130.82 46.17 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 122.524 0.33 . . . . 37.97 111.461 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.7 mmt85 -87.5 -6.45 58.37 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 117.971 2.582 . . . . 54.82 117.971 -177.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 81.6 p -144.79 153.14 41.33 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.791 -0.818 . . . . 34.87 108.791 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 54.5 p30 -96.83 -178.54 4.26 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.362 -0.535 . . . . 31.91 111.077 179.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -59.94 -24.06 64.05 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 114.075 1.139 . . . . 58.38 114.075 -178.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -90.7 5.27 48.82 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.214 0.82 . . . . 45.03 113.214 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.32 15.1 79.21 Favored Glycine 0 C--O 1.221 -0.717 0 N-CA-C 115.8 1.08 . . . . 30.82 115.8 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -88.49 134.22 33.92 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-N 117.847 0.824 . . . . 34.75 110.538 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -66.04 147.77 50.43 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 107.34 -2.304 . . . . 27.65 107.34 177.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 68.9 mt -115.4 108.57 16.68 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 106.08 -1.822 . . . . 27.02 106.08 179.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -151.04 174.16 13.49 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 114.255 1.206 . . . . 25.69 114.255 -178.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -99.14 128.61 45.3 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 100.402 -3.925 . . . . 26.64 100.402 175.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 27.8 mm -106.07 133.0 51.73 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.751 0 N-CA-C 109.215 -0.661 . . . . 31.0 109.215 -179.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -115.04 134.32 55.28 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 123.61 0.569 . . . . 28.13 110.522 178.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -117.06 109.45 16.98 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 104.605 -2.369 . . . . 31.71 104.605 177.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 51.93 46.56 26.38 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-O 121.447 0.641 . . . . 37.15 110.213 -178.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 82.2 -16.88 20.62 Favored Glycine 0 N--CA 1.442 -0.95 0 N-CA-C 117.617 1.807 . . . . 35.21 117.617 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -93.48 125.6 38.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 117.92 0.86 . . . . 59.63 110.839 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.2 ttm -72.02 119.15 15.79 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-O 121.081 0.467 . . . . 28.19 111.802 -178.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 56.4 t -63.06 -38.63 82.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.606 -0.724 . . . . 31.68 111.604 -179.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -55.26 -51.46 66.56 Favored 'General case' 0 C--O 1.248 1.02 0 CA-C-N 116.24 -0.436 . . . . 26.91 110.131 179.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -67.48 -42.22 83.31 Favored 'General case' 0 C--O 1.236 0.367 0 O-C-N 123.888 0.743 . . . . 35.11 111.575 -179.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.77 -44.18 77.44 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.391 0.515 . . . . 26.66 112.391 179.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 35.1 mt -63.15 -45.74 90.44 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.911 0.386 . . . . 31.53 111.213 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 56.0 t -64.1 -46.28 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-N 115.522 -0.763 . . . . 27.3 110.711 -179.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 44.9 tpt85 -60.35 -31.98 70.84 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 113.119 0.785 . . . . 27.23 113.119 -179.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -86.41 1.67 50.41 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.734 1.214 . . . . 40.65 113.802 -179.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.99 24.52 76.43 Favored Glycine 0 CA--C 1.52 0.377 0 C-N-CA 120.661 -0.78 . . . . 30.74 113.693 179.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 81.2 mt -104.87 10.17 34.47 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.164 0.801 . . . . 32.97 113.164 -179.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -168.51 162.47 12.16 Favored 'General case' 0 CA--C 1.5 -0.979 0 N-CA-C 107.411 -1.329 . . . . 33.2 107.411 179.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.6 mtpp -113.24 155.66 24.67 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.088 -1.449 . . . . 78.17 107.088 178.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 82.3 t -75.5 123.18 30.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 105.138 -2.171 . . . . 37.85 105.138 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -82.48 164.01 21.21 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 117.854 0.297 . . . . 35.64 111.287 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -65.99 145.1 56.28 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 106.263 -1.754 . . . . 64.87 106.263 179.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 58.2 t -55.93 145.54 6.12 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.375 0 O-C-N 123.669 0.605 . . . . 43.64 109.615 177.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -124.73 119.92 30.31 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 121.436 0.636 . . . . 46.69 109.751 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 32.4 mmtm 45.79 41.18 7.3 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 119.181 3.03 . . . . 55.46 119.181 177.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 85.56 10.73 76.14 Favored Glycine 0 C--N 1.336 0.581 0 N-CA-C 117.924 1.93 . . . . 30.95 117.924 177.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -97.03 86.45 3.98 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 106.376 -1.712 . . . . 29.31 106.376 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -136.16 9.07 3.22 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 116.71 2.115 . . . . 49.46 116.71 -177.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 97.4 m -45.07 -48.31 11.88 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.415 1.265 . . . . 32.84 114.415 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 44.2 m-70 -99.44 17.0 21.34 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 116.504 2.038 . . . . 30.3 116.504 -178.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 54.6 tt0 -60.2 -43.04 96.25 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.972 0.73 . . . . 41.33 112.972 -179.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -63.87 -46.12 86.36 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 120.423 -0.511 . . . . 