data_6dm9_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6dm9 _Structure_validation_residue.Date_analyzed 2018-12-14 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 ' 0' ' ' FME . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 16.9 p -74.84 157.28 35.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.266 -1.333 . . . . 76.74 109.508 179.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.7 ttt-85 -57.23 -48.08 79.72 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.527 -0.469 . . . . 83.36 111.03 -178.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . . . -60.04 -32.96 71.39 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.312 -0.555 . . . . 61.14 111.287 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 87.8 mt-10 -69.37 -40.93 77.13 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.315 -0.554 . . . . 83.18 111.11 177.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.58 -42.07 95.85 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.358 -0.537 . . . . 55.58 111.218 -179.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -65.56 -40.54 92.93 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.949 -0.7 . . . . 63.02 111.016 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ARG . . . . . 0.464 ' NH1' ' O ' ' A' ' 102' ' ' HOH . 19.1 tpp180 -61.81 -38.85 89.68 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.221 -0.592 . . . . 107.49 110.796 175.105 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -64.2 -40.66 96.55 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.626 -0.83 . . . . 45.03 110.742 175.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -52.95 -43.55 66.42 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.237 -0.585 . . . . 67.33 110.652 173.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 52.9 mt -64.72 -50.48 75.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-O 121.097 0.475 . . . . 53.56 110.318 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -55.28 -42.37 73.52 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.473 -0.491 . . . . 79.68 111.166 178.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.9 mt -62.4 -43.7 98.2 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.473 -0.491 . . . . 48.97 111.129 179.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.6 -47.26 87.0 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.546 -0.462 . . . . 44.33 110.971 176.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.0 mtmt -60.96 -44.63 97.03 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.104 -0.638 . . . . 89.81 110.984 178.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.4 -41.25 89.02 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.267 -0.573 . . . . 72.51 111.031 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -63.49 -36.87 85.18 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.345 -0.542 . . . . 65.92 111.045 -179.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.1 mt -66.42 -44.24 90.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 120.295 -0.562 . . . . 56.92 110.605 179.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . . . -60.3 -37.86 81.83 Favored 'General case' 0 C--O 1.237 0.42 0 O-C-N 121.863 -0.523 . . . . 49.76 111.058 176.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 10.3 mt -66.69 -46.41 85.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 121.032 0.444 . . . . 52.49 110.442 179.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 33.4 mmt -58.69 -38.7 78.8 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.238 -0.585 . . . . 51.0 111.13 176.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -62.55 -45.67 91.9 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.527 -0.469 . . . . 98.33 111.02 178.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 63.6 tt0 -58.83 -40.07 83.13 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.078 -0.649 . . . . 77.65 110.899 178.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 49.8 mt -63.4 -43.62 98.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 C-N-CA 120.377 -0.529 . . . . 50.44 110.317 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 tp -56.74 -44.45 81.72 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 121.886 -0.509 . . . . 72.38 110.775 177.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -56.08 -47.3 78.26 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.752 -0.379 . . . . 83.55 110.892 173.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 39.4 mt -68.93 -31.21 69.94 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.795 -0.362 . . . . 53.47 111.918 -174.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 31.4 mt -65.02 -44.91 87.63 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.917 -0.713 . . . . 59.36 110.772 175.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . . . -59.26 -40.12 85.04 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.388 -0.525 . . . . 48.17 111.018 177.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -63.46 -34.71 78.35 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 119.869 -0.733 . . . . 76.86 110.808 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 63.0 mtp -63.72 -43.1 97.54 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.17 -0.612 . . . . 57.86 110.916 175.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -62.77 -39.91 95.67 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.414 -0.515 . . . . 59.82 111.176 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -61.97 -42.04 98.69 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.348 -0.541 . . . . 79.14 111.127 177.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 76.4 mt -69.03 -41.54 77.57 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.419 -0.512 . . . . 65.04 111.229 179.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.6 mt -63.46 -38.66 91.99 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.343 -0.543 . . . . 54.83 111.247 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . . . -75.38 -31.64 60.53 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.375 -0.53 . . . . 66.45 111.764 179.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -62.19 -54.72 36.93 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.373 -0.531 . . . . 118.6 110.769 175.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.98 -39.69 78.82 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.399 -0.52 . . . . 57.87 110.866 176.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 51.2 ttt85 -55.54 -52.67 62.94 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.874 0.369 . . . . 113.68 111.095 178.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -65.7 -37.43 93.49 Favored Glycine 0 C--N 1.333 0.41 0 C-N-CA 120.086 -1.054 . . . . 49.52 112.519 179.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.31 -45.49 93.01 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 122.201 -0.588 . . . . 54.43 110.993 -179.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -66.17 -28.55 68.86 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.23 -0.588 . . . . 48.4 111.604 178.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.77 -35.63 60.07 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.505 -0.478 . . . . 68.51 111.537 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -66.45 -43.85 84.41 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.519 -0.473 . . . . 72.38 110.951 173.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.1 t -61.94 -44.35 98.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-O 120.996 0.427 . . . . 58.68 110.445 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.82 -38.57 85.88 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.34 -0.544 . . . . 53.0 111.117 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . . . -64.59 -45.9 84.99 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.683 -0.407 . . . . 54.69 111.036 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 64.3 m -59.48 -42.81 92.94 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.509 -0.476 . . . . 65.61 111.009 178.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 71.7 mt -68.38 -37.16 77.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 120.464 -0.494 . . . . 53.22 110.549 -179.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . . . -59.51 -43.53 93.38 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.34 -0.544 . . . . 53.64 111.305 -179.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -74.53 -36.82 63.17 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.28 -0.568 . . . . 96.24 111.107 179.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 24.6 mt -60.73 -37.77 82.87 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.03 -0.668 . . . . 61.88 110.874 176.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 87.0 mt -70.07 -28.64 65.61 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.005 -0.678 . . . . 57.19 111.554 175.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . . . -72.54 -50.74 23.61 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.603 -0.439 . . . . 68.65 110.923 177.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 65.9 mtp180 -46.98 -47.21 21.95 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.168 0.509 . . . . 104.97 110.443 169.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.2 tp -61.85 -43.91 97.9 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 116.476 -0.329 . . . . 85.04 111.43 -176.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 36.4 mttt -63.56 -44.02 95.36 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.281 -0.568 . . . . 125.98 111.466 -177.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -66.08 -34.24 77.61 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.567 -0.853 . . . . 82.28 111.248 -179.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 97.1 mt -62.58 -39.38 84.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 C-N-CA 120.294 -0.562 . . . . 77.34 110.194 175.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 95.3 mt -66.41 -52.82 42.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 O-C-N 121.946 -0.471 . . . . 72.65 110.45 -177.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -51.63 -42.75 62.25 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.472 -0.491 . . . . 86.62 111.038 178.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . . . -63.79 -38.22 90.28 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.089 -0.644 . . . . 62.0 110.85 175.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -56.82 -47.3 80.61 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.632 -0.427 . . . . 81.4 110.818 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -70.51 -26.54 63.64 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.185 -0.606 . . . . 75.21 111.832 -177.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 65.7 mtm-85 -61.41 -45.48 94.15 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.372 -0.531 . . . . 79.9 110.723 169.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 89.7 mt -64.52 -43.75 96.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.021 0.438 . . . . 82.75 110.524 179.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.0 -43.76 98.17 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.911 -0.493 . . . . 64.06 111.396 -177.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . . . -67.94 -28.55 67.57 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.015 -0.674 . . . . 71.5 111.241 178.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -72.47 -42.61 64.74 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.337 -0.545 . . . . 95.06 110.893 174.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 10.7 m-70 -49.15 -52.82 24.09 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.45 -0.5 . . . . 76.19 110.556 170.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -54.67 -45.74 73.94 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 122.213 -0.304 . . . . 109.46 111.166 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -60.95 -35.13 75.94 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.406 -0.517 . . . . 149.77 111.278 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 85.0 mt -71.31 -49.45 47.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 CA-C-O 120.964 0.412 . . . . 81.26 110.559 -179.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.26 -39.38 69.72 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 122.031 -0.418 . . . . 73.1 111.127 179.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -61.93 -45.22 94.66 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.561 -0.456 . . . . 110.89 110.674 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . . . -64.25 -42.32 96.55 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.855 -0.338 . . . . 95.04 111.532 -176.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ARG . . . . . 0.729 ' NH2' ' OE2' ' B' ' 79' ' ' GLU . 33.0 mtp-105 -70.16 -5.75 29.4 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.12 0.785 . . . . 90.75 113.12 -178.05 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.6 p . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 118.768 0.713 . . . . 96.68 110.465 178.233 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' THR . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.127 0 CA-C-O 120.916 0.389 . . . . 93.94 110.934 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' GLU . . . . . 0.729 ' OE2' ' NH2' ' A' ' 76' ' ' ARG . 11.4 tp10 -72.15 -39.23 68.91 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.916 -0.584 . . . . 92.29 111.549 -178.938 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . . . -68.55 -37.96 80.39 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.653 -0.419 . . . . 108.28 111.748 -174.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . . . -68.78 -49.04 61.91 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.449 -0.501 . . . . 95.91 111.079 -179.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 6.8 mt -60.2 -38.28 82.81 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.429 -0.508 . . . . 90.77 111.275 178.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 14.1 tp -68.79 -33.79 74.47 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.202 -0.599 . . . . 89.07 111.51 -177.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . . . -74.14 -33.17 63.44 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.115 -0.634 . . . . 74.73 111.086 173.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ARG . . . . . . . . . . . . . . . -56.52 -51.92 66.73 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.953 0.406 . . . . 100.98 110.377 170.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 28.3 t -63.07 -40.55 98.0 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.79 -0.364 . . . . 66.22 111.238 178.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . . . -63.99 -37.64 88.16 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.286 -0.565 . . . . 74.87 111.166 -179.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . . . -66.88 -33.1 74.86 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.301 -0.56 . . . . 71.37 111.302 177.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 90.1 mt -72.87 -36.06 67.32 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.433 -0.507 . . . . 74.37 111.333 -178.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -63.16 -33.81 76.26 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.035 -0.666 . . . . 65.62 111.269 176.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -65.26 -39.26 92.42 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.186 -0.605 . . . . 85.71 110.938 174.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -66.09 -47.36 74.47 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.919 -0.312 . . . . 98.56 111.067 177.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' SER . . . . . . . . . . . . . 4.8 m -58.3 -44.02 88.36 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.622 -0.431 . . . . 66.2 111.441 -179.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -59.69 -43.11 94.19 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.318 -0.553 . . . . 98.9 111.058 -178.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' ARG . . . . . . . . . . . . . 30.6 mtp85 -64.26 -36.48 84.23 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.166 -0.614 . . . . 99.49 111.039 177.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 34.1 mt -70.03 -46.36 65.22 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.239 -0.585 . . . . 64.01 110.961 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.76 -41.12 94.83 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.239 -0.584 . . . . 80.05 111.124 -179.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -63.27 -39.64 95.14 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.11 -0.636 . . . . 72.58 111.003 175.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -63.7 -44.4 93.79 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.269 -0.572 . . . . 81.2 110.851 178.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 86.6 mtp -57.57 -43.7 84.74 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.327 -0.549 . . . . 64.44 111.039 176.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.24 -46.27 88.94 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.553 -0.459 . . . . 47.68 111.13 -177.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' GLU . . . . . 0.611 ' OE1' ' NH2' ' B' ' 105' ' ' ARG . 24.4 tp10 -64.13 -37.4 87.33 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.384 -0.526 . . . . 86.46 111.021 -178.548 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 39.3 mt -61.85 -43.27 97.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 C-N-CA 120.628 -0.429 . . . . 66.68 110.443 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 82.6 mmm -65.03 -39.01 92.74 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.309 -0.556 . . . . 52.27 111.138 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' ARG . . . . . 0.611 ' NH2' ' OE1' ' B' ' 102' ' ' GLU . 88.9 mtm-85 -66.51 -36.11 81.9 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 119.961 -0.696 . . . . 111.78 110.968 176.249 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . . . -70.79 -43.06 69.48 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.308 -0.557 . . . . 93.12 111.073 177.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 39.8 mt -56.25 -51.35 64.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 CA-C-O 121.247 0.546 . . . . 49.25 110.155 174.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' LYS . . . . . 0.594 ' O ' ' O ' ' B' ' 301' ' ' HOH . 3.9 ttmt -54.32 -37.67 65.12 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 122.039 -0.413 . . . . 74.66 111.439 -179.616 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' LYS . . . . . . . . . . . . . 75.1 mttt -74.91 -40.5 60.84 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.522 -0.471 . . . . 76.93 111.303 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 23.2 mt -58.25 -40.93 83.06 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.214 -0.594 . . . . 62.0 111.022 177.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 67.2 mt -66.89 -42.38 85.6 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.263 -0.575 . . . . 58.24 111.269 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . . . -63.54 -41.78 98.44 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.1 -0.64 . . . . 57.74 110.971 177.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . . . -65.69 -40.79 92.67 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.472 -0.491 . . . . 59.59 111.25 178.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.33 -42.77 96.13 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.487 -0.485 . . . . 58.61 111.13 178.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' ARG . . . . . 0.778 ' NH2' ' OE1' ' D' ' 119' ' ' GLU . 28.7 ttt85 -59.78 -44.22 94.01 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.545 -0.462 . . . . 125.88 110.991 176.653 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . -59.4 -43.28 97.53 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 120.053 -1.07 . . . . 49.52 112.516 176.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' ALA . . . . . . . . . . . . . . . -67.4 -39.64 85.57 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 122.236 -0.567 . . . . 68.48 111.31 -178.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -67.35 -43.24 82.0 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.881 -0.728 . . . . 62.59 111.143 177.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . . . -57.63 -37.06 72.68 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.041 -0.664 . . . . 65.9 110.929 176.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 22.3 tptt -62.56 -48.0 81.4 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.817 0.341 . . . . 86.58 110.914 177.