74.06 112.285 -179.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.2 tp -54.71 -49.31 71.06 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.957 0.786 . . . . 35.67 109.913 178.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.5 mp -67.51 -32.04 72.57 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.021 0.748 . . . . 37.32 113.021 -178.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 33.8 mmt180 -66.21 -38.26 87.53 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.008 0.432 . . . . 58.83 110.206 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 35.5 mmtp -63.55 -50.81 68.08 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 109.423 -0.584 . . . . 52.63 109.423 179.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 36.2 m -59.35 -39.34 82.89 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 112.695 0.628 . . . . 32.67 112.695 -179.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -64.8 -37.98 89.43 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 123.577 0.548 . . . . 41.61 110.724 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.0 -47.87 81.28 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 107.789 -1.189 . . . . 35.65 107.789 179.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 9.8 tp-100 -62.04 -46.39 89.36 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-N 115.861 -0.609 . . . . 48.12 111.878 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.52 -34.07 74.9 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.5 0.667 . . . . 32.3 110.618 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -71.71 -39.9 69.83 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.411 -0.959 . . . . 65.53 108.411 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 21.2 ttpp -64.33 -30.35 71.4 Favored 'General case' 0 C--O 1.22 -0.471 0 O-C-N 123.956 0.785 . . . . 60.79 110.167 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -93.45 9.77 35.16 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.039 -0.413 . . . . 32.98 111.219 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 37.9 mttm 45.74 41.85 7.93 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.807 0.337 . . . . 57.61 110.856 179.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 7.4 mt -78.77 132.38 36.89 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 114.692 1.367 . . . . 38.51 114.692 -178.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 38.88 -101.46 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 117.627 2.454 . . . . 46.61 117.627 177.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 19.8 mt -53.9 -28.37 16.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.165 -0.47 . . . . 49.16 111.375 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -96.43 13.62 27.23 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.175 1.546 . . . . 52.39 115.175 -179.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 79.5 p . . . . . 0 C--O 1.25 1.116 0 N-CA-C 106.861 -1.533 . . . . 57.22 106.861 178.167 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.8 tttm . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 111.141 0.052 . . . . 77.83 111.141 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 41.3 mt -79.68 152.07 30.14 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 108.57 -0.9 . . . . 54.74 108.57 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 -125.78 138.85 53.87 Favored 'General case' 0 C--O 1.214 -0.794 0 O-C-N 123.376 0.422 . . . . 67.13 111.323 -177.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -90.92 140.04 30.2 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 108.419 -0.956 . . . . 40.9 108.419 177.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -127.76 139.55 35.63 Favored Pre-proline 0 C--N 1.327 -0.385 0 N-CA-C 109.196 -0.668 . . . . 54.85 109.196 179.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -69.92 151.73 68.26 Favored 'Trans proline' 0 CA--C 1.49 -1.717 0 N-CA-C 110.485 -0.621 . . . . 32.59 110.485 -179.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -145.16 167.8 21.89 Favored 'General case' 0 C--O 1.248 1.009 0 N-CA-C 103.315 -2.846 . . . . 29.15 103.315 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 35.7 m -128.68 130.18 46.84 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 105.345 -2.094 . . . . 34.42 105.345 178.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.7 tp -63.9 136.05 57.05 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 120.078 -0.649 . . . . 34.34 110.598 179.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.5 mt -111.7 -61.3 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 N-CA-C 104.279 -2.489 . . . . 38.0 104.279 177.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.3 tttm -155.35 135.71 13.21 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.29 0.478 . . . . 62.85 112.29 -179.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -91.72 122.87 34.66 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 104.972 -2.233 . . . . 39.52 104.972 177.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ILE . . . . . 0.508 ' N ' HD12 ' A' ' 18' ' ' ILE . 2.0 mp -83.31 -75.49 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 N-CA-C 108.528 -0.916 . . . . 49.34 108.528 -179.203 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 57.9 p-10 -136.87 -155.0 0.58 Allowed 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 119.709 -0.796 . . . . 47.37 111.969 176.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -59.24 -42.52 97.3 Favored Glycine 0 C--O 1.216 -0.976 0 N-CA-C 117.701 1.84 . . . . 34.09 117.701 -178.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 41.0 p30 -112.49 11.39 19.8 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 117.011 2.226 . . . . 48.6 117.011 -177.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 38.3 m -134.61 126.66 29.65 Favored 'General case' 0 C--O 1.245 0.848 0 O-C-N 123.625 0.578 . . . . 30.64 111.433 -178.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.7 t -132.26 144.04 38.2 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 C-N-CA 123.899 0.88 . . . . 38.54 110.381 -178.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . 0.674 ' HE2' ' HB2' ' A' ' 31' ' ' PRO . 0.3 OUTLIER -103.27 121.04 41.89 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 107.461 -1.311 . . . . 66.65 107.461 -179.803 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 35.6 mt -131.65 155.68 47.17 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.589 1.329 . . . . 36.96 114.589 -177.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 58.4 tpp -94.44 113.73 25.64 Favored 'General case' 0 N--CA 1.443 -0.804 1 N-CA-C 99.289 -4.337 . . . . 48.88 99.289 177.6 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -126.22 119.01 26.36 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.462 -1.31 . . . . 38.47 107.462 -178.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 76.6 mttt 56.95 43.12 25.19 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.994 1.109 . . . . 59.04 113.994 -179.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.89 23.14 77.1 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 117.161 1.624 . . . . 50.25 117.161 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -155.6 137.44 9.76 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 118.04 0.92 . . . . 74.77 110.277 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' PRO . . . . . 0.674 ' HB2' ' HE2' ' A' ' 24' ' ' LYS . 61.6 Cg_endo -67.96 144.48 64.4 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 120.922 1.081 . . . . 44.84 111.111 179.839 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 18.2 ttt -155.55 144.15 20.38 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.434 -0.803 . . . . 62.41 109.221 -177.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.8 m -95.51 131.58 41.53 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 107.659 -1.237 . . . . 38.02 107.659 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -114.95 141.0 48.56 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.584 -0.734 . . . . 31.11 110.464 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.5 tpt85 -109.11 125.91 52.65 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 101.495 -3.52 . . . . 31.71 101.495 177.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.93 127.13 30.84 Favored 'General case' 0 C--O 1.238 0.499 0 O-C-N 122.489 -0.132 . . . . 33.45 110.748 -179.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 mt -67.27 145.16 55.44 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 112.784 0.661 . . . . 26.19 112.784 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 18.9 mt 56.94 20.11 5.08 Favored 'General case' 0 CA--C 1.493 -1.231 0 N-CA-C 120.661 3.578 . . . . 34.37 120.661 176.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.8 m -130.85 146.8 33.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 C-N-CA 119.695 -0.802 . . . . 34.74 109.631 178.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -125.81 100.65 6.5 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 107.157 -1.423 . . . . 51.02 107.157 177.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' THR . . . . . 0.494 HG22 ' HB2' ' A' ' 109' ' ' ALA . 40.5 p -90.61 159.88 40.08 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.516 -0.55 . . . . 44.41 109.516 179.458 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -72.35 136.54 26.63 Favored 'Trans proline' 0 CA--C 1.55 1.307 0 N-CA-C 107.729 -1.681 . . . . 53.88 107.729 179.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . 0.422 ' HB2' ' OE2' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -74.4 136.14 42.41 Favored 'General case' 0 CA--C 1.51 -0.562 0 O-C-N 122.29 -0.256 . . . . 72.52 110.702 -179.927 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . 0.54 ' C ' ' HA ' ' A' ' 51' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--N 1.326 -0.424 0 N-CA-C 109.017 -0.734 . . . . 92.51 109.017 177.933 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' VAL . . . . . 0.54 ' HA ' ' C ' ' A' ' 44' ' ' THR . 78.3 t . . . . . 0 CA--C 1.532 0.255 0 N-CA-C 113.182 0.808 . . . . 101.17 113.182 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . 0.422 ' OE2' ' HB2' ' A' ' 43' ' ' GLU . 34.8 mt-10 -92.0 161.26 14.87 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 107.047 -1.464 . . . . 84.58 107.047 178.749 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 54' ' ' TYR . 15.8 tptp -58.49 127.16 30.75 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 105.227 -2.138 . . . . 72.89 105.227 178.597 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' TYR . . . . . 0.423 ' HB2' ' O ' ' A' ' 53' ' ' LYS . 57.9 m-85 77.0 -3.95 2.43 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 116.269 1.951 . . . . 54.26 116.269 -178.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -59.67 -49.81 74.57 Favored Glycine 0 C--O 1.221 -0.714 0 C-N-CA 120.013 -1.089 . . . . 42.26 110.704 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -60.95 -32.96 92.99 Favored 'Trans proline' 0 C--O 1.222 -0.294 0 C-N-CA 122.711 2.274 . . . . 35.5 112.907 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -72.99 -38.3 66.7 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.033 -0.53 . . . . 53.61 112.223 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.45 -40.49 73.68 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.634 -0.876 . . . . 31.17 108.634 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.8 m -60.63 -50.24 74.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.348 -0.387 . . . . 36.59 110.601 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.97 -43.0 95.36 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 115.621 -0.718 . . . . 32.91 112.69 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PHE . . . . . 0.511 ' HA ' ' HE3' ' A' ' 64' ' ' LYS . 51.2 t80 -61.89 -48.49 80.24 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.208 -0.905 . . . . 34.43 110.717 179.813 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 93.3 m -62.06 -46.0 91.04 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 116.539 -0.3 . . . . 30.38 111.236 179.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . 0.413 ' HE3' ' OE2' ' A' ' 67' ' ' GLU . 83.4 tttt -57.9 -51.4 69.77 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 122.32 1.057 . . . . 54.18 112.13 179.787 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . 0.511 ' HE3' ' HA ' ' A' ' 61' ' ' PHE . 6.2 ttpp -58.7 -45.23 89.97 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 114.265 -1.334 . . . . 55.41 110.259 -179.608 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 9.9 ttt -60.97 -42.28 98.01 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 113.171 0.804 . . . . 36.12 113.171 -179.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 m -84.67 -23.94 7.37 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 N-CA-C 115.603 1.705 . . . . 32.72 115.603 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . 0.413 ' OE2' ' HE3' ' A' ' 63' ' ' LYS . 95.2 mt-10 -76.8 -37.5 55.65 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.172 -1.011 . . . . 53.8 112.41 179.413 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -82.2 -3.03 54.19 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.562 0.949 . . . . 50.04 113.562 -179.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -76.79 143.89 39.53 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 112.528 0.566 . . . . 40.85 112.528 -178.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -87.67 -32.93 18.97 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 106.245 -1.761 . . . . 46.38 106.245 177.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -132.71 129.84 39.25 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.457 -0.792 . . . . 54.48 112.378 -179.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 45.3 mm -111.98 138.3 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 N-CA-C 104.155 -2.535 . . . . 32.83 104.155 176.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -135.15 145.8 48.16 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 107.771 -1.196 . . . . 44.09 107.771 177.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.2 m -116.76 145.62 22.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 107.498 -1.297 . . . . 35.48 107.498 177.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -138.33 110.6 7.39 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.456 -0.942 . . . . 