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 2.7 t -62.03 -45.94 97.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 121.018 0.437 . . . . 55.87 110.516 179.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 mt -63.45 -33.91 76.6 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.817 -0.552 . . . . 77.53 111.657 178.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -58.99 -46.27 88.57 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.409 -0.516 . . . . 66.56 110.776 172.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -70.82 -43.54 68.38 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.568 -0.453 . . . . 79.33 111.459 -178.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 47.2 mt -55.32 -40.43 71.14 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.341 -0.544 . . . . 57.3 111.041 174.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' ARG . . . . . . . . . . . . . 3.0 tmm_? -61.12 -41.06 96.01 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.973 -0.291 . . . . 161.5 111.144 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . . . -70.99 -39.0 72.73 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.459 -0.496 . . . . 61.15 111.235 -179.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' ILE . . . . . . . . . . . . . 96.4 mt -59.94 -37.04 70.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 120.952 0.406 . . . . 58.02 110.419 178.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' ILE . . . . . . . . . . . . . 34.0 mt -72.48 -36.87 55.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 C-N-CA 120.351 -0.54 . . . . 49.19 110.737 -176.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -69.99 -27.46 64.72 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.538 -0.865 . . . . 76.0 111.407 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -68.47 -46.72 69.01 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.468 -0.493 . . . . 80.74 110.433 170.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' ILE . . . . . . . . . . . . . 74.1 mt -56.06 -49.53 75.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-O 121.14 0.495 . . . . 41.16 110.28 177.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' ARG . . . . . . . . . . . . . 64.0 mtp180 -64.19 -35.77 81.88 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.182 -0.607 . . . . 78.25 111.457 -177.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -63.9 -37.21 86.54 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 119.814 -0.754 . . . . 60.61 110.841 173.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' LEU . . . . . . . . . . . . . 39.7 mt -65.35 -27.75 68.81 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.303 -0.559 . . . . 59.21 111.355 176.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 74.9 mt -79.3 -25.0 42.49 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.153 0.427 . . . . 49.29 112.153 175.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -61.02 -48.86 79.85 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.059 -0.656 . . . . 69.58 110.354 169.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 11.6 tpt180 -64.89 -40.66 95.46 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.077 -0.649 . . . . 95.12 110.942 177.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 32.9 t -55.94 -44.68 78.64 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.222 -0.591 . . . . 55.57 110.936 176.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 85.4 mtt-85 -64.25 -38.89 92.66 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.233 -0.587 . . . . 94.17 111.107 176.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 30.8 mmtt -61.31 -42.93 99.49 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.303 -0.559 . . . . 73.3 110.866 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 71.2 mt -61.75 -50.04 81.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 121.085 0.469 . . . . 55.48 110.167 178.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' HIS . . . . . 0.508 ' ND1' ' OE1' ' D' ' 90' ' ' GLN . 47.9 t60 -56.09 -48.66 75.72 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.401 -0.52 . . . . 93.3 110.869 175.514 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -55.38 -43.43 75.15 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.797 -0.361 . . . . 75.74 111.118 178.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -67.34 -36.76 82.06 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 120.407 -0.517 . . . . 53.61 111.069 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' SER . . . . . . . . . . . . . 4.4 m -62.39 -42.4 99.4 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.389 -0.524 . . . . 62.63 111.298 179.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.21 -41.06 98.04 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.959 -0.697 . . . . 72.92 110.853 177.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -50.42 -53.01 32.66 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.014 0.435 . . . . 81.46 111.003 174.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' ILE . . . . . . . . . . . . . 78.0 mt -61.37 -35.76 68.52 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-O 120.844 0.354 . . . . 63.72 110.717 -175.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -73.04 -32.26 64.95 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.444 -0.502 . . . . 77.75 111.79 -179.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' TYR . . . . . . . . . . . . . . . -58.59 -48.07 82.19 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.447 -0.501 . . . . 102.05 110.896 178.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.276 0 O-C-N 122.149 -0.344 . . . . 108.0 110.745 178.381 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 0' ' ' FME . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' THR . . . . . . . . . . . . . 19.9 p -75.39 164.08 26.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.392 -1.277 . . . . 78.71 110.814 -179.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' ARG . . . . . . . . . . . . . 53.7 ttt85 -53.39 -46.35 69.64 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.097 -0.501 . . . . 70.25 110.803 175.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' GLU . . . . . . . . . . . . . 48.2 tt0 -57.93 -36.49 72.57 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.606 -0.438 . . . . 85.91 111.233 -179.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -72.96 -40.55 65.25 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.506 -0.478 . . . . 77.32 111.372 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' LEU . . . . . . . . . . . . . 1.6 mt -62.97 -40.48 97.84 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.562 -0.455 . . . . 57.91 111.254 179.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' LEU . . . . . . . . . . . . . 87.4 mt -66.29 -38.05 86.87 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.012 -0.675 . . . . 82.11 111.152 178.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' ARG . . . . . . . . . . . . . . . -62.23 -37.63 86.14 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.125 -0.63 . . . . 74.47 110.69 174.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -67.59 -39.29 84.83 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.714 -0.394 . . . . 64.88 111.079 178.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -56.56 -45.87 81.04 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.477 -0.489 . . . . 70.29 110.865 175.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' ILE . . . . . . . . . . . . . 69.5 mt -60.19 -49.23 84.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 CA-C-O 121.255 0.55 . . . . 64.5 110.254 177.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . . . -60.22 -46.05 91.09 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.946 -0.471 . . . . 89.63 111.155 -178.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' LEU . . . . . . . . . . . . . 14.9 mt -60.27 -39.76 87.95 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.082 -0.647 . . . . 58.47 111.022 178.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.55 96.17 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.448 -0.501 . . . . 52.95 111.199 179.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -66.07 -50.79 62.9 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.221 -0.592 . . . . 96.66 110.951 176.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 63.4 tt0 -54.33 -40.57 68.13 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.497 -0.481 . . . . 63.57 110.931 176.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -58.84 -44.37 90.93 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.708 -0.397 . . . . 70.57 110.984 175.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' ILE . . . . . . . . . . . . . 12.0 mt -64.58 -48.44 84.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-O 121.112 0.482 . . . . 65.79 110.383 -179.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 30.2 tp10 -60.23 -38.22 82.74 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 121.863 -0.523 . . . . 95.27 111.108 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' ILE . . . . . . . . . . . . . 26.4 mt -59.2 -54.24 36.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-O 121.232 0.539 . . . . 60.52 110.123 175.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' MET . . . . . . . . . . . . . 35.6 mmt -56.01 -38.42 70.47 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 122.07 -0.394 . . . . 73.69 111.334 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . . . -61.1 -42.03 97.78 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.202 -0.599 . . . . 61.89 110.99 176.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -67.32 -38.54 85.1 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.102 -0.639 . . . . 84.34 111.099 179.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' ILE . . . . . . . . . . . . . 40.3 mt -58.48 -57.32 11.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 C-N-CA 120.411 -0.516 . . . . 57.95 109.946 176.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' LEU . . . . . . . . . . . . . . . -50.39 -41.15 51.62 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 122.127 -0.358 . . . . 67.45 111.206 179.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -62.41 -40.27 95.99 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.344 -0.543 . . . . 70.5 110.99 174.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 10.3 mt -72.04 -26.4 62.18 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.425 -0.51 . . . . 66.35 111.524 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' LEU . . . . . . . . . . . . . 62.3 mt -74.4 -29.91 61.73 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.454 -0.498 . . . . 52.94 111.224 175.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -56.81 -51.8 67.54 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.597 -0.441 . . . . 83.18 110.751 170.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' LYS . . . . . . . . . . . . . . . -60.11 -39.27 85.6 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.775 -0.37 . . . . 58.15 111.275 -177.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' MET . . . . . . . . . . . . . 84.0 mtp -57.83 -42.54 84.58 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.055 -0.658 . . . . 55.85 110.963 176.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.21 -45.81 83.25 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.687 -0.405 . . . . 72.33 110.97 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -62.74 -38.77 91.82 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.453 -0.499 . . . . 80.56 111.248 -178.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' LEU . . . . . . . . . . . . . 40.1 mt -68.66 -42.85 77.32 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.052 -0.659 . . . . 61.75 111.156 176.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 55.0 mt -61.9 -38.67 89.25 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.164 -0.615 . . . . 58.68 111.018 175.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -64.5 -46.89 81.02 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.541 -0.464 . . . . 72.25 110.988 177.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' LYS . . . . . . . . . . . . . 24.5 ttpt -59.57 -55.94 28.16 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.54 -0.464 . . . . 85.2 111.038 179.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' ALA . . . . . . . . . . . . . . . -53.76 -38.7 64.68 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.467 -0.493 . . . . 53.98 111.271 -179.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' ARG . . . . . . . . . . . . . 40.6 ttp85 -62.17 -39.41 92.57 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 120.092 -0.643 . . . . 85.06 110.894 174.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' GLY . . . . . . . . . . . . . . . -71.01 -41.43 61.05 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.127 -1.035 . . . . 55.5 112.597 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.68 -41.55 97.72 Favored 'General case' 0 C--O 1.237 0.409 0 O-C-N 122.171 -0.605 . . . . 49.64 111.033 178.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -70.05 -28.01 65.11 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.218 -0.593 . . . . 52.11 111.596 178.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -69.62 -39.5 77.16 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.106 -0.637 . . . . 75.34 110.921 175.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -59.87 -56.23 24.33 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.195 0.521 . . . . 69.54 110.835 175.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' VAL . . . . . . . . . . . . . 79.6 t -58.81 -42.39 85.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 C-N-CA 120.741 -0.384 . . . . 61.87 110.601 -176.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.69 -49.3 78.09 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 120.044 -0.663 . . . . 50.47 110.764 178.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -59.22 -46.05 89.48 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.412 -0.515 . . . . 91.98 110.829 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' THR . . . . . . . . . . . . . 92.5 m -58.19 -41.91 84.97 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.728 -0.389 . . . . 68.98 111.25 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' ILE . . . . . . . . . . . . . 35.9 mt -65.51 -39.38 84.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 120.496 -0.482 . . . . 58.43 110.796 -178.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -59.38 -41.67 89.9 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.749 -0.78 . . . . 89.23 110.755 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -59.95 -39.46 85.67 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.498 -0.481 . . . . 80.65 111.065 176.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 83.5 mt -69.41 -49.03 58.98 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.391 -0.524 . . . . 53.34 111.06 178.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 80.4 mt -59.11 -39.88 83.66 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.252 -0.579 . . . . 53.4 110.963 175.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' ARG . . . . . . . . . . . . . 18.1 ttp85 -58.32 -48.56 80.15 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.332 -0.547 . . . . 84.21 110.678 176.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -61.77 -36.91 82.41 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.712 -0.395 . . . . 106.35 111.069 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' LEU . . . . . . . . . . . . . 13.6 mt -61.7 -51.55 67.91 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.374 -0.53 . . . . 58.99 111.171 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -53.57 -40.56 65.72 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.442 -0.503 . . . . 59.32 110.975 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' GLU . . . . . . . . . . . . . 62.7 tt0 -61.5 -42.13 98.34 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.803 -0.359 . . . . 67.82 111.145 176.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' ILE . . . . . . . . . . . . . 58.0 mt -65.93 -45.06 92.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-O 121.04 0.447 . . . . 66.93 110.578 178.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' ILE . . . . . . . . . . . . . 53.1 mt -61.58 -40.27 85.99 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 O-C-N 121.929 -0.482 . . . . 60.0 110.7 -174.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 36.3 tp10 -59.93 -36.35 76.86 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.065 -0.654 . . . . 93.02 110.985 178.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' ARG . . . . . . . . . . . . . 29.6 tpt180 -67.83 -45.04 75.81 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.482 -0.487 . . . . 74.39 111.087 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -58.69 -41.55 86.51 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.221 -0.591 . . . . 63.5 111.396 -179.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -67.71 -32.15 72.59 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 119.704 -0.798 . . . . 95.4 111.462 178.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 28.9 mtp180 -64.56 -36.63 84.83 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.13 -0.628 . . . . 102.79 110.773 169.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' ILE . . . . . . . . . . . . . 4.3 mt -72.74 -47.4 50.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 C-N-CA 120.669 -0.412 . . . . 62.97 110.419 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.0 -40.22 76.17 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.223 -0.591 . . . . 63.18 111.034 177.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 67' ' ' LYS . . . . . . . . . . . . . . . -59.79 -43.38 94.44 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.257 -0.577 . . . . 74.12 111.073 176.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 68' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -62.51 -41.87 99.13 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.138 -0.625 . . . . 70.91 110.95 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 69' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -59.18 -44.57 92.17 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.423 -0.511 . . . . 55.05 110.877 177.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -51.0 -50.98 57.46 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.268 -0.573 . . . . 65.72 110.354 170.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 71' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -59.19 -49.12 79.08 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.878 -0.329 . . . . 108.72 111.25 -177.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 54.3 mt -62.22 -47.15 94.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.236 -0.586 . . . . 76.57 110.518 -176.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.95 -39.07 71.21 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.427 -0.509 . . . . 72.59 111.226 -179.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 74' ' ' ARG . . . . . . . . . . . . . 24.1 mtt-85 -72.99 -30.08 63.53 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.353 -0.539 . . . . 82.62 111.552 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 75' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -76.48 -28.0 56.32 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 112.065 0.394 . . . . 90.47 112.065 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 76' ' ' ARG . . . . . . . . . . . . . 63.6 mtp180 -80.28 -29.81 38.27 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 112.549 0.574 . . . . 79.39 112.549 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 77' ' ' SER . . . . . . . . . . . . . 57.1 p . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 118.107 0.412 . . . . 88.18 111.376 -175.785 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 78' ' ' THR . . . . . . . . . . . . . 13.9 p . . . . . 0 C--O 1.232 0.134 0 N-CA-C 111.737 0.273 . . . . 90.27 111.737 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 79' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -65.21 -48.76 72.24 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.496 -0.481 . . . . 96.44 110.991 178.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 80' ' ' ARG . . . . . . . . . . . . . . . -64.73 -38.76 92.09 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.47 -0.492 . . . . 85.62 111.207 178.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 81' ' ' LYS . . . . . . . . . . . . . . . -60.23 -56.26 23.66 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.025 0.44 . . . . 73.45 110.77 179.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 82' ' ' LEU . . . . . . . . . . . . . 