32.46 108.456 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PHE . . . . . 0.504 ' HB3' ' HD2' ' A' ' 81' ' ' ARG . 63.4 m-85 -78.05 151.46 33.47 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 119.954 -0.698 . . . . 25.61 109.232 179.217 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASP . . . . . 0.541 ' HB3' ' OD1' ' A' ' 118' ' ' ASN . 11.0 t0 -91.94 -173.43 3.48 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.779 -1.563 . . . . 28.93 106.779 178.441 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -81.56 -14.81 56.39 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 116.004 1.853 . . . . 57.87 116.004 -177.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -88.56 -151.32 23.03 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 120.052 -1.071 . . . . 30.75 112.903 179.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -63.28 130.82 46.17 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 122.524 0.33 . . . . 37.97 111.461 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ARG . . . . . 0.504 ' HD2' ' HB3' ' A' ' 76' ' ' PHE . 15.7 mmt85 -87.5 -6.45 58.37 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 117.971 2.582 . . . . 54.82 117.971 -177.379 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 81.6 p -144.79 153.14 41.33 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.791 -0.818 . . . . 34.87 108.791 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 54.5 p30 -96.83 -178.54 4.26 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.362 -0.535 . . . . 31.91 111.077 179.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -59.94 -24.06 64.05 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 114.075 1.139 . . . . 58.38 114.075 -178.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -90.7 5.27 48.82 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.214 0.82 . . . . 45.03 113.214 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.32 15.1 79.21 Favored Glycine 0 C--O 1.221 -0.717 0 N-CA-C 115.8 1.08 . . . . 30.82 115.8 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -88.49 134.22 33.92 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-N 117.847 0.824 . . . . 34.75 110.538 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -66.04 147.77 50.43 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 107.34 -2.304 . . . . 27.65 107.34 177.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 68.9 mt -115.4 108.57 16.68 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 106.08 -1.822 . . . . 27.02 106.08 179.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -151.04 174.16 13.49 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 114.255 1.206 . . . . 25.69 114.255 -178.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -99.14 128.61 45.3 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 100.402 -3.925 . . . . 26.64 100.402 175.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 27.8 mm -106.07 133.0 51.73 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.751 0 N-CA-C 109.215 -0.661 . . . . 31.0 109.215 -179.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -115.04 134.32 55.28 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 123.61 0.569 . . . . 28.13 110.522 178.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -117.06 109.45 16.98 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 104.605 -2.369 . . . . 31.71 104.605 177.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 51.93 46.56 26.38 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-O 121.447 0.641 . . . . 37.15 110.213 -178.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 82.2 -16.88 20.62 Favored Glycine 0 N--CA 1.442 -0.95 0 N-CA-C 117.617 1.807 . . . . 35.21 117.617 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -93.48 125.6 38.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 117.92 0.86 . . . . 59.63 110.839 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.2 ttm -72.02 119.15 15.79 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-O 121.081 0.467 . . . . 28.19 111.802 -178.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 56.4 t -63.06 -38.63 82.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.606 -0.724 . . . . 31.68 111.604 -179.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -55.26 -51.46 66.56 Favored 'General case' 0 C--O 1.248 1.02 0 CA-C-N 116.24 -0.436 . . . . 26.91 110.131 179.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -67.48 -42.22 83.31 Favored 'General case' 0 C--O 1.236 0.367 0 O-C-N 123.888 0.743 . . . . 35.11 111.575 -179.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.77 -44.18 77.44 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.391 0.515 . . . . 26.66 112.391 179.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 35.1 mt -63.15 -45.74 90.44 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.911 0.386 . . . . 31.53 111.213 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 56.0 t -64.1 -46.28 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-N 115.522 -0.763 . . . . 27.3 110.711 -179.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 44.9 tpt85 -60.35 -31.98 70.84 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 113.119 0.785 . . . . 27.23 113.119 -179.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 30.5 tp60 -86.41 1.67 50.41 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.734 1.214 . . . . 40.65 113.802 -179.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.99 24.52 76.43 Favored Glycine 0 CA--C 1.52 0.377 0 C-N-CA 120.661 -0.78 . . . . 30.74 113.693 179.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 81.2 mt -104.87 10.17 34.47 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.164 0.801 . . . . 32.97 113.164 -179.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . 0.494 ' HB2' HG22 ' A' ' 41' ' ' THR . . . -168.51 162.47 12.16 Favored 'General case' 0 CA--C 1.5 -0.979 0 N-CA-C 107.411 -1.329 . . . . 33.2 107.411 179.4 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.6 mtpp -113.24 155.66 24.67 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.088 -1.449 . . . . 78.17 107.088 178.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 82.3 t -75.5 123.18 30.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 105.138 -2.171 . . . . 37.85 105.138 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -82.48 164.01 21.21 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 117.854 0.297 . . . . 35.64 111.287 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -65.99 145.1 56.28 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 106.263 -1.754 . . . . 64.87 106.263 179.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 58.2 t -55.93 145.54 6.12 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.375 0 O-C-N 123.669 0.605 . . . . 43.64 109.615 177.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -124.73 119.92 30.31 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 121.436 0.636 . . . . 46.69 109.751 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 32.4 mmtm 45.79 41.18 7.3 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 119.181 3.03 . . . . 55.46 119.181 177.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 85.56 10.73 76.14 Favored Glycine 0 C--N 1.336 0.581 0 N-CA-C 117.924 1.93 . . . . 30.95 117.924 177.