46.0 mt -57.7 -42.21 83.26 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.405 -0.518 . . . . 70.04 111.139 177.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 83' ' ' LEU . . . . . . . . . . . . . 21.3 tp -66.14 -39.4 89.83 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.65 -0.42 . . . . 65.7 111.269 -178.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 84' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -67.11 -38.04 84.95 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.482 -0.487 . . . . 80.64 111.116 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 85' ' ' ARG . . . . . . . . . . . . . . . -64.35 -40.28 95.55 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.328 -0.549 . . . . 87.72 110.994 179.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 3.7 p -65.23 -40.97 94.79 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.096 -0.641 . . . . 73.12 111.063 179.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 87' ' ' ARG . . . . . . . . . . . . . 65.1 mtt85 -59.59 -41.79 91.08 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 120.087 -0.645 . . . . 87.91 110.935 177.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 88' ' ' ARG . . . . . . . . . . . . . . . -56.58 -46.87 80.57 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.603 -0.439 . . . . 73.89 110.901 176.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 66.1 mt -68.34 -34.93 77.0 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.224 -0.59 . . . . 62.55 111.769 -176.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 90' ' ' GLN . . . . . 0.508 ' OE1' ' ND1' ' B' ' 143' ' ' HIS . 39.6 mm-40 -60.13 -47.92 83.87 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.883 -0.727 . . . . 80.94 110.607 173.896 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 91' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -56.48 -41.28 76.31 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.261 -0.575 . . . . 73.54 111.103 177.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 92' ' ' GLU . . . . . . . . . . . . . 68.9 tt0 -63.15 -44.38 95.66 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.052 -0.659 . . . . 76.68 110.831 175.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 93' ' ' SER . . . . . . . . . . . . . 4.1 m -56.69 -46.87 80.93 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.647 -0.421 . . . . 63.76 111.018 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 94' ' ' LYS . . . . . . . . . . . . . . . -53.69 -49.58 67.71 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.387 -0.525 . . . . 62.83 110.718 179.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 95' ' ' ARG . . . . . . . . . . . . . . . -57.24 -40.29 77.29 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.509 -0.477 . . . . 64.07 111.211 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 90.5 mt -72.04 -43.57 64.76 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.237 -0.585 . . . . 63.98 111.232 -177.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 97' ' ' LEU . . . . . . . . . . . . . 77.5 mt -57.3 -41.11 79.2 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 119.851 -0.74 . . . . 59.15 110.677 175.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 98' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -58.08 -49.47 76.79 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.789 -0.364 . . . . 64.54 111.096 176.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 99' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -64.26 -31.34 72.5 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 119.699 -0.8 . . . . 64.55 111.471 -178.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 100' ' ' MET . . . . . . . . . . . . . 46.6 mtp -67.67 -48.29 67.05 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.116 -0.634 . . . . 53.33 110.868 176.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.27 -36.67 78.34 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.44 -0.504 . . . . 59.01 111.06 178.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 49.9 tt0 -69.82 -32.26 70.6 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.667 -0.413 . . . . 82.34 111.357 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 103' ' ' ILE . . . . . . . . . . . . . 22.8 mt -74.38 -38.25 46.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 120.294 -0.562 . . . . 48.57 110.618 179.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 104' ' ' MET . . . . . . . . . . . . . 83.4 mmm -65.08 -46.46 81.03 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.171 -0.611 . . . . 50.27 110.842 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 105' ' ' ARG . . . . . . . . . . . . . . . -58.71 -33.11 69.83 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.443 -0.503 . . . . 53.39 111.313 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 106' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -72.05 -43.47 64.88 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.103 -0.639 . . . . 79.25 111.061 179.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 107' ' ' ILE . . . . . . . . . . . . . 54.7 mt -57.16 -41.33 77.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 120.347 -0.541 . . . . 60.54 110.237 177.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 108' ' ' LYS . . . . . . . . . . . . . 27.0 mtpt -55.45 -51.74 65.92 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 121.959 -0.463 . . . . 76.69 110.956 172.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 109' ' ' LYS . . . . . . . . . . . . . . . -57.48 -39.42 76.35 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.577 -0.449 . . . . 51.31 111.233 -179.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 110' ' ' LEU . . . . . . . . . . . . . 35.0 mt -68.26 -41.4 81.16 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.027 -0.669 . . . . 85.41 111.384 -179.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 111' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.72 -42.49 95.2 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.386 -0.526 . . . . 54.46 111.212 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 112' ' ' LYS . . . . . . . . . . . . . . . -60.24 -43.44 96.08 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.185 -0.606 . . . . 56.42 110.881 175.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 113' ' ' LYS . . . . . . . . . . . . . 42.5 tttt -59.7 -54.74 42.88 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.84 0.352 . . . . 67.71 110.948 179.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 114' ' ' ALA . . . . . . . . . . . . . . . -57.02 -41.8 79.2 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.634 -0.426 . . . . 57.75 111.209 -178.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 115' ' ' ARG . . . . . . . . . . . . . 48.9 ttt180 -62.43 -46.08 90.2 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.365 -0.534 . . . . 119.52 110.91 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 116' ' ' GLY . . . . . . . . . . . . . . . -58.5 -43.83 95.74 Favored Glycine 0 C--N 1.334 0.424 0 C-N-CA 119.895 -1.145 . . . . 50.84 112.448 177.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 117' ' ' ALA . . . . . . . . . . . . . . . -64.77 -38.45 91.01 Favored 'General case' 0 C--O 1.238 0.455 0 O-C-N 122.233 -0.569 . . . . 49.6 111.238 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 118' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -66.05 -35.29 80.14 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.18 -0.608 . . . . 63.98 111.185 176.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 119' ' ' GLU . . . . . 0.778 ' OE1' ' NH2' ' B' ' 115' ' ' ARG . 25.9 mm-40 -64.44 -39.45 93.85 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.487 -0.485 . . . . 91.95 111.094 177.371 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 120' ' ' LYS . . . . . . . . . . . . . . . -64.79 -43.07 94.41 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.553 -0.459 . . . . 62.6 111.005 176.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 121' ' ' VAL . . . . . . . . . . . . . 40.6 t -62.09 -41.16 90.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 C-N-CA 120.375 -0.53 . . . . 61.5 110.421 177.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 122' ' ' LEU . . . . . . . . . . . . . 9.9 mt -65.91 -44.14 86.1 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 121.91 -0.494 . . . . 60.28 111.333 178.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 123' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -57.03 -48.44 78.5 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.599 -0.44 . . . . 74.84 110.922 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 124' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -57.62 -54.08 50.9 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.322 -0.551 . . . . 83.17 110.63 176.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 125' ' ' LEU . . . . . . . . . . . . . 30.6 mt -48.4 -43.83 34.4 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 122.204 -0.31 . . . . 52.16 111.697 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 126' ' ' ARG . . . . . . . . . . . . . 23.9 ttp-105 -58.79 -47.39 84.92 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 120.014 -0.674 . . . . 80.14 110.725 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 127' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -64.09 -38.11 89.86 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.189 -0.604 . . . . 90.2 111.288 -178.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 128' ' ' ILE . . . . . . . . . . . . . 7.2 mt -64.13 -41.84 93.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 C-N-CA 120.174 -0.61 . . . . 54.73 110.191 177.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 129' ' ' ILE . . . . . . . . . . . . . 37.3 mt -62.68 -36.4 75.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 C-N-CA 120.43 -0.508 . . . . 51.85 110.515 -178.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 130' ' ' GLU . . . . . 0.495 ' OE2' ' NZ ' ' B' ' 108' ' ' LYS . 67.7 mm-40 -77.6 -31.68 53.1 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.034 -0.666 . . . . 83.95 112.094 -177.391 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 131' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -65.73 -41.39 92.26 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.771 -0.772 . . . . 89.27 110.465 169.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 132' ' ' ILE . . . . . . . . . . . . . 44.5 mt -58.49 -55.71 20.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-O 121.343 0.592 . . . . 45.65 110.091 174.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 133' ' ' ARG . . . . . . . . . . . . . 44.5 mtp180 -62.44 -30.52 71.29 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.197 -0.601 . . . . 103.19 111.523 -177.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 134' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -62.91 -37.85 88.64 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.016 -0.674 . . . . 72.09 110.603 170.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 135' ' ' LEU . . . . . . . . . . . . . 85.1 mt -68.87 -35.49 76.95 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.42 -0.512 . . . . 58.44 110.996 177.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 136' ' ' LEU . . . . . . . . . . . . . 87.0 mt -68.07 -27.35 66.43 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.828 -0.749 . . . . 50.3 111.432 175.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 137' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -66.48 -48.16 70.74 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.439 -0.504 . . . . 79.42 110.706 173.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 138' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -62.54 -42.5 99.57 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.121 -0.632 . . . . 73.64 110.854 177.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 139' ' ' SER . . . . . . . . . . . . . 27.3 t -57.13 -40.25 76.74 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.136 -0.626 . . . . 51.51 111.021 176.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 140' ' ' ARG . . . . . . . . . . . . . . . -65.09 -32.98 74.96 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.224 -0.59 . . . . 63.53 111.544 177.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 141' ' ' LYS . . . . . . . . . . . . . 20.1 mmtt -68.67 -43.78 75.42 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.082 -0.647 . . . . 86.39 110.928 175.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 142' ' ' ILE . . . . . . . . . . . . . 93.3 mt -56.28 -48.17 79.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 120.341 -0.543 . . . . 59.16 110.156 178.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 143' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -64.04 -40.19 95.74 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.621 -0.832 . . . . 81.31 111.091 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 144' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -58.9 -50.65 73.23 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.405 -0.518 . . . . 89.57 110.657 176.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 145' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -58.92 -41.46 87.34 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.716 -0.394 . . . . 61.6 111.058 176.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 146' ' ' SER . . . . . . . . . . . . . 5.7 m -62.83 -36.82 84.44 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.257 -0.577 . . . . 71.89 111.075 177.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 147' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -65.48 -37.8 87.9 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.302 -0.559 . . . . 74.03 110.926 175.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 148' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -62.27 -47.17 85.54 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 120.843 0.354 . . . . 78.94 111.43 179.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 149' ' ' ILE . . . . . . . . . . . . . 41.6 mt -57.53 -23.63 20.24 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 111.64 0.237 . . . . 76.72 111.64 -169.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 150' ' ' ALA . . . . . . . . . . . . . . . -102.76 13.89 33.31 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.966 0.728 . . . . 114.85 112.966 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 151' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 118.368 0.531 . . . . 119.18 111.123 178.909 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . 0.464 ' O ' ' NH1' ' A' ' 7' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' HOH . . . . . 0.594 ' O ' ' O ' ' B' ' 108' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' FME . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 16.9 p -74.84 157.28 35.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.266 -1.333 . . . . 63.95 109.508 179.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.7 ttt-85 -57.23 -48.08 79.72 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.527 -0.469 . . . . 69.46 111.03 -178.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . . . -60.04 -32.96 71.39 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.312 -0.555 . . . . 52.78 111.287 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 87.8 mt-10 -69.37 -40.93 77.13 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.315 -0.554 . . . . 77.14 111.11 177.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.58 -42.07 95.85 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.358 -0.537 . . . . 46.32 111.218 -179.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -65.56 -40.54 92.93 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.949 -0.7 . . . . 52.52 111.016 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ARG . . . . . 0.464 ' NH1' ' O ' ' A' ' 102' ' ' HOH . 19.1 tpp180 -61.81 -38.85 89.68 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.221 -0.592 . . . . 89.57 110.796 175.105 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -64.2 -40.66 96.55 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.626 -0.83 . . . . 41.37 110.742 175.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -52.95 -43.55 66.42 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.237 -0.585 . . . . 56.11 110.652 173.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 52.9 mt -64.72 -50.48 75.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-O 121.097 0.475 . . . . 44.63 110.318 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -55.28 -42.37 73.52 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.473 -0.491 . . . . 79.68 111.166 178.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.9 mt -62.4 -43.7 98.2 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.473 -0.491 . . . . 40.81 111.129 179.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.6 -47.26 87.0 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.546 -0.462 . . . . 36.94 110.971 176.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.0 mtmt -60.96 -44.63 97.03 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.104 -0.638 . . . . 74.84 110.984 178.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.4 -41.25 89.02 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.267 -0.573 . . . . 67.53 111.031 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -63.49 -36.87 85.18 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.345 -0.542 . . . . 54.94 111.045 -179.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.1 mt -66.42 -44.24 90.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 120.295 -0.562 . . . . 47.43 110.605 179.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . . . -60.3 -37.86 81.83 Favored 'General case' 0 C--O 1.237 0.42 0 O-C-N 121.863 -0.523 . . . . 41.86 111.058 176.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 10.3 mt -66.69 -46.41 85.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 121.032 0.444 . . . . 43.74 110.442 179.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 33.4 mmt -58.69 -38.7 78.8 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.238 -0.585 . . . . 46.5 111.13 176.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -62.55 -45.67 91.9 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.527 -0.469 . . . . 81.95 111.02 178.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 63.6 tt0 -58.83 -40.07 83.13 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.078 -0.649 . . . . 73.25 110.899 178.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 49.8 mt -63.4 -43.62 98.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 C-N-CA 120.377 -0.529 . . . . 46.82 110.317 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 tp -56.74 -44.45 81.72 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 121.886 -0.509 . . . . 60.32 110.775 177.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -56.08 -47.3 78.26 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.752 -0.379 . . . . 79.22 110.892 173.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 39.4 mt -68.93 -31.21 69.94 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.795 -0.362 . . . . 44.56 111.918 -174.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 31.4 mt -65.02 -44.91 87.63 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.917 -0.713 . . . . 49.47 110.772 175.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . . . -59.26 -40.12 85.04 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.388 -0.525 . . . . 40.14 111.018 177.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -63.46 -34.71 78.35 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 119.869 -0.733 . . . . 64.05 110.808 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 63.0 mtp -63.72 -43.1 97.54 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.17 -0.612 . . . . 48.22 110.916 175.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -62.77 -39.91 95.67 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.414 -0.515 . . . . 57.71 111.176 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -61.97 -42.04 98.69 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.348 -0.541 . . . . 71.49 111.127 177.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 76.4 mt -69.03 -41.54 77.57 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.419 -0.512 . . . . 54.2 111.229 179.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.6 mt -63.46 -38.66 91.99 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.343 -0.543 . . . . 51.96 111.247 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . . . -75.38 -31.64 60.53 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.375 -0.53 . . . . 55.37 111.764 179.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -62.19 -54.72 36.93 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.373 -0.531 . . . . 