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ASN . . . . . 0.541 ' OD1' ' HB3' ' A' ' 77' ' ' ASP . 77.5 m-20 -97.03 86.45 3.98 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 106.376 -1.712 . . . . 29.31 106.376 179.127 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -136.16 9.07 3.22 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 116.71 2.115 . . . . 49.46 116.71 -177.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 97.4 m -45.07 -48.31 11.88 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.415 1.265 . . . . 32.84 114.415 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 44.2 m-70 -99.44 17.0 21.34 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 116.504 2.038 . . . . 30.3 116.504 -178.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 54.6 tt0 -60.2 -43.04 96.25 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.972 0.73 . . . . 41.33 112.972 -179.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' GLN . . . . . 0.441 ' O ' ' HG2' ' A' ' 127' ' ' LYS . 7.0 mm-40 -63.87 -46.12 86.36 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 120.423 -0.511 . . . . 74.06 112.285 -179.587 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.2 tp -54.71 -49.31 71.06 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.957 0.786 . . . . 35.67 109.913 178.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.5 mp -67.51 -32.04 72.57 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.021 0.748 . . . . 37.32 113.021 -178.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 33.8 mmt180 -66.21 -38.26 87.53 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.008 0.432 . . . . 58.83 110.206 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LYS . . . . . 0.441 ' HG2' ' O ' ' A' ' 123' ' ' GLN . 35.5 mmtp -63.55 -50.81 68.08 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 109.423 -0.584 . . . . 52.63 109.423 179.104 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 36.2 m -59.35 -39.34 82.89 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 112.695 0.628 . . . . 32.67 112.695 -179.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -64.8 -37.98 89.43 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 123.577 0.548 . . . . 41.61 110.724 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.0 -47.87 81.28 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 107.789 -1.189 . . . . 35.65 107.789 179.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLN . . . . . 0.415 HE22 ' CE ' ' A' ' 134' ' ' LYS . 9.8 tp-100 -62.04 -46.39 89.36 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-N 115.861 -0.609 . . . . 48.12 111.878 179.198 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.52 -34.07 74.9 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.5 0.667 . . . . 32.3 110.618 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LYS . . . . . 0.573 ' HG3' ' CD2' ' A' ' 140' ' ' TRP . 14.0 ttmt -71.71 -39.9 69.83 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.411 -0.959 . . . . 65.53 108.411 179.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' LYS . . . . . 0.415 ' CE ' HE22 ' A' ' 131' ' ' GLN . 21.2 ttpp -64.33 -30.35 71.4 Favored 'General case' 0 C--O 1.22 -0.471 0 O-C-N 123.956 0.785 . . . . 60.79 110.167 178.216 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -93.45 9.77 35.16 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.039 -0.413 . . . . 32.98 111.219 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 37.9 mttm 45.74 41.85 7.93 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.807 0.337 . . . . 57.61 110.856 179.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 7.4 mt -78.77 132.38 36.89 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 114.692 1.367 . . . . 38.51 114.692 -178.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 38.88 -101.46 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 117.627 2.454 . . . . 46.61 117.627 177.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 19.8 mt -53.9 -28.37 16.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.165 -0.47 . . . . 49.16 111.375 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' TRP . . . . . 0.573 ' CD2' ' HG3' ' A' ' 133' ' ' LYS . 57.0 m95 -96.43 13.62 27.23 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.175 1.546 . . . . 52.39 115.175 -179.325 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 79.5 p . . . . . 0 C--O 1.25 1.116 0 N-CA-C 106.861 -1.533 . . . . 57.22 106.861 178.167 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.8 tttm . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 111.141 0.052 . . . . 77.829999999999998 111.141 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 41.3 mt -79.68 152.07 30.14 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 108.57 -0.9 . . . . 54.740000000000002 108.57 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 -125.78 138.85 53.87 Favored 'General case' 0 C--O 1.214 -0.794 0 O-C-N 123.376 0.422 . . . . 67.129999999999995 111.323 -177.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -90.92 140.04 30.2 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 108.419 -0.956 . . . . 40.899999999999999 108.419 177.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -127.76 139.55 35.63 Favored Pre-proline 0 C--N 1.327 -0.385 0 N-CA-C 109.196 -0.668 . . . . 54.850000000000001 109.196 179.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -69.92 151.73 68.26 Favored 'Trans proline' 0 CA--C 1.49 -1.717 0 N-CA-C 110.485 -0.621 . . . . 32.590000000000003 110.485 -179.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -145.16 167.8 21.89 Favored 'General case' 0 C--O 1.248 1.009 0 N-CA-C 103.315 -2.846 . . . . 29.149999999999999 103.315 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 35.7 m -128.68 130.18 46.84 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 105.345 -2.094 . . . . 34.420000000000002 105.345 178.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.7 tp -63.9 136.05 57.05 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 120.078 -0.649 . . . . 34.340000000000003 110.598 179.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.5 mt -111.7 -61.3 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 N-CA-C 104.279 -2.489 . . . . 38.0 104.279 177.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.3 tttm -155.35 135.71 13.21 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.29 0.478 . . . . 62.850000000000001 112.29 -179.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -91.72 122.87 34.66 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 104.972 -2.233 . . . . 39.520000000000003 104.972 177.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.508 HD12 ' N ' ' A' ' 18' ' ' ILE . 2.0 mp -83.31 -75.49 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 N-CA-C 108.528 -0.916 . . . . 49.340000000000003 108.528 -179.203 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 57.9 p-10 -136.87 -155.0 0.58 Allowed 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 119.709 -0.796 . . . . 47.369999999999997 111.969 176.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -59.24 -42.52 97.3 Favored Glycine 0 C--O 1.216 -0.976 0 N-CA-C 117.701 1.84 . . . . 34.090000000000003 117.701 -178.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 41.0 p30 -112.49 11.39 19.8 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 117.011 2.226 . . . . 48.600000000000001 117.011 -177.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 38.3 m -134.61 126.66 29.65 Favored 'General case' 0 C--O 1.245 0.848 0 O-C-N 123.625 0.578 . . . . 30.640000000000001 111.433 -178.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.7 t -132.26 144.04 38.2 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 C-N-CA 123.899 0.88 . . . . 38.539999999999999 110.381 -178.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.674 ' HE2' ' HB2' ' A' ' 31' ' ' PRO . 0.3 OUTLIER -103.27 121.04 41.89 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 107.461 -1.311 . . . . 66.650000000000006 107.461 -179.803 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 35.6 mt -131.65 155.68 47.17 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.589 1.329 . . . . 36.960000000000001 114.589 -177.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 58.4 tpp -94.44 113.73 25.64 Favored 'General case' 0 N--CA 1.443 -0.804 1 N-CA-C 99.289 -4.337 . . . . 48.880000000000003 99.289 177.6 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -126.22 119.01 26.36 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.462 -1.31 . . . . 38.469999999999999 107.462 -178.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 76.6 mttt 56.95 43.12 25.19 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.994 1.109 . . . . 59.039999999999999 113.994 -179.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.89 23.14 77.1 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 117.161 1.624 . . . . 50.25 117.161 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -155.6 137.44 9.76 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 118.04 0.92 . . . . 74.769999999999996 110.277 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.674 ' HB2' ' HE2' ' A' ' 24' ' ' LYS . 61.6 Cg_endo -67.96 144.48 64.4 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 120.922 1.081 . . . . 44.840000000000003 111.111 179.839 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 18.2 ttt -155.55 144.15 20.38 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.434 -0.803 . . . . 62.409999999999997 109.221 -177.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.8 m -95.51 131.58 41.53 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 107.659 -1.237 . . . . 38.020000000000003 107.659 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -114.95 141.0 48.56 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.584 -0.734 . . . . 31.109999999999999 110.464 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.5 tpt85 -109.11 125.91 52.65 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 101.495 -3.52 . . . . 31.710000000000001 101.495 177.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.93 127.13 30.84 Favored 'General case' 0 C--O 1.238 0.499 0 O-C-N 122.489 -0.132 . . . . 33.450000000000003 110.748 -179.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.8 mt -67.27 145.16 55.44 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 112.784 0.661 . . . . 26.190000000000001 112.784 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 18.9 mt 56.94 20.11 5.08 Favored 'General case' 0 CA--C 1.493 -1.231 0 N-CA-C 120.661 3.578 . . . . 34.369999999999997 120.661 176.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.8 m -130.85 146.8 33.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 C-N-CA 119.695 -0.802 . . . . 34.740000000000002 109.631 178.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -125.81 100.65 6.5 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 107.157 -1.423 . . . . 51.020000000000003 107.157 177.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' THR . . . . . 0.494 HG22 ' HB2' ' A' ' 109' ' ' ALA . 40.5 p -90.61 159.88 40.08 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.516 -0.55 . . . . 44.409999999999997 109.516 179.458 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -72.35 136.54 26.63 Favored 'Trans proline' 0 CA--C 1.55 1.307 0 N-CA-C 107.729 -1.681 . . . . 53.880000000000003 107.729 179.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.422 ' HB2' ' OE2' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -74.4 136.14 42.41 Favored 'General case' 0 CA--C 1.51 -0.562 0 O-C-N 122.29 -0.256 . . . . 72.519999999999996 110.702 -179.927 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . 0.54 ' C ' ' HA ' ' A' ' 51' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--N 1.326 -0.424 0 N-CA-C 109.017 -0.734 . . . . 92.510000000000005 109.017 177.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.54 ' HA ' ' C ' ' A' ' 44' ' ' THR . 78.3 t . . . . . 0 CA--C 1.532 0.255 0 N-CA-C 113.182 0.808 . . . . 101.17 113.182 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.422 ' OE2' ' HB2' ' A' ' 43' ' ' GLU . 34.8 mt-10 -92.0 161.26 14.87 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 107.047 -1.464 . . . . 84.579999999999998 107.047 178.749 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 54' ' ' TYR . 15.8 tptp -58.49 127.16 30.75 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 105.227 -2.138 . . . . 72.890000000000001 105.227 178.597 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.423 ' HB2' ' O ' ' A' ' 53' ' ' LYS . 57.9 m-85 77.0 -3.95 2.43 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 116.269 1.951 . . . . 54.259999999999998 116.269 -178.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -59.67 -49.81 74.57 Favored Glycine 0 C--O 1.221 -0.714 0 C-N-CA 120.013 -1.089 . . . . 42.259999999999998 110.704 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -60.95 -32.96 92.99 Favored 'Trans proline' 0 C--O 1.222 -0.294 0 C-N-CA 122.711 2.274 . . . . 35.5 112.907 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -72.99 -38.3 66.7 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.033 -0.53 . . . . 53.609999999999999 112.223 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.45 -40.49 73.68 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.634 -0.876 . . . . 31.170000000000002 108.634 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.8 m -60.63 -50.24 74.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.348 -0.387 . . . . 36.590000000000003 110.601 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.97 -43.0 95.36 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 115.621 -0.718 . . . . 32.909999999999997 112.69 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.511 ' HA ' ' HE3' ' A' ' 64' ' ' LYS . 51.2 t80 -61.89 -48.49 80.24 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.208 -0.905 . . . . 34.43 110.717 179.813 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 93.3 m -62.06 -46.0 91.04 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 116.539 -0.3 . . . . 30.379999999999999 111.236 179.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.413 ' HE3' ' OE2' ' A' ' 67' ' ' GLU . 83.4 tttt -57.9 -51.4 69.77 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 122.32 1.057 . . . . 54.18 112.13 179.787 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.511 ' HE3' ' HA ' ' A' ' 61' ' ' PHE . 6.2 ttpp -58.7 -45.23 89.97 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 114.265 -1.334 . . . . 