98.83 110.769 175.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.98 -39.69 78.82 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.399 -0.52 . . . . 48.23 110.866 176.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 51.2 ttt85 -55.54 -52.67 62.94 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.874 0.369 . . . . 94.73 111.095 178.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -65.7 -37.43 93.49 Favored Glycine 0 C--N 1.333 0.41 0 C-N-CA 120.086 -1.054 . . . . 42.96 112.519 179.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.31 -45.49 93.01 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 122.201 -0.588 . . . . 45.35 110.993 -179.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -66.17 -28.55 68.86 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.23 -0.588 . . . . 44.28 111.604 178.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.77 -35.63 60.07 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.505 -0.478 . . . . 68.49 111.537 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -66.45 -43.85 84.41 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.519 -0.473 . . . . 71.07 110.951 173.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.1 t -61.94 -44.35 98.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-O 120.996 0.427 . . . . 48.9 110.445 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.82 -38.57 85.88 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.34 -0.544 . . . . 44.17 111.117 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . . . -64.59 -45.9 84.99 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.683 -0.407 . . . . 51.17 111.036 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 64.3 m -59.48 -42.81 92.94 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.509 -0.476 . . . . 54.67 111.009 178.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ILE . . . . . 0.485 HG21 HD11 ' C' ' 34' ' ' LEU . 71.7 mt -68.38 -37.16 77.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 120.464 -0.494 . . . . 47.87 110.549 -179.676 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . . . -59.51 -43.53 93.38 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.34 -0.544 . . . . 46.66 111.305 -179.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -74.53 -36.82 63.17 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.28 -0.568 . . . . 94.71 111.107 179.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 24.6 mt -60.73 -37.77 82.87 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.03 -0.668 . . . . 51.57 110.874 176.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 87.0 mt -70.07 -28.64 65.61 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.005 -0.678 . . . . 51.3 111.554 175.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . . . -72.54 -50.74 23.61 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.603 -0.439 . . . . 57.21 110.923 177.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 65.9 mtp180 -46.98 -47.21 21.95 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.168 0.509 . . . . 87.47 110.443 169.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.2 tp -61.85 -43.91 97.9 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 116.476 -0.329 . . . . 70.87 111.43 -176.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 36.4 mttt -63.56 -44.02 95.36 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.281 -0.568 . . . . 104.98 111.466 -177.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -66.08 -34.24 77.61 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.567 -0.853 . . . . 82.28 111.248 -179.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 97.1 mt -62.58 -39.38 84.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 C-N-CA 120.294 -0.562 . . . . 64.45 110.194 175.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ILE . . . . . 0.419 HG23 ' HB3' ' C' ' 20' ' ' MET . 95.3 mt -66.41 -52.82 42.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 O-C-N 121.946 -0.471 . . . . 60.54 110.45 -177.62 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -51.63 -42.75 62.25 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.472 -0.491 . . . . 80.26 111.038 178.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . . . -63.79 -38.22 90.28 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.089 -0.644 . . . . 54.41 110.85 175.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -56.82 -47.3 80.61 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.632 -0.427 . . . . 67.83 110.818 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -70.51 -26.54 63.64 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.185 -0.606 . . . . 68.2 111.832 -177.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 65.7 mtm-85 -61.41 -45.48 94.15 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.372 -0.531 . . . . 66.59 110.723 169.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ILE . . . . . 0.403 HG23 ' HB3' ' B' ' 89' ' ' LEU . 89.7 mt -64.52 -43.75 96.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.021 0.438 . . . . 68.96 110.524 179.288 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.0 -43.76 98.17 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.911 -0.493 . . . . 53.38 111.396 -177.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . . . -67.94 -28.55 67.57 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.015 -0.674 . . . . 59.98 111.241 178.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -72.47 -42.61 64.74 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.337 -0.545 . . . . 92.9 110.893 174.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 10.7 m-70 -49.15 -52.82 24.09 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.45 -0.5 . . . . 63.49 110.556 170.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -54.67 -45.74 73.94 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 122.213 -0.304 . . . . 102.63 111.166 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -60.95 -35.13 75.94 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.406 -0.517 . . . . 124.81 111.278 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . 0.753 HG23 HD22 ' B' ' 82' ' ' LEU . 85.0 mt -71.31 -49.45 47.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 CA-C-O 120.964 0.412 . . . . 67.72 110.559 -179.603 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.26 -39.38 69.72 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 122.031 -0.418 . . . . 67.51 111.127 179.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -61.93 -45.22 94.66 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.561 -0.456 . . . . 92.41 110.674 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . . . -64.25 -42.32 96.55 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.855 -0.338 . . . . 88.34 111.532 -176.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ARG . . . . . 0.729 ' NH2' ' OE2' ' B' ' 79' ' ' GLU . 33.0 mtp-105 -70.16 -5.75 29.4 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.12 0.785 . . . . 75.62 113.12 -178.05 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.6 p . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 118.768 0.713 . . . . 80.57 110.465 178.233 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 78' ' ' THR . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.127 0 CA-C-O 120.916 0.389 . . . . 80.71 110.934 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 79' ' ' GLU . . . . . 0.729 ' OE2' ' NH2' ' A' ' 76' ' ' ARG . 11.4 tp10 -72.15 -39.23 68.91 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.916 -0.584 . . . . 80.58 111.549 -178.938 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . . . -68.55 -37.96 80.39 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.653 -0.419 . . . . 94.45 111.748 -174.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . . . -68.78 -49.04 61.91 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.449 -0.501 . . . . 79.93 111.079 -179.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' LEU . . . . . 0.753 HD22 HG23 ' A' ' 72' ' ' ILE . 6.8 mt -60.2 -38.28 82.81 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.429 -0.508 . . . . 79.28 111.275 178.624 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 14.1 tp -68.79 -33.79 74.47 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.202 -0.599 . . . . 74.22 111.51 -177.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . . . -74.14 -33.17 63.44 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.115 -0.634 . . . . 64.25 111.086 173.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ARG . . . . . . . . . . . . . . . -56.52 -51.92 66.73 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.953 0.406 . . . . 87.8 110.377 170.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 28.3 t -63.07 -40.55 98.0 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.79 -0.364 . . . . 55.19 111.238 178.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . . . -63.99 -37.64 88.16 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.286 -0.565 . . . . 69.83 111.166 -179.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . . . -66.88 -33.1 74.86 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.301 -0.56 . . . . 59.48 111.302 177.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' LEU . . . . . 0.403 ' HB3' HG23 ' A' ' 65' ' ' ILE . 90.1 mt -72.87 -36.06 67.32 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.433 -0.507 . . . . 61.97 111.333 -178.675 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -63.16 -33.81 76.26 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.035 -0.666 . . . . 62.1 111.269 176.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -65.26 -39.26 92.42 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.186 -0.605 . . . . 85.71 110.938 174.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -66.09 -47.36 74.47 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.919 -0.312 . . . . 88.73 111.067 177.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' SER . . . . . . . . . . . . . 4.8 m -58.3 -44.02 88.36 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.622 -0.431 . . . . 60.22 111.441 -179.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -59.69 -43.11 94.19 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.318 -0.553 . . . . 82.41 111.058 -178.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' ARG . . . . . . . . . . . . . 30.6 mtp85 -64.26 -36.48 84.23 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.166 -0.614 . . . . 82.91 111.039 177.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 34.1 mt -70.03 -46.36 65.22 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.239 -0.585 . . . . 53.34 110.961 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.76 -41.12 94.83 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.239 -0.584 . . . . 66.71 111.124 -179.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -63.27 -39.64 95.14 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.11 -0.636 . . . . 66.64 111.003 175.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -63.7 -44.4 93.79 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.269 -0.572 . . . . 70.78 110.851 178.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' MET . . . . . 0.422 ' HE2' HD21 ' D' ' 136' ' ' LEU . 86.6 mtp -57.57 -43.7 84.74 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.327 -0.549 . . . . 53.7 111.039 176.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.24 -46.27 88.94 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.553 -0.459 . . . . 41.64 111.13 -177.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' GLU . . . . . 0.611 ' OE1' ' NH2' ' B' ' 105' ' ' ARG . 24.4 tp10 -64.13 -37.4 87.33 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.384 -0.526 . . . . 79.12 111.021 -178.548 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 39.3 mt -61.85 -43.27 97.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 C-N-CA 120.628 -0.429 . . . . 55.57 110.443 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 82.6 mmm -65.03 -39.01 92.74 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.309 -0.556 . . . . 49.57 111.138 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' ARG . . . . . 0.611 ' NH2' ' OE1' ' B' ' 102' ' ' GLU . 88.9 mtm-85 -66.51 -36.11 81.9 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 119.961 -0.696 . . . . 93.15 110.968 176.249 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . . . -70.79 -43.06 69.48 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.308 -0.557 . . . . 81.54 111.073 177.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 39.8 mt -56.25 -51.35 64.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 CA-C-O 121.247 0.546 . . . . 41.04 110.155 174.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' LYS . . . . . 0.594 ' O ' ' O ' ' B' ' 301' ' ' HOH . 3.9 ttmt -54.32 -37.67 65.12 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 122.039 -0.413 . . . . 63.99 111.439 -179.616 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 109' ' ' LYS . . . . . . . . . . . . . 75.1 mttt -74.91 -40.5 60.84 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.522 -0.471 . . . . 64.11 111.303 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 23.2 mt -58.25 -40.93 83.06 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.214 -0.594 . . . . 51.67 111.022 177.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 67.2 mt -66.89 -42.38 85.6 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.263 -0.575 . . . . 48.53 111.269 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . . . -63.54 -41.78 98.44 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.1 -0.64 . . . . 53.35 110.971 177.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . . . -65.69 -40.79 92.67 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.472 -0.491 . . . . 50.4 111.25 178.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.33 -42.77 96.13 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.487 -0.485 . . . . 48.84 111.13 178.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' ARG . . . . . 0.778 ' NH2' ' OE1' ' D' ' 119' ' ' GLU . 28.7 ttt85 -59.78 -44.22 94.01 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.545 -0.462 . . . . 104.9 110.991 176.653 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . -59.4 -43.28 97.53 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 120.053 -1.07 . . . . 42.9 112.516 176.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' ALA . . . . . . . . . . . . . . . -67.4 -39.64 85.57 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 122.236 -0.567 . . . . 61.12 111.31 -178.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -67.35 -43.24 82.0 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.881 -0.728 . . . . 55.94 111.143 177.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . . . -57.63 -37.06 72.68 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.041 -0.664 . . . . 54.92 110.929 176.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 22.3 tptt -62.56 -48.0 81.4 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.817 0.341 . . . . 72.15 110.914 177.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 2.7 t -62.03 -45.94 97.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 121.018 0.437 . . . . 46.56 110.516 179.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 mt -63.45 -33.91 76.6 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.817 -0.552 . . . . 64.61 111.657 178.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -58.99 -46.27 88.57 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.409 -0.516 . . . . 60.57 110.776 172.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -70.82 -43.54 68.38 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.568 -0.453 . . . . 79.33 111.459 -178.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 47.2 mt -55.32 -40.43 71.14 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.341 -0.544 . . . . 47.75 111.041 174.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' ARG . . . . . . . . . . . . . 3.0 tmm_? -61.12 -41.06 96.01 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.973 -0.291 . . . . 134.59 111.144 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . . . -70.99 -39.0 72.73 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.459 -0.496 . . . . 50.96 111.235 -179.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' ILE . . . . . . . . . . . . . 96.4 mt -59.94 -37.04 70.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 120.952 0.406 . . . . 48.35 110.419 178.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' ILE . . . . . . . . . . . . . 34.0 mt -72.48 -36.87 55.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 C-N-CA 120.351 -0.54 . . . . 42.35 110.737 -176.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -69.99 -27.46 64.72 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.538 -0.865 . . . . 69.45 111.407 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -68.47 -46.72 69.01 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.468 -0.493 . . . . 67.29 110.433 170.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' ILE . . . . . . . . . . . . . 74.1 mt -56.06 -49.53 75.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-O 121.14 0.495 . . . . 41.16 110.28 177.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' ARG . . . . . . . . . . . . . 64.0 mtp180 -64.19 -35.77 81.88 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.182 -0.607 . . . . 65.21 111.457 -177.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -63.9 -37.21 86.54 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 119.814 -0.754 . . . . 60.61 110.841 173.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 135' ' ' LEU . . . . . . . . . . . . . 39.7 mt -65.35 -27.75 68.81 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.303 -0.559 . . . . 49.34 111.355 176.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 74.9 mt -79.3 -25.0 42.49 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.153 0.427 . . . . 44.33 112.153 175.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -61.02 -48.86 79.85 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.059 -0.656 . . . . 66.62 110.354 169.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 11.6 tpt180 -64.89 -40.66 95.46 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.077 -0.649 . . . . 79.27 110.942 177.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 32.9 t -55.94 -44.68 78.64 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.222 -0.591 . . . . 46.96 110.936 176.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 85.4 mtt-85 -64.25 -38.89 92.66 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.233 -0.587 . . . . 78.47 111.107 176.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 30.8 mmtt -61.31 -42.93 99.49 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.303 -0.559 . . . . 61.08 110.866 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 71.2 mt -61.75 -50.04 81.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 121.085 0.469 . . . . 46.24 110.167 178.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' HIS . . . . . 0.508 ' ND1' ' OE1' ' D' ' 90' ' ' GLN . 47.9 t60 -56.09 -48.66 75.72 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.401 -0.52 . . . . 77.75 110.869 175.514 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 144' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -55.38 -43.43 75.15 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.797 -0.361 . . . . 71.53 111.118 178.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -67.34 -36.76 82.06 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 120.407 -0.517 . . . . 44.68 111.069 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' SER . . . . . . . . . . . . . 4.4 m -62.39 -42.4 99.4 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.389 -0.524 . . . . 52.35 111.298 179.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.21 -41.06 98.04 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.959 -0.697 . . . . 70.7 110.853 177.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -50.42 -53.01 32.66 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.014 0.435 . . . . 73.46 111.003 174.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 149' ' ' ILE . . . . . . . . . . . . . 78.0 mt -61.37 -35.76 68.52 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-O 120.844 0.354 . . . . 53.1 110.717 -175.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -73.04 -32.26 64.95 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.444 -0.502 . . . . 77.75 111.79 -179.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 151' ' ' TYR . . . . . . . . . . . . . . . -58.59 -48.07 82.19 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.447 -0.501 . . . . 91.59 110.896 178.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.276 0 O-C-N 122.149 -0.344 . . . . 90.25 110.745 178.381 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 0' ' ' FME . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 1' ' ' THR . . . . . . . . . . . . . 19.9 p -75.39 164.08 26.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.392 -1.277 . . . . 65.59 110.814 -179.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 2' ' ' ARG . . . . . . . . . . . . . 53.7 ttt85 -53.39 -46.35 69.64 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.097 -0.501 . . . . 58.54 110.803 175.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' GLU . . . . . . . . . . . . . 48.2 tt0 -57.93 -36.49 72.57 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.606 -0.438 . . . . 85.29 111.233 -179.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -72.96 -40.55 65.25 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.506 -0.478 . . . . 67.22 111.372 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' LEU . . . . . 0.66 HD22 HG23 ' D' ' 149' ' ' ILE . 1.6 mt -62.97 -40.48 97.84 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.562 -0.455 . . . . 52.05 111.254 179.67 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 6' ' ' LEU . . . . . 0.473 HD21 ' NH1' ' A' ' 76' ' ' ARG . 87.4 mt -66.29 -38.05 86.87 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.012 -0.675 . . . . 68.43 111.152 178.064 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 7' ' ' ARG . . . . . . . . . . . . . . . -62.23 -37.63 86.14 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.125 -0.63 . . . . 62.06 110.69 174.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 8' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -67.59 -39.29 84.83 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.714 -0.394 . . . . 57.05 111.079 178.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -56.56 -45.87 81.04 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.477 -0.489 . . . . 61.92 110.865 175.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' ILE . . . . . . . . . . . . . 69.5 mt -60.19 -49.23 84.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 CA-C-O 121.255 0.55 . . . . 57.26 110.254 177.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . . . -60.22 -46.05 91.09 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.946 -0.471 . . . . 74.69 111.155 -178.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' LEU . . . . . . . . . . . . . 14.9 mt -60.27 -39.76 87.95 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.082 -0.647 . . . . 48.72 111.022 178.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.55 96.17 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.448 -0.501 . . . . 46.64 111.199 179.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -66.07 -50.79 62.9 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.221 -0.592 . . . . 80.55 110.951 176.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' GLU . . . . . 0.46 ' HG2' HD11 ' D' ' 142' ' ' ILE . 63.4 tt0 -54.33 -40.57 68.13 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.497 -0.481 . . . . 56.02 110.931 176.146 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -58.84 -44.37 90.93 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.708 -0.397 . . . . 58.81 110.984 175.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' ILE . . . . . . . . . . . . . 12.0 mt -64.58 -48.44 84.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-O 121.112 0.482 . . . . 54.83 110.383 -179.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 30.2 tp10 -60.23 -38.22 82.74 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 121.863 -0.523 . . . . 93.47 111.108 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' ILE . . . . . . . . . . . . . 26.4 mt -59.2 -54.24 36.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-O 121.232 0.539 . . . . 50.43 110.123 175.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' MET . . . . . 0.586 ' HE2' HD12 ' C' ' 23' ' ' ILE . 35.6 mmt -56.01 -38.42 70.47 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 122.07 -0.394 . . . . 73.69 111.334 179.643 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . . . -61.1 -42.03 97.78 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.202 -0.599 . . . . 51.58 110.99 176.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -67.32 -38.54 85.1 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.102 -0.639 . . . . 72.14 111.099 179.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' ILE . . . . . 0.586 HD12 ' HE2' ' C' ' 20' ' ' MET . 40.3 mt -58.48 -57.32 11.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 C-N-CA 120.411 -0.516 . . . . 48.29 109.946 176.429 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 24' ' ' LEU . . . . . . . . . . . . . . . -50.39 -41.15 51.62 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 122.127 -0.358 . . . . 67.45 111.206 179.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -62.41 -40.27 95.99 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.344 -0.543 . . . . 64.87 110.99 174.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 26' ' ' LEU . . . . . 0.473 HD22 HG23 ' D' ' 128' ' ' ILE . 10.3 mt -72.04 -26.4 62.18 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.425 -0.51 . . . . 55.29 111.524 179.506 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 27' ' ' LEU . . . . . . . . . . . . . 62.3 mt -74.4 -29.91 61.73 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.454 -0.498 . . . . 47.67 111.224 175.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -56.81 -51.8 67.54 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.597 -0.441 . . . . 69.32 110.751 170.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' LYS . . . . . . . . . . . . . . . -60.11 -39.27 85.6 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.775 -0.37 . . . . 48.46 111.275 -177.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' MET . . . . . . . . . . . . . 84.0 mtp -57.83 -42.54 84.58 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.055 -0.658 . . . . 46.54 110.963 176.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 31' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.21 -45.81 83.25 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.687 -0.405 . . . . 65.12 110.97 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -62.74 -38.77 91.82 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.453 -0.499 . . . . 71.98 111.248 -178.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 33' ' ' LEU . . . . . . . . . . . . . 40.1 mt -68.66 -42.85 77.32 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.052 -0.659 . . . . 51.46 111.156 176.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 34' ' ' LEU . . . . . 0.485 HD11 HG21 ' A' ' 48' ' ' ILE . 55.0 mt -61.9 -38.67 89.25 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.164 -0.615 . . . . 52.34 111.018 175.808 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -64.5 -46.89 81.02 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.541 -0.464 . . . . 61.32 110.988 177.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 36' ' ' LYS . . . . . . . . . . . . . 24.5 ttpt -59.57 -55.94 28.16 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.54 -0.464 . . . . 71.0 111.038 179.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 37' ' ' ALA . . . . . 0.468 ' HB2' HG21 ' D' ' 121' ' ' VAL . . . -53.76 -38.7 64.68 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.467 -0.493 . . . . 44.98 111.271 -179.913 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 38' ' ' ARG . . . . . . . . . . . . . 40.6 ttp85 -62.17 -39.41 92.57 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 120.092 -0.643 . . . . 70.88 110.894 174.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 39' ' ' GLY . . . . . . . . . . . . . . . -71.01 -41.43 61.05 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.127 -1.035 . . . . 46.25 112.597 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.68 -41.55 97.72 Favored 'General case' 0 C--O 1.237 0.409 0 O-C-N 122.171 -0.605 . . . . 45.51 111.033 178.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 41' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -70.05 -28.01 65.11 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.218 -0.593 . . . . 49.21 111.596 178.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 42' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -69.62 -39.5 77.16 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.106 -0.637 . . . . 68.58 110.921 175.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 43' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -59.87 -56.23 24.33 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.195 0.521 . . . . 65.47 110.835 175.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 44' ' ' VAL . . . . . . . . . . . . . 79.6 t -58.81 -42.39 85.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 C-N-CA 120.741 -0.384 . . . . 51.55 110.601 -176.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.69 -49.3 78.09 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 120.044 -0.663 . . . . 43.23 110.764 178.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -59.22 -46.05 89.48 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.412 -0.515 . . . . 76.65 110.829 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 47' ' ' THR . . . . . . . . . . . . . 92.5 m -58.19 -41.91 84.97 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.728 -0.389 . . . . 57.48 111.25 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 48' ' ' ILE . . . . . . . . . . . . . 35.9 mt -65.51 -39.38 84.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 120.496 -0.482 . . . . 48.69 110.796 -178.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -59.38 -41.67 89.9 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.749 -0.78 . . . . 74.36 110.755 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 50' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -59.95 -39.46 85.67 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.498 -0.481 . . . . 80.65 111.065 176.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 83.5 mt -69.41 -49.03 58.98 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.391 -0.524 . . . . 46.75 111.06 178.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 80.4 mt -59.11 -39.88 83.66 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.252 -0.579 . . . . 45.56 110.963 175.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 53' ' ' ARG . . . . . . . . . . . . . 18.1 ttp85 -58.32 -48.56 80.15 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.332 -0.547 . . . . 70.18 110.678 176.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -61.77 -36.91 82.41 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.712 -0.395 . . . . 88.62 111.069 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 55' ' ' LEU . . . . . 0.408 ' HG ' HG21 ' D' ' 103' ' ' ILE . 13.6 mt -61.7 -51.55 67.91 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.374 -0.53 . . . . 49.16 111.171 178.64 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 56' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -53.57 -40.56 65.72 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.442 -0.503 . . . . 49.43 110.975 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 57' ' ' GLU . . . . . . . . . . . . . 62.7 tt0 -61.5 -42.13 98.34 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.803 -0.359 . . . . 63.29 111.145 176.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 58' ' ' ILE . . . . . 0.441 HG21 ' HG3' ' D' ' 100' ' ' MET . 58.0 mt -65.93 -45.06 92.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-O 121.04 0.447 . . . . 55.77 110.578 178.071 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 59' ' ' ILE . . . . . . . . . . . . . 53.1 mt -61.58 -40.27 85.99 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 O-C-N 121.929 -0.482 . . . . 57.96 110.7 -174.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 36.3 tp10 -59.93 -36.35 76.86 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.065 -0.654 . . . . 81.95 110.985 178.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 61' ' ' ARG . . . . . . . . . . . . . 29.6 tpt180 -67.83 -45.04 75.81 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.482 -0.487 . . . . 62.0 111.087 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 62' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -58.69 -41.55 86.51 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.221 -0.591 . . . . 59.11 111.396 -179.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 63' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -67.71 -32.15 72.59 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 119.704 -0.798 . . . . 82.17 111.462 178.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 28.9 mtp180 -64.56 -36.63 84.83 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.13 -0.628 . . . . 85.66 110.773 169.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 65' ' ' ILE . . . . . . . . . . . . . 4.3 mt -72.74 -47.4 50.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 C-N-CA 120.669 -0.412 . . . . 52.47 110.419 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.0 -40.22 76.17 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.223 -0.591 . . . . 54.2 111.034 177.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 67' ' ' LYS . . . . . . . . . . . . . . . -59.79 -43.38 94.44 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.257 -0.577 . . . . 63.04 111.073 176.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 68' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -62.51 -41.87 99.13 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.138 -0.625 . . . . 70.91 110.95 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 69' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -59.18 -44.57 92.17 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.423 -0.511 . . . . 45.9 110.877 177.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -51.0 -50.98 57.46 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.268 -0.573 . . . . 56.59 110.354 170.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 71' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -59.19 -49.12 79.08 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.878 -0.329 . . . . 90.6 111.25 -177.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 54.3 mt -62.22 -47.15 94.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.236 -0.586 . . . . 63.81 110.518 -176.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.95 -39.07 71.21 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.427 -0.509 . . . . 63.01 111.226 -179.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 74' ' ' ARG . . . . . . . . . . . . . 24.1 mtt-85 -72.99 -30.08 63.53 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.353 -0.539 . . . . 72.75 111.552 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 75' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -76.48 -28.0 56.32 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 112.065 0.394 . . . . 81.47 112.065 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 76' ' ' ARG . . . . . . . . . . . . . 63.6 mtp180 -80.28 -29.81 38.27 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 112.549 0.574 . . . . 66.16 112.549 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 77' ' ' SER . . . . . . . . . . . . . 57.1 p . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 118.107 0.412 . . . . 83.65 111.376 -175.785 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 78' ' ' THR . . . . . . . . . . . . . 13.9 p . . . . . 0 C--O 1.232 0.134 0 N-CA-C 111.737 0.273 . . . . 78.26 111.737 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 79' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -65.21 -48.76 72.24 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.496 -0.481 . . . . 81.47 110.991 178.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 80' ' ' ARG . . . . . . . . . . . . . . . -64.73 -38.76 92.09 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.47 -0.492 . . . . 71.35 111.207 178.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 81' ' ' LYS . . . . . . . . . . . . . . . -60.23 -56.26 23.66 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.025 0.44 . . . . 61.21 110.77 179.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 82' ' ' LEU . . . . . . . . . . . . . 46.0 mt -57.7 -42.21 83.26 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.405 -0.518 . . . . 58.36 111.139 177.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 83' ' ' LEU . . . . . . . . . . . . . 21.3 tp -66.14 -39.4 89.83 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.65 -0.42 . . . . 54.75 111.269 -178.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 84' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -67.11 -38.04 84.95 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.482 -0.487 . . . . 71.38 111.116 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 85' ' ' ARG . . . . . . . . . . . . . . . -64.35 -40.28 95.55 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.328 -0.549 . . . . 78.07 110.994 179.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 3.7 p -65.23 -40.97 94.79 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.096 -0.641 . . . . 60.93 111.063 179.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 87' ' ' ARG . . . . . . . . . . . . . 65.1 mtt85 -59.59 -41.79 91.08 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 120.087 -0.645 . . . . 73.26 110.935 177.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 88' ' ' ARG . . . . . . . . . . . . . . . -56.58 -46.87 80.57 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.603 -0.439 . . . . 63.8 110.901 176.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 66.1 mt -68.34 -34.93 77.0 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.224 -0.59 . . . . 52.12 111.769 -176.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 90' ' ' GLN . . . . . 0.508 ' OE1' ' ND1' ' B' ' 143' ' ' HIS . 39.6 mm-40 -60.13 -47.92 83.87 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.883 -0.727 . . . . 67.45 110.607 173.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 91' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -56.48 -41.28 76.31 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.261 -0.575 . . . . 64.14 111.103 177.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 92' ' ' GLU . . . . . . . . . . . . . 68.9 tt0 -63.15 -44.38 95.66 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.052 -0.659 . . . . 68.62 110.831 175.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 93' ' ' SER . . . . . . . . . . . . . 4.1 m -56.69 -46.87 80.93 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.647 -0.421 . . . . 53.13 111.018 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 94' ' ' LYS . . . . . . . . . . . . . . . -53.69 -49.58 67.71 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.387 -0.525 . . . . 53.59 110.718 179.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 95' ' ' ARG . . . . . . . . . . . . . . . -57.24 -40.29 77.29 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.509 -0.477 . . . . 57.03 111.211 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 90.5 mt -72.04 -43.57 64.76 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.237 -0.585 . . . . 53.32 111.232 -177.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 97' ' ' LEU . . . . . . . . . . . . . 77.5 mt -57.3 -41.11 79.2 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 119.851 -0.74 . . . . 49.29 110.677 175.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 98' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -58.08 -49.47 76.79 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.789 -0.364 . . . . 61.54 111.096 176.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 99' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -64.26 -31.34 72.5 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 119.699 -0.8 . . . . 60.7 111.471 -178.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 100' ' ' MET . . . . . 0.441 ' HG3' HG21 ' C' ' 58' ' ' ILE . 46.6 mtp -67.67 -48.29 67.05 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.116 -0.634 . . . . 48.12 110.868 176.885 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.27 -36.67 78.34 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.44 -0.504 . . . . 49.17 111.06 178.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 49.9 tt0 -69.82 -32.26 70.6 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.667 -0.413 . . . . 82.34 111.357 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 103' ' ' ILE . . . . . 0.408 HG21 ' HG ' ' C' ' 55' ' ' LEU . 22.8 mt -74.38 -38.25 46.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 120.294 -0.562 . . . . 40.47 110.618 179.951 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 104' ' ' MET . . . . . . . . . . . . . 83.4 mmm -65.08 -46.46 81.03 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.171 -0.611 . . . . 41.93 110.842 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 105' ' ' ARG . . . . . . . . . . . . . . . -58.71 -33.11 69.83 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.443 -0.503 . . . . 