55.409999999999997 110.259 -179.608 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 9.9 ttt -60.97 -42.28 98.01 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 113.171 0.804 . . . . 36.119999999999997 113.171 -179.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 m -84.67 -23.94 7.37 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 N-CA-C 115.603 1.705 . . . . 32.719999999999999 115.603 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.413 ' OE2' ' HE3' ' A' ' 63' ' ' LYS . 95.2 mt-10 -76.8 -37.5 55.65 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.172 -1.011 . . . . 53.799999999999997 112.41 179.413 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -82.2 -3.03 54.19 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.562 0.949 . . . . 50.039999999999999 113.562 -179.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -76.79 143.89 39.53 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 112.528 0.566 . . . . 40.850000000000001 112.528 -178.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -87.67 -32.93 18.97 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 106.245 -1.761 . . . . 46.380000000000003 106.245 177.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -132.71 129.84 39.25 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.457 -0.792 . . . . 54.479999999999997 112.378 -179.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 45.3 mm -111.98 138.3 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 N-CA-C 104.155 -2.535 . . . . 32.829999999999998 104.155 176.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -135.15 145.8 48.16 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 107.771 -1.196 . . . . 44.090000000000003 107.771 177.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.2 m -116.76 145.62 22.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 107.498 -1.297 . . . . 35.479999999999997 107.498 177.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -138.33 110.6 7.39 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.456 -0.942 . . . . 32.460000000000001 108.456 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.504 ' HB3' ' HD2' ' A' ' 81' ' ' ARG . 63.4 m-85 -78.05 151.46 33.47 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 119.954 -0.698 . . . . 25.609999999999999 109.232 179.217 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.541 ' HB3' ' OD1' ' A' ' 118' ' ' ASN . 11.0 t0 -91.94 -173.43 3.48 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.779 -1.563 . . . . 28.93 106.779 178.441 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -81.56 -14.81 56.39 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 116.004 1.853 . . . . 57.869999999999997 116.004 -177.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -88.56 -151.32 23.03 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 120.052 -1.071 . . . . 30.75 112.903 179.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.487 ' NE2' ' HG3' ' A' ' 116' ' ' LYS . 26.0 mt-30 -63.28 130.82 46.17 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 122.524 0.33 . . . . 37.969999999999999 111.461 179.559 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.504 ' HD2' ' HB3' ' A' ' 76' ' ' PHE . 15.7 mmt85 -87.5 -6.45 58.37 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 117.971 2.582 . . . . 54.82 117.971 -177.379 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 81.6 p -144.79 153.14 41.33 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.791 -0.818 . . . . 34.869999999999997 108.791 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 54.5 p30 -96.83 -178.54 4.26 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.362 -0.535 . . . . 31.91 111.077 179.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -59.94 -24.06 64.05 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 114.075 1.139 . . . . 58.380000000000003 114.075 -178.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -90.7 5.27 48.82 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.214 0.82 . . . . 45.030000000000001 113.214 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.32 15.1 79.21 Favored Glycine 0 C--O 1.221 -0.717 0 N-CA-C 115.8 1.08 . . . . 30.82 115.8 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -88.49 134.22 33.92 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-N 117.847 0.824 . . . . 34.75 110.538 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -66.04 147.77 50.43 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 107.34 -2.304 . . . . 27.649999999999999 107.34 177.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 68.9 mt -115.4 108.57 16.68 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 106.08 -1.822 . . . . 27.02 106.08 179.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -151.04 174.16 13.49 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 114.255 1.206 . . . . 25.690000000000001 114.255 -178.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -99.14 128.61 45.3 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 100.402 -3.925 . . . . 26.640000000000001 100.402 175.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 27.8 mm -106.07 133.0 51.73 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.751 0 N-CA-C 109.215 -0.661 . . . . 31.0 109.215 -179.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -115.04 134.32 55.28 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 123.61 0.569 . . . . 28.129999999999999 110.522 178.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -117.06 109.45 16.98 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 104.605 -2.369 . . . . 31.710000000000001 104.605 177.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 51.93 46.56 26.38 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-O 121.447 0.641 . . . . 37.149999999999999 110.213 -178.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 82.2 -16.88 20.62 Favored Glycine 0 N--CA 1.442 -0.95 0 N-CA-C 117.617 1.807 . . . . 35.210000000000001 117.617 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -93.48 125.6 38.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 117.92 0.86 . . . . 59.630000000000003 110.839 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.2 ttm -72.02 119.15 15.79 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-O 121.081 0.467 . . . . 28.190000000000001 111.802 -178.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 56.4 t -63.06 -38.63 82.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.606 -0.724 . . . . 31.68 111.604 -179.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -55.26 -51.46 66.56 Favored 'General case' 0 C--O 1.248 1.02 0 CA-C-N 116.24 -0.436 . . . . 26.91 110.131 179.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -67.48 -42.22 83.31 Favored 'General case' 0 C--O 1.236 0.367 0 O-C-N 123.888 0.743 . . . . 35.109999999999999 111.575 -179.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.77 -44.18 77.44 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.391 0.515 . . . . 26.66 112.391 179.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 35.1 mt -63.15 -45.74 90.44 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.911 0.386 . . . . 31.530000000000001 111.213 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 56.0 t -64.1 -46.28 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-N 115.522 -0.763 . . . . 