44.98 111.313 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 106' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -72.05 -43.47 64.88 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.103 -0.639 . . . . 66.04 111.061 179.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 107' ' ' ILE . . . . . . . . . . . . . 54.7 mt -57.16 -41.33 77.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 120.347 -0.541 . . . . 50.45 110.237 177.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 108' ' ' LYS . . . . . . . . . . . . . 27.0 mtpt -55.45 -51.74 65.92 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 121.959 -0.463 . . . . 63.91 110.956 172.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 109' ' ' LYS . . . . . . . . . . . . . . . -57.48 -39.42 76.35 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.577 -0.449 . . . . 48.1 111.233 -179.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 110' ' ' LEU . . . . . . . . . . . . . 35.0 mt -68.26 -41.4 81.16 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.027 -0.669 . . . . 71.17 111.384 -179.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 111' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.72 -42.49 95.2 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.386 -0.526 . . . . 45.39 111.212 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 112' ' ' LYS . . . . . . . . . . . . . . . -60.24 -43.44 96.08 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.185 -0.606 . . . . 49.94 110.881 175.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 113' ' ' LYS . . . . . . . . . . . . . 42.5 tttt -59.7 -54.74 42.88 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.84 0.352 . . . . 56.43 110.948 179.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 114' ' ' ALA . . . . . . . . . . . . . . . -57.02 -41.8 79.2 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.634 -0.426 . . . . 50.81 111.209 -178.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 115' ' ' ARG . . . . . . . . . . . . . 48.9 ttt180 -62.43 -46.08 90.2 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.365 -0.534 . . . . 99.6 110.91 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 116' ' ' GLY . . . . . . . . . . . . . . . -58.5 -43.83 95.74 Favored Glycine 0 C--N 1.334 0.424 0 C-N-CA 119.895 -1.145 . . . . 42.37 112.448 177.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 117' ' ' ALA . . . . . . . . . . . . . . . -64.77 -38.45 91.01 Favored 'General case' 0 C--O 1.238 0.455 0 O-C-N 122.233 -0.569 . . . . 42.67 111.238 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 118' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -66.05 -35.29 80.14 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.18 -0.608 . . . . 59.05 111.185 176.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 119' ' ' GLU . . . . . 0.778 ' OE1' ' NH2' ' B' ' 115' ' ' ARG . 25.9 mm-40 -64.44 -39.45 93.85 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.487 -0.485 . . . . 91.95 111.094 177.371 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 120' ' ' LYS . . . . . . . . . . . . . . . -64.79 -43.07 94.41 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.553 -0.459 . . . . 53.93 111.005 176.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 121' ' ' VAL . . . . . 0.468 HG21 ' HB2' ' C' ' 37' ' ' ALA . 40.6 t -62.09 -41.16 90.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 C-N-CA 120.375 -0.53 . . . . 51.25 110.421 177.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 122' ' ' LEU . . . . . . . . . . . . . 9.9 mt -65.91 -44.14 86.1 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 121.91 -0.494 . . . . 50.24 111.333 178.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 123' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -57.03 -48.44 78.5 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.599 -0.44 . . . . 66.03 110.922 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 124' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -57.62 -54.08 50.9 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.322 -0.551 . . . . 76.71 110.63 176.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 125' ' ' LEU . . . . . . . . . . . . . 30.6 mt -48.4 -43.83 34.4 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 122.204 -0.31 . . . . 43.47 111.697 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 126' ' ' ARG . . . . . . . . . . . . . 23.9 ttp-105 -58.79 -47.39 84.92 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 120.014 -0.674 . . . . 66.78 110.725 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 127' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -64.09 -38.11 89.86 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.189 -0.604 . . . . 75.16 111.288 -178.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 128' ' ' ILE . . . . . 0.473 HG23 HD22 ' C' ' 26' ' ' LEU . 7.2 mt -64.13 -41.84 93.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 C-N-CA 120.174 -0.61 . . . . 45.61 110.191 177.578 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 129' ' ' ILE . . . . . . . . . . . . . 37.3 mt -62.68 -36.4 75.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 C-N-CA 120.43 -0.508 . . . . 49.5 110.515 -178.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 130' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -77.6 -31.68 53.1 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.034 -0.666 . . . . 76.38 112.094 -177.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 131' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -65.73 -41.39 92.26 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.771 -0.772 . . . . 74.39 110.465 169.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 132' ' ' ILE . . . . . . . . . . . . . 44.5 mt -58.49 -55.71 20.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-O 121.343 0.592 . . . . 39.24 110.091 174.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 133' ' ' ARG . . . . . . . . . . . . . 44.5 mtp180 -62.44 -30.52 71.29 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.197 -0.601 . . . . 85.99 111.523 -177.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 134' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -62.91 -37.85 88.64 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.016 -0.674 . . . . 69.16 110.603 170.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 135' ' ' LEU . . . . . . . . . . . . . 85.1 mt -68.87 -35.49 76.95 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.42 -0.512 . . . . 48.7 110.996 177.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 136' ' ' LEU . . . . . 0.422 HD21 ' HE2' ' B' ' 100' ' ' MET . 87.0 mt -68.07 -27.35 66.43 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.828 -0.749 . . . . 47.85 111.432 175.714 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 137' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -66.48 -48.16 70.74 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.439 -0.504 . . . . 79.42 110.706 173.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 138' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -62.54 -42.5 99.57 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.121 -0.632 . . . . 62.14 110.854 177.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 139' ' ' SER . . . . . . . . . . . . . 27.3 t -57.13 -40.25 76.74 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.136 -0.626 . . . . 47.64 111.021 176.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 140' ' ' ARG . . . . . . . . . . . . . . . -65.09 -32.98 74.96 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.224 -0.59 . . . . 57.01 111.544 177.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 141' ' ' LYS . . . . . . . . . . . . . 20.1 mmtt -68.67 -43.78 75.42 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.082 -0.647 . . . . 71.99 110.928 175.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 142' ' ' ILE . . . . . 0.46 HD11 ' HG2' ' C' ' 15' ' ' GLU . 93.3 mt -56.28 -48.17 79.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 120.341 -0.543 . . . . 49.3 110.156 178.024 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 143' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -64.04 -40.19 95.74 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.621 -0.832 . . . . 67.84 111.091 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 144' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -58.9 -50.65 73.23 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.405 -0.518 . . . . 79.88 110.657 176.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 145' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -58.92 -41.46 87.34 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.716 -0.394 . . . . 51.33 111.058 176.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 146' ' ' SER . . . . . . . . . . . . . 5.7 m -62.83 -36.82 84.44 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.257 -0.577 . . . . 59.91 111.075 177.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 147' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -65.48 -37.8 87.9 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.302 -0.559 . . . . 66.25 110.926 175.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 148' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -62.27 -47.17 85.54 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 120.843 0.354 . . . . 67.13 111.43 179.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 149' ' ' ILE . . . . . 0.66 HG23 HD22 ' C' ' 5' ' ' LEU . 41.6 mt -57.53 -23.63 20.24 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 111.64 0.237 . . . . 74.02 111.64 -169.831 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 150' ' ' ALA . . . . . . . . . . . . . . . -102.76 13.89 33.31 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.966 0.728 . . . . 106.87 112.966 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 151' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 118.368 0.531 . . . . 99.32 111.123 178.909 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . 0.464 ' O ' ' NH1' ' A' ' 7' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 301' ' ' HOH . . . . . 0.594 ' O ' ' O ' ' B' ' 108' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' FME . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 16.9 p -74.84 157.28 35.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.266 -1.333 . . . . 63.950000000000003 109.508 179.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.7 ttt-85 -57.23 -48.08 79.72 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.527 -0.469 . . . . 69.459999999999994 111.03 -178.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . . . -60.04 -32.96 71.39 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.312 -0.555 . . . . 52.780000000000001 111.287 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 87.8 mt-10 -69.37 -40.93 77.13 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.315 -0.554 . . . . 77.140000000000001 111.11 177.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.58 -42.07 95.85 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.358 -0.537 . . . . 46.32 111.218 -179.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -65.56 -40.54 92.93 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.949 -0.7 . . . . 52.520000000000003 111.016 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.464 ' NH1' ' O ' ' A' ' 102' ' ' HOH . 19.1 tpp180 -61.81 -38.85 89.68 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.221 -0.592 . . . . 89.569999999999993 110.796 175.105 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -64.2 -40.66 96.55 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.626 -0.83 . . . . 41.369999999999997 110.742 175.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -52.95 -43.55 66.42 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.237 -0.585 . . . . 56.109999999999999 110.652 173.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 52.9 mt -64.72 -50.48 75.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-O 121.097 0.475 . . . . 44.630000000000003 110.318 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -55.28 -42.37 73.52 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.473 -0.491 . . . . 79.680000000000007 111.166 178.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.9 mt -62.4 -43.7 98.2 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.473 -0.491 . . . . 40.810000000000002 111.129 179.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.6 -47.26 87.0 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.546 -0.462 . . . . 36.939999999999998 110.971 176.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.0 mtmt -60.96 -44.63 97.03 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.104 -0.638 . . . . 74.840000000000003 110.984 178.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.4 -41.25 89.02 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.267 -0.573 . . . . 67.530000000000001 111.031 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -63.49 -36.87 85.18 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.345 -0.542 . . . . 54.939999999999998 111.045 -179.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.1 mt -66.42 -44.24 90.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 120.295 -0.562 . . . . 47.43 110.605 179.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . . . -60.3 -37.86 81.83 Favored 'General case' 0 C--O 1.237 0.42 0 O-C-N 121.863 -0.523 . . . . 41.859999999999999 111.058 176.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 10.3 mt -66.69 -46.41 85.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 121.032 0.444 . . . . 43.740000000000002 110.442 179.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 33.4 mmt -58.69 -38.7 78.8 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.238 -0.585 . . . . 46.5 111.13 176.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -62.55 -45.67 91.9 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.527 -0.469 . . . . 81.950000000000003 111.02 178.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 63.6 tt0 -58.83 -40.07 83.13 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.078 -0.649 . . . . 73.25 110.899 178.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 49.8 mt -63.4 -43.62 98.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 C-N-CA 120.377 -0.529 . . . . 46.82 110.317 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 tp -56.74 -44.45 81.72 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 121.886 -0.509 . . . . 60.32 110.775 177.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -56.08 -47.3 78.26 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.752 -0.379 . . . . 79.219999999999999 110.892 173.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 39.4 mt -68.93 -31.21 69.94 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.795 -0.362 . . . . 44.560000000000002 111.918 -174.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 31.4 mt -65.02 -44.91 87.63 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.917 -0.713 . . . . 49.469999999999999 110.772 175.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . . . -59.26 -40.12 85.04 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.388 -0.525 . . . . 40.140000000000001 111.018 177.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -63.46 -34.71 78.35 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 119.869 -0.733 . . . . 64.049999999999997 110.808 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 63.0 mtp -63.72 -43.1 97.54 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.17 -0.612 . . . . 48.219999999999999 110.916 175.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -62.77 -39.91 95.67 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.414 -0.515 . . . . 57.710000000000001 111.176 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -61.97 -42.04 98.69 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.348 -0.541 . . . . 71.489999999999995 111.127 177.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 76.4 mt -69.03 -41.54 77.57 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.419 -0.512 . . . . 54.200000000000003 111.229 179.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.6 mt -63.46 -38.66 91.99 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.343 -0.543 . . . . 51.960000000000001 111.247 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . . . -75.38 -31.64 60.53 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.375 -0.53 . . . . 55.369999999999997 111.764 179.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -62.19 -54.72 36.93 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.373 -0.531 . . . . 98.829999999999998 110.769 175.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.98 -39.69 78.82 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.399 -0.52 . . . . 48.229999999999997 110.866 176.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 51.2 ttt85 -55.54 -52.67 62.94 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.874 0.369 . . . . 94.730000000000004 111.095 178.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -65.7 -37.43 93.49 Favored Glycine 0 C--N 1.333 0.41 0 C-N-CA 120.086 -1.054 . . . . 42.960000000000001 112.519 179.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.31 -45.49 93.01 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 122.201 -0.588 . . . . 45.350000000000001 110.993 -179.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -66.17 -28.55 68.86 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.23 -0.588 . . . . 44.280000000000001 111.604 178.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.77 -35.63 60.07 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.505 -0.478 . . . . 68.489999999999995 111.537 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -66.45 -43.85 84.41 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.519 -0.473 . . . . 71.069999999999993 110.951 173.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.1 t -61.94 -44.35 98.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-O 120.996 0.427 . . . . 48.899999999999999 110.445 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.82 -38.57 85.88 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.34 -0.544 . . . . 44.170000000000002 111.117 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . . . -64.59 -45.9 84.99 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.683 -0.407 . . . . 51.170000000000002 111.036 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 64.3 m -59.48 -42.81 92.94 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.509 -0.476 . . . . 54.670000000000002 111.009 178.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.485 HG21 HD11 ' C' ' 34' ' ' LEU . 71.7 mt -68.38 -37.16 77.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 120.464 -0.494 . . . . 47.869999999999997 110.549 -179.676 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . . . -59.51 -43.53 93.38 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.34 -0.544 . . . . 46.659999999999997 111.305 -179.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -74.53 -36.82 63.17 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.28 -0.568 . . . . 94.709999999999994 111.107 179.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 24.6 mt -60.73 -37.77 82.87 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.03 -0.668 . . . . 51.57 110.874 176.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 87.0 mt -70.07 -28.64 65.61 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.005 -0.678 . . . . 51.299999999999997 111.554 175.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . . . -72.54 -50.74 23.61 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.603 -0.439 . . . . 57.210000000000001 110.923 177.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 65.9 mtp180 -46.98 -47.21 21.95 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.168 0.509 . . . . 87.469999999999999 110.443 169.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.2 tp -61.85 -43.91 97.9 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 116.476 -0.329 . . . . 70.870000000000005 111.43 -176.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 36.4 mttt -63.56 -44.02 95.36 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.281 -0.568 . . . . 104.98 111.466 -177.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -66.08 -34.24 77.61 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.567 -0.853 . . . . 82.280000000000001 111.248 -179.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 97.1 mt -62.58 -39.38 84.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 C-N-CA 120.294 -0.562 . . . . 64.450000000000003 110.194 175.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.419 HG23 ' HB3' ' C' ' 20' ' ' MET . 95.3 mt -66.41 -52.82 42.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 O-C-N 121.946 -0.471 . . . . 60.539999999999999 110.45 -177.62 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -51.63 -42.75 62.25 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.472 -0.491 . . . . 80.260000000000005 111.038 178.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . . . -63.79 -38.22 90.28 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.089 -0.644 . . . . 54.409999999999997 110.85 175.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -56.82 -47.3 80.61 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.632 -0.427 . . . . 67.829999999999998 110.818 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -70.51 -26.54 63.64 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.185 -0.606 . . . . 68.200000000000003 111.832 -177.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 65.7 mtm-85 -61.41 -45.48 94.15 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.372 -0.531 . . . . 66.590000000000003 110.723 169.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.403 HG23 ' HB3' ' B' ' 89' ' ' LEU . 89.7 mt -64.52 -43.75 96.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.021 0.438 . . . . 68.959999999999994 110.524 179.288 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.0 -43.76 98.17 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.911 -0.493 . . . . 53.380000000000003 111.396 -177.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . . . -67.94 -28.55 67.57 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.015 -0.674 . . . . 59.979999999999997 111.241 178.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -72.47 -42.61 64.74 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.337 -0.545 . . . . 92.900000000000006 110.893 174.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 10.7 m-70 -49.15 -52.82 24.09 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.45 -0.5 . . . . 63.490000000000002 110.556 170.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -54.67 -45.74 73.94 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 122.213 -0.304 . . . . 102.63 111.166 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -60.95 -35.13 75.94 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.406 -0.517 . . . . 124.81 111.278 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.753 HG23 HD22 ' B' ' 82' ' ' LEU . 85.0 mt -71.31 -49.45 47.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 CA-C-O 120.964 0.412 . . . . 67.719999999999999 110.559 -179.603 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.26 -39.38 69.72 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 122.031 -0.418 . . . . 67.510000000000005 111.127 179.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -61.93 -45.22 94.66 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.561 -0.456 . . . . 92.409999999999997 110.674 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . . . -64.25 -42.32 96.55 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.855 -0.338 . . . . 88.340000000000003 111.532 -176.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.729 ' NH2' ' OE2' ' B' ' 79' ' ' GLU . 33.0 mtp-105 -70.16 -5.75 29.4 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.12 0.785 . . . . 75.620000000000005 113.12 -178.05 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.6 p . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 118.768 0.713 . . . . 80.569999999999993 110.465 178.233 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' THR . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.127 0 CA-C-O 120.916 0.389 . . . . 80.709999999999994 110.934 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' GLU . . . . . 0.729 ' OE2' ' NH2' ' A' ' 76' ' ' ARG . 11.4 tp10 -72.15 -39.23 68.91 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.916 -0.584 . . . . 80.579999999999998 111.549 -178.938 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . . . -68.55 -37.96 80.39 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.653 -0.419 . . . . 94.450000000000003 111.748 -174.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . . . -68.78 -49.04 61.91 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.449 -0.501 . . . . 79.930000000000007 111.079 -179.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' LEU . . . . . 0.753 HD22 HG23 ' A' ' 72' ' ' ILE . 6.8 mt -60.2 -38.28 82.81 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.429 -0.508 . . . . 79.280000000000001 111.275 178.624 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 14.1 tp -68.79 -33.79 74.47 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.202 -0.599 . . . . 74.219999999999999 111.51 -177.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . . . -74.14 -33.17 63.44 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.115 -0.634 . . . . 64.25 111.086 173.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ARG . . . . . . . . . . . . . . . -56.52 -51.92 66.73 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.953 0.406 . . . . 87.799999999999997 110.377 170.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 28.3 t -63.07 -40.55 98.0 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.79 -0.364 . . . . 55.189999999999998 111.238 178.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . . . -63.99 -37.64 88.16 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.286 -0.565 . . . . 69.829999999999998 111.166 -179.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . . . -66.88 -33.1 74.86 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.301 -0.56 . . . . 59.479999999999997 111.302 177.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' LEU . . . . . 0.403 ' HB3' HG23 ' A' ' 65' ' ' ILE . 90.1 mt -72.87 -36.06 67.32 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.433 -0.507 . . . . 61.969999999999999 111.333 -178.675 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -63.16 -33.81 76.26 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.035 -0.666 . . . . 62.100000000000001 111.269 176.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -65.26 -39.26 92.42 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.186 -0.605 . . . . 85.709999999999994 110.938 174.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -66.09 -47.36 74.47 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.919 -0.312 . . . . 88.730000000000004 111.067 177.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' SER . . . . . . . . . . . . . 4.8 m -58.3 -44.02 88.36 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.622 -0.431 . . . . 60.219999999999999 111.441 -179.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -59.69 -43.11 94.19 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.318 -0.553 . . . . 82.409999999999997 111.058 -178.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' ARG . . . . . . . . . . . . . 30.6 mtp85 -64.26 -36.48 84.23 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.166 -0.614 . . . . 82.909999999999997 111.039 177.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 34.1 mt -70.03 -46.36 65.22 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.239 -0.585 . . . . 53.340000000000003 110.961 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.76 -41.12 94.83 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.239 -0.584 . . . . 66.709999999999994 111.124 -179.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -63.27 -39.64 95.14 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.11 -0.636 . . . . 66.640000000000001 111.003 175.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -63.7 -44.4 93.79 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.269 -0.572 . . . . 70.780000000000001 110.851 178.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' MET . . . . . 0.422 ' HE2' HD21 ' D' ' 136' ' ' LEU . 86.6 mtp -57.57 -43.7 84.74 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.327 -0.549 . . . . 53.700000000000003 111.039 176.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.24 -46.27 88.94 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.553 -0.459 . . . . 41.640000000000001 111.13 -177.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' GLU . . . . . 0.611 ' OE1' ' NH2' ' B' ' 105' ' ' ARG . 24.4 tp10 -64.13 -37.4 87.33 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.384 -0.526 . . . . 79.120000000000005 111.021 -178.548 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 39.3 mt -61.85 -43.27 97.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 C-N-CA 120.628 -0.429 . . . . 55.57 110.443 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' MET . . . . . . . . . . . . . 82.6 mmm -65.03 -39.01 92.74 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.309 -0.556 . . . . 49.57 111.138 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' ARG . . . . . 0.611 ' NH2' ' OE1' ' B' ' 102' ' ' GLU . 88.9 mtm-85 -66.51 -36.11 81.9 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 119.961 -0.696 . . . . 93.150000000000006 110.968 176.249 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . . . -70.79 -43.06 69.48 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.308 -0.557 . . . . 81.540000000000006 111.073 177.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 39.8 mt -56.25 -51.35 64.21 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 CA-C-O 121.247 0.546 . . . . 41.039999999999999 110.155 174.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' LYS . . . . . 0.594 ' O ' ' O ' ' B' ' 301' ' ' HOH . 3.9 ttmt -54.32 -37.67 65.12 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 122.039 -0.413 . . . . 63.990000000000002 111.439 -179.616 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' LYS . . . . . . . . . . . . . 75.1 mttt -74.91 -40.5 60.84 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.522 -0.471 . . . . 64.109999999999999 111.303 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 23.2 mt -58.25 -40.93 83.06 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.214 -0.594 . . . . 51.670000000000002 111.022 177.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 67.2 mt -66.89 -42.38 85.6 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.263 -0.575 . . . . 48.530000000000001 111.269 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' LYS . . . . . . . . . . . . . . . -63.54 -41.78 98.44 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.1 -0.64 . . . . 53.350000000000001 110.971 177.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . . . -65.69 -40.79 92.67 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.472 -0.491 . . . . 50.399999999999999 111.25 178.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.33 -42.77 96.13 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.487 -0.485 . . . . 48.840000000000003 111.13 178.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' ARG . . . . . 0.778 ' NH2' ' OE1' ' D' ' 119' ' ' GLU . 28.7 ttt85 -59.78 -44.22 94.01 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.545 -0.462 . . . . 104.90000000000001 110.991 176.653 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . -59.4 -43.28 97.53 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 120.053 -1.07 . . . . 42.899999999999999 112.516 176.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' ALA . . . . . . . . . . . . . . . -67.4 -39.64 85.57 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 122.236 -0.567 . . . . 61.119999999999997 111.31 -178.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -67.35 -43.24 82.0 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.881 -0.728 . . . . 55.939999999999998 111.143 177.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . . . -57.63 -37.06 72.68 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.041 -0.664 . . . . 54.920000000000002 110.929 176.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 22.3 tptt -62.56 -48.0 81.4 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.817 0.341 . . . . 72.150000000000006 110.914 177.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 2.7 t -62.03 -45.94 97.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 121.018 0.437 . . . . 46.560000000000002 110.516 179.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 2.6 mt -63.45 -33.91 76.6 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.817 -0.552 . . . . 64.609999999999999 111.657 178.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -58.99 -46.27 88.57 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.409 -0.516 . . . . 60.57 110.776 172.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -70.82 -43.54 68.38 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.568 -0.453 . . . . 79.329999999999998 111.459 -178.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 47.2 mt -55.32 -40.43 71.14 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.341 -0.544 . . . . 47.75 111.041 174.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' ARG . . . . . . . . . . . . . 3.0 tmm_? -61.12 -41.06 96.01 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.973 -0.291 . . . . 134.59 111.144 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' LYS . . . . . . . . . . . . . . . -70.99 -39.0 72.73 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.459 -0.496 . . . . 50.960000000000001 111.235 -179.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' ILE . . . . . . . . . . . . . 96.4 mt -59.94 -37.04 70.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 120.952 0.406 . . . . 48.350000000000001 110.419 178.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' ILE . . . . . . . . . . . . . 34.0 mt -72.48 -36.87 55.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 C-N-CA 120.351 -0.54 . . . . 42.350000000000001 110.737 -176.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -69.99 -27.46 64.72 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.538 -0.865 . . . . 69.450000000000003 111.407 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -68.47 -46.72 69.01 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.468 -0.493 . . . . 67.290000000000006 110.433 170.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' ILE . . . . . . . . . . . . . 74.1 mt -56.06 -49.53 75.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-O 121.14 0.495 . . . . 41.159999999999997 110.28 177.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' ARG . . . . . . . . . . . . . 64.0 mtp180 -64.19 -35.77 81.88 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.182 -0.607 . . . . 65.209999999999994 111.457 -177.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -63.9 -37.21 86.54 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 119.814 -0.754 . . . . 60.609999999999999 110.841 173.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' LEU . . . . . . . . . . . . . 39.7 mt -65.35 -27.75 68.81 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.303 -0.559 . . . . 49.340000000000003 111.355 176.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 74.9 mt -79.3 -25.0 42.49 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.153 0.427 . . . . 44.329999999999998 112.153 175.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -61.02 -48.86 79.85 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.059 -0.656 . . . . 66.620000000000005 110.354 169.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' ARG . . . . . . . . . . . . . 11.6 tpt180 -64.89 -40.66 95.46 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.077 -0.649 . . . . 79.269999999999996 110.942 177.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 32.9 t -55.94 -44.68 78.64 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.222 -0.591 . . . . 46.960000000000001 110.936 176.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 85.4 mtt-85 -64.25 -38.89 92.66 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.233 -0.587 . . . . 78.469999999999999 111.107 176.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' LYS . . . . . . . . . . . . . 30.8 mmtt -61.31 -42.93 99.49 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.303 -0.559 . . . . 61.079999999999998 110.866 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 71.2 mt -61.75 -50.04 81.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 121.085 0.469 . . . . 46.240000000000002 110.167 178.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' HIS . . . . . 0.508 ' ND1' ' OE1' ' D' ' 90' ' ' GLN . 47.9 t60 -56.09 -48.66 75.72 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.401 -0.52 . . . . 77.75 110.869 175.514 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -55.38 -43.43 75.15 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.797 -0.361 . . . . 71.530000000000001 111.118 178.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -67.34 -36.76 82.06 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 120.407 -0.517 . . . . 44.68 111.069 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' SER . . . . . . . . . . . . . 4.4 m -62.39 -42.4 99.4 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.389 -0.524 . . . . 52.350000000000001 111.298 179.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.21 -41.06 98.04 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.959 -0.697 . . . . 70.700000000000003 110.853 177.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -50.42 -53.01 32.66 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.014 0.435 . . . . 73.459999999999994 111.003 174.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' ILE . . . . . . . . . . . . . 78.0 mt -61.37 -35.76 68.52 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-O 120.844 0.354 . . . . 53.100000000000001 110.717 -175.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -73.04 -32.26 64.95 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.444 -0.502 . . . . 77.75 111.79 -179.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' TYR . . . . . . . . . . . . . . . -58.59 -48.07 82.19 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.447 -0.501 . . . . 91.590000000000003 110.896 178.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.276 0 O-C-N 122.149 -0.344 . . . . 90.25 110.745 178.381 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 0' ' ' FME . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' THR . . . . . . . . . . . . . 19.9 p -75.39 164.08 26.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.392 -1.277 . . . . 65.590000000000003 110.814 -179.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' ARG . . . . . . . . . . . . . 53.7 ttt85 -53.39 -46.35 69.64 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.097 -0.501 . . . . 58.539999999999999 110.803 175.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' GLU . . . . . . . . . . . . . 48.2 tt0 -57.93 -36.49 72.57 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.606 -0.438 . . . . 85.290000000000006 111.233 -179.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -72.96 -40.55 65.25 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.506 -0.478 . . . . 67.219999999999999 111.372 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' LEU . . . . . 0.66 HD22 HG23 ' D' ' 149' ' ' ILE . 1.6 mt -62.97 -40.48 97.84 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.562 -0.455 . . . . 52.049999999999997 111.254 179.67 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' LEU . . . . . 0.473 HD21 ' NH1' ' A' ' 76' ' ' ARG . 87.4 mt -66.29 -38.05 86.87 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.012 -0.675 . . . . 68.430000000000007 111.152 178.064 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' ARG . . . . . . . . . . . . . . . -62.23 -37.63 86.14 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.125 -0.63 . . . . 62.060000000000002 110.69 174.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -67.59 -39.29 84.83 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.714 -0.394 . . . . 57.049999999999997 111.079 178.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -56.56 -45.87 81.04 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.477 -0.489 . . . . 61.920000000000002 110.865 175.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' ILE . . . . . . . . . . . . . 69.5 mt -60.19 -49.23 84.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 CA-C-O 121.255 0.55 . . . . 57.259999999999998 110.254 177.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . . . -60.22 -46.05 91.09 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.946 -0.471 . . . . 74.689999999999998 111.155 -178.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' LEU . . . . . . . . . . . . . 14.9 mt -60.27 -39.76 87.95 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.082 -0.647 . . . . 48.719999999999999 111.022 178.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.55 96.17 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.448 -0.501 . . . . 46.640000000000001 111.199 179.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -66.07 -50.79 62.9 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.221 -0.592 . . . . 80.549999999999997 110.951 176.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' GLU . . . . . 