27.300000000000001 110.711 -179.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 44.9 tpt85 -60.35 -31.98 70.84 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 113.119 0.785 . . . . 27.23 113.119 -179.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -86.41 1.67 50.41 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.734 1.214 . . . . 40.649999999999999 113.802 -179.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.99 24.52 76.43 Favored Glycine 0 CA--C 1.52 0.377 0 C-N-CA 120.661 -0.78 . . . . 30.739999999999998 113.693 179.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 81.2 mt -104.87 10.17 34.47 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.164 0.801 . . . . 32.969999999999999 113.164 -179.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.494 ' HB2' HG22 ' A' ' 41' ' ' THR . . . -168.51 162.47 12.16 Favored 'General case' 0 CA--C 1.5 -0.979 0 N-CA-C 107.411 -1.329 . . . . 33.200000000000003 107.411 179.4 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.6 mtpp -113.24 155.66 24.67 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.088 -1.449 . . . . 78.170000000000002 107.088 178.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 82.3 t -75.5 123.18 30.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 105.138 -2.171 . . . . 37.850000000000001 105.138 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -82.48 164.01 21.21 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 117.854 0.297 . . . . 35.640000000000001 111.287 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -65.99 145.1 56.28 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 106.263 -1.754 . . . . 64.870000000000005 106.263 179.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 58.2 t -55.93 145.54 6.12 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.375 0 O-C-N 123.669 0.605 . . . . 43.640000000000001 109.615 177.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -124.73 119.92 30.31 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 121.436 0.636 . . . . 46.689999999999998 109.751 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.487 ' HG3' ' NE2' ' A' ' 80' ' ' GLN . 32.4 mmtm 45.79 41.18 7.3 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 119.181 3.03 . . . . 55.460000000000001 119.181 177.027 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 85.56 10.73 76.14 Favored Glycine 0 C--N 1.336 0.581 0 N-CA-C 117.924 1.93 . . . . 30.949999999999999 117.924 177.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ASN . . . . . 0.541 ' OD1' ' HB3' ' A' ' 77' ' ' ASP . 77.5 m-20 -97.03 86.45 3.98 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 106.376 -1.712 . . . . 29.309999999999999 106.376 179.127 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -136.16 9.07 3.22 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 116.71 2.115 . . . . 49.460000000000001 116.71 -177.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 97.4 m -45.07 -48.31 11.88 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.415 1.265 . . . . 32.840000000000003 114.415 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 44.2 m-70 -99.44 17.0 21.34 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 116.504 2.038 . . . . 30.300000000000001 116.504 -178.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 54.6 tt0 -60.2 -43.04 96.25 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.972 0.73 . . . . 41.329999999999998 112.972 -179.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.441 ' O ' ' HG2' ' A' ' 127' ' ' LYS . 7.0 mm-40 -63.87 -46.12 86.36 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 120.423 -0.511 . . . . 74.060000000000002 112.285 -179.587 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 10.2 tp -54.71 -49.31 71.06 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.957 0.786 . . . . 35.670000000000002 109.913 178.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.5 mp -67.51 -32.04 72.57 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.021 0.748 . . . . 37.32 113.021 -178.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 33.8 mmt180 -66.21 -38.26 87.53 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.008 0.432 . . . . 58.829999999999998 110.206 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.441 ' HG2' ' O ' ' A' ' 123' ' ' GLN . 35.5 mmtp -63.55 -50.81 68.08 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 109.423 -0.584 . . . . 52.630000000000003 109.423 179.104 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 36.2 m -59.35 -39.34 82.89 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 112.695 0.628 . . . . 32.670000000000002 112.695 -179.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -64.8 -37.98 89.43 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 123.577 0.548 . . . . 41.609999999999999 110.724 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.0 -47.87 81.28 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 107.789 -1.189 . . . . 35.649999999999999 107.789 179.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.415 HE22 ' CE ' ' A' ' 134' ' ' LYS . 9.8 tp-100 -62.04 -46.39 89.36 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-N 115.861 -0.609 . . . . 48.119999999999997 111.878 179.198 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.52 -34.07 74.9 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.5 0.667 . . . . 32.299999999999997 110.618 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.573 ' HG3' ' CD2' ' A' ' 140' ' ' TRP . 14.0 ttmt -71.71 -39.9 69.83 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.411 -0.959 . . . . 65.530000000000001 108.411 179.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.415 ' CE ' HE22 ' A' ' 131' ' ' GLN . 21.2 ttpp -64.33 -30.35 71.4 Favored 'General case' 0 C--O 1.22 -0.471 0 O-C-N 123.956 0.785 . . . . 60.789999999999999 110.167 178.216 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -93.45 9.77 35.16 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.039 -0.413 . . . . 32.979999999999997 111.219 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 37.9 mttm 45.74 41.85 7.93 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.807 0.337 . . . . 57.609999999999999 110.856 179.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 7.4 mt -78.77 132.38 36.89 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 114.692 1.367 . . . . 38.509999999999998 114.692 -178.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 38.88 -101.46 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 117.627 2.454 . . . . 46.609999999999999 117.627 177.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 19.8 mt -53.9 -28.37 16.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.165 -0.47 . . . . 49.159999999999997 111.375 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' TRP . . . . . 0.573 ' CD2' ' HG3' ' A' ' 133' ' ' LYS . 57.0 m95 -96.43 13.62 27.23 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.175 1.546 . . . . 52.390000000000001 115.175 -179.325 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 79.5 p . . . . . 0 C--O 1.25 1.116 0 N-CA-C 106.861 -1.533 . . . . 57.219999999999999 106.861 178.167 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_