0.46 ' HG2' HD11 ' D' ' 142' ' ' ILE . 63.4 tt0 -54.33 -40.57 68.13 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.497 -0.481 . . . . 56.020000000000003 110.931 176.146 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -58.84 -44.37 90.93 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.708 -0.397 . . . . 58.810000000000002 110.984 175.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' ILE . . . . . . . . . . . . . 12.0 mt -64.58 -48.44 84.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-O 121.112 0.482 . . . . 54.829999999999998 110.383 -179.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 30.2 tp10 -60.23 -38.22 82.74 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 121.863 -0.523 . . . . 93.469999999999999 111.108 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' ILE . . . . . . . . . . . . . 26.4 mt -59.2 -54.24 36.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-O 121.232 0.539 . . . . 50.43 110.123 175.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' MET . . . . . 0.586 ' HE2' HD12 ' C' ' 23' ' ' ILE . 35.6 mmt -56.01 -38.42 70.47 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 122.07 -0.394 . . . . 73.689999999999998 111.334 179.643 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . . . -61.1 -42.03 97.78 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.202 -0.599 . . . . 51.579999999999998 110.99 176.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -67.32 -38.54 85.1 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.102 -0.639 . . . . 72.140000000000001 111.099 179.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' ILE . . . . . 0.586 HD12 ' HE2' ' C' ' 20' ' ' MET . 40.3 mt -58.48 -57.32 11.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 C-N-CA 120.411 -0.516 . . . . 48.289999999999999 109.946 176.429 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' LEU . . . . . . . . . . . . . . . -50.39 -41.15 51.62 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 122.127 -0.358 . . . . 67.450000000000003 111.206 179.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -62.41 -40.27 95.99 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.344 -0.543 . . . . 64.870000000000005 110.99 174.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' LEU . . . . . 0.473 HD22 HG23 ' D' ' 128' ' ' ILE . 10.3 mt -72.04 -26.4 62.18 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.425 -0.51 . . . . 55.289999999999999 111.524 179.506 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' LEU . . . . . . . . . . . . . 62.3 mt -74.4 -29.91 61.73 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.454 -0.498 . . . . 47.670000000000002 111.224 175.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -56.81 -51.8 67.54 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.597 -0.441 . . . . 69.319999999999993 110.751 170.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' LYS . . . . . . . . . . . . . . . -60.11 -39.27 85.6 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.775 -0.37 . . . . 48.460000000000001 111.275 -177.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' MET . . . . . . . . . . . . . 84.0 mtp -57.83 -42.54 84.58 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.055 -0.658 . . . . 46.539999999999999 110.963 176.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.21 -45.81 83.25 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.687 -0.405 . . . . 65.120000000000005 110.97 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -62.74 -38.77 91.82 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.453 -0.499 . . . . 71.980000000000004 111.248 -178.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' LEU . . . . . . . . . . . . . 40.1 mt -68.66 -42.85 77.32 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.052 -0.659 . . . . 51.460000000000001 111.156 176.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.485 HD11 HG21 ' A' ' 48' ' ' ILE . 55.0 mt -61.9 -38.67 89.25 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.164 -0.615 . . . . 52.340000000000003 111.018 175.808 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -64.5 -46.89 81.02 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.541 -0.464 . . . . 61.32 110.988 177.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' LYS . . . . . . . . . . . . . 24.5 ttpt -59.57 -55.94 28.16 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.54 -0.464 . . . . 71.0 111.038 179.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' ALA . . . . . 0.468 ' HB2' HG21 ' D' ' 121' ' ' VAL . . . -53.76 -38.7 64.68 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.467 -0.493 . . . . 44.979999999999997 111.271 -179.913 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' ARG . . . . . . . . . . . . . 40.6 ttp85 -62.17 -39.41 92.57 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 120.092 -0.643 . . . . 70.879999999999995 110.894 174.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' GLY . . . . . . . . . . . . . . . -71.01 -41.43 61.05 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.127 -1.035 . . . . 46.25 112.597 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.68 -41.55 97.72 Favored 'General case' 0 C--O 1.237 0.409 0 O-C-N 122.171 -0.605 . . . . 45.509999999999998 111.033 178.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -70.05 -28.01 65.11 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.218 -0.593 . . . . 49.210000000000001 111.596 178.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -69.62 -39.5 77.16 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.106 -0.637 . . . . 68.579999999999998 110.921 175.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -59.87 -56.23 24.33 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.195 0.521 . . . . 65.469999999999999 110.835 175.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' VAL . . . . . . . . . . . . . 79.6 t -58.81 -42.39 85.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 C-N-CA 120.741 -0.384 . . . . 51.549999999999997 110.601 -176.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.69 -49.3 78.09 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 120.044 -0.663 . . . . 43.229999999999997 110.764 178.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -59.22 -46.05 89.48 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.412 -0.515 . . . . 76.650000000000006 110.829 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' THR . . . . . . . . . . . . . 92.5 m -58.19 -41.91 84.97 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.728 -0.389 . . . . 57.479999999999997 111.25 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' ILE . . . . . . . . . . . . . 35.9 mt -65.51 -39.38 84.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 120.496 -0.482 . . . . 48.689999999999998 110.796 -178.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -59.38 -41.67 89.9 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.749 -0.78 . . . . 74.359999999999999 110.755 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -59.95 -39.46 85.67 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.498 -0.481 . . . . 80.650000000000006 111.065 176.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 83.5 mt -69.41 -49.03 58.98 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.391 -0.524 . . . . 46.75 111.06 178.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' LEU . . . . . . . . . . . . . 80.4 mt -59.11 -39.88 83.66 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.252 -0.579 . . . . 45.560000000000002 110.963 175.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' ARG . . . . . . . . . . . . . 18.1 ttp85 -58.32 -48.56 80.15 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.332 -0.547 . . . . 70.180000000000007 110.678 176.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -61.77 -36.91 82.41 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.712 -0.395 . . . . 88.620000000000005 111.069 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' LEU . . . . . 0.408 ' HG ' HG21 ' D' ' 103' ' ' ILE . 13.6 mt -61.7 -51.55 67.91 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.374 -0.53 . . . . 49.159999999999997 111.171 178.64 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -53.57 -40.56 65.72 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.442 -0.503 . . . . 49.43 110.975 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' GLU . . . . . . . . . . . . . 62.7 tt0 -61.5 -42.13 98.34 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.803 -0.359 . . . . 63.289999999999999 111.145 176.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' ILE . . . . . 0.441 HG21 ' HG3' ' D' ' 100' ' ' MET . 58.0 mt -65.93 -45.06 92.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-O 121.04 0.447 . . . . 55.770000000000003 110.578 178.071 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' ILE . . . . . . . . . . . . . 53.1 mt -61.58 -40.27 85.99 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 O-C-N 121.929 -0.482 . . . . 57.960000000000001 110.7 -174.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 36.3 tp10 -59.93 -36.35 76.86 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.065 -0.654 . . . . 81.950000000000003 110.985 178.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' ARG . . . . . . . . . . . . . 29.6 tpt180 -67.83 -45.04 75.81 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.482 -0.487 . . . . 62.0 111.087 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -58.69 -41.55 86.51 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.221 -0.591 . . . . 59.109999999999999 111.396 -179.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -67.71 -32.15 72.59 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 119.704 -0.798 . . . . 82.170000000000002 111.462 178.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' ARG . . . . . . . . . . . . . 28.9 mtp180 -64.56 -36.63 84.83 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.13 -0.628 . . . . 85.659999999999997 110.773 169.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' ILE . . . . . . . . . . . . . 4.3 mt -72.74 -47.4 50.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 C-N-CA 120.669 -0.412 . . . . 52.469999999999999 110.419 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.0 -40.22 76.17 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.223 -0.591 . . . . 54.200000000000003 111.034 177.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 67' ' ' LYS . . . . . . . . . . . . . . . -59.79 -43.38 94.44 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.257 -0.577 . . . . 63.039999999999999 111.073 176.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 68' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -62.51 -41.87 99.13 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.138 -0.625 . . . . 70.909999999999997 110.95 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 69' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -59.18 -44.57 92.17 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.423 -0.511 . . . . 45.899999999999999 110.877 177.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -51.0 -50.98 57.46 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.268 -0.573 . . . . 56.590000000000003 110.354 170.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 71' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -59.19 -49.12 79.08 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.878 -0.329 . . . . 90.599999999999994 111.25 -177.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 72' ' ' ILE . . . . . . . . . . . . . 54.3 mt -62.22 -47.15 94.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.236 -0.586 . . . . 63.810000000000002 110.518 -176.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.95 -39.07 71.21 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.427 -0.509 . . . . 63.009999999999998 111.226 -179.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 74' ' ' ARG . . . . . . . . . . . . . 24.1 mtt-85 -72.99 -30.08 63.53 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.353 -0.539 . . . . 72.75 111.552 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 75' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -76.48 -28.0 56.32 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 112.065 0.394 . . . . 81.469999999999999 112.065 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 76' ' ' ARG . . . . . . . . . . . . . 63.6 mtp180 -80.28 -29.81 38.27 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 112.549 0.574 . . . . 66.159999999999997 112.549 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 77' ' ' SER . . . . . . . . . . . . . 57.1 p . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 118.107 0.412 . . . . 83.650000000000006 111.376 -175.785 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 78' ' ' THR . . . . . . . . . . . . . 13.9 p . . . . . 0 C--O 1.232 0.134 0 N-CA-C 111.737 0.273 . . . . 78.260000000000005 111.737 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 79' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -65.21 -48.76 72.24 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.496 -0.481 . . . . 81.469999999999999 110.991 178.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 80' ' ' ARG . . . . . . . . . . . . . . . -64.73 -38.76 92.09 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.47 -0.492 . . . . 71.349999999999994 111.207 178.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 81' ' ' LYS . . . . . . . . . . . . . . . -60.23 -56.26 23.66 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.025 0.44 . . . . 61.210000000000001 110.77 179.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 82' ' ' LEU . . . . . . . . . . . . . 46.0 mt -57.7 -42.21 83.26 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.405 -0.518 . . . . 58.359999999999999 111.139 177.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 83' ' ' LEU . . . . . . . . . . . . . 21.3 tp -66.14 -39.4 89.83 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.65 -0.42 . . . . 54.75 111.269 -178.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 84' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -67.11 -38.04 84.95 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.482 -0.487 . . . . 71.379999999999995 111.116 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 85' ' ' ARG . . . . . . . . . . . . . . . -64.35 -40.28 95.55 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.328 -0.549 . . . . 78.069999999999993 110.994 179.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 3.7 p -65.23 -40.97 94.79 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.096 -0.641 . . . . 60.93 111.063 179.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 87' ' ' ARG . . . . . . . . . . . . . 65.1 mtt85 -59.59 -41.79 91.08 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 120.087 -0.645 . . . . 73.260000000000005 110.935 177.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 88' ' ' ARG . . . . . . . . . . . . . . . -56.58 -46.87 80.57 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.603 -0.439 . . . . 63.799999999999997 110.901 176.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 66.1 mt -68.34 -34.93 77.0 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.224 -0.59 . . . . 52.119999999999997 111.769 -176.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 90' ' ' GLN . . . . . 0.508 ' OE1' ' ND1' ' B' ' 143' ' ' HIS . 39.6 mm-40 -60.13 -47.92 83.87 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.883 -0.727 . . . . 67.450000000000003 110.607 173.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 91' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -56.48 -41.28 76.31 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.261 -0.575 . . . . 64.140000000000001 111.103 177.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 92' ' ' GLU . . . . . . . . . . . . . 68.9 tt0 -63.15 -44.38 95.66 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.052 -0.659 . . . . 68.620000000000005 110.831 175.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 93' ' ' SER . . . . . . . . . . . . . 4.1 m -56.69 -46.87 80.93 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.647 -0.421 . . . . 53.130000000000003 111.018 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 94' ' ' LYS . . . . . . . . . . . . . . . -53.69 -49.58 67.71 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.387 -0.525 . . . . 53.590000000000003 110.718 179.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 95' ' ' ARG . . . . . . . . . . . . . . . -57.24 -40.29 77.29 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.509 -0.477 . . . . 57.030000000000001 111.211 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 90.5 mt -72.04 -43.57 64.76 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.237 -0.585 . . . . 53.32 111.232 -177.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 97' ' ' LEU . . . . . . . . . . . . . 77.5 mt -57.3 -41.11 79.2 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 119.851 -0.74 . . . . 49.289999999999999 110.677 175.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 98' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -58.08 -49.47 76.79 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.789 -0.364 . . . . 61.539999999999999 111.096 176.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 99' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -64.26 -31.34 72.5 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 119.699 -0.8 . . . . 60.700000000000003 111.471 -178.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 100' ' ' MET . . . . . 0.441 ' HG3' HG21 ' C' ' 58' ' ' ILE . 46.6 mtp -67.67 -48.29 67.05 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.116 -0.634 . . . . 48.119999999999997 110.868 176.885 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.27 -36.67 78.34 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.44 -0.504 . . . . 49.170000000000002 111.06 178.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 49.9 tt0 -69.82 -32.26 70.6 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.667 -0.413 . . . . 82.340000000000003 111.357 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 103' ' ' ILE . . . . . 0.408 HG21 ' HG ' ' C' ' 55' ' ' LEU . 22.8 mt -74.38 -38.25 46.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 120.294 -0.562 . . . . 40.469999999999999 110.618 179.951 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 104' ' ' MET . . . . . . . . . . . . . 83.4 mmm -65.08 -46.46 81.03 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.171 -0.611 . . . . 41.93 110.842 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 105' ' ' ARG . . . . . . . . . . . . . . . -58.71 -33.11 69.83 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.443 -0.503 . . . . 44.979999999999997 111.313 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 106' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -72.05 -43.47 64.88 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.103 -0.639 . . . . 66.040000000000006 111.061 179.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 107' ' ' ILE . . . . . . . . . . . . . 54.7 mt -57.16 -41.33 77.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 120.347 -0.541 . . . . 50.450000000000003 110.237 177.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 108' ' ' LYS . . . . . . . . . . . . . 27.0 mtpt -55.45 -51.74 65.92 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 121.959 -0.463 . . . . 63.909999999999997 110.956 172.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 109' ' ' LYS . . . . . . . . . . . . . . . -57.48 -39.42 76.35 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.577 -0.449 . . . . 48.100000000000001 111.233 -179.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 110' ' ' LEU . . . . . . . . . . . . . 35.0 mt -68.26 -41.4 81.16 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.027 -0.669 . . . . 71.170000000000002 111.384 -179.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 111' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.72 -42.49 95.2 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.386 -0.526 . . . . 45.390000000000001 111.212 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 112' ' ' LYS . . . . . . . . . . . . . . . -60.24 -43.44 96.08 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.185 -0.606 . . . . 49.939999999999998 110.881 175.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 113' ' ' LYS . . . . . . . . . . . . . 42.5 tttt -59.7 -54.74 42.88 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.84 0.352 . . . . 56.43 110.948 179.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 114' ' ' ALA . . . . . . . . . . . . . . . -57.02 -41.8 79.2 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.634 -0.426 . . . . 50.810000000000002 111.209 -178.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 115' ' ' ARG . . . . . . . . . . . . . 48.9 ttt180 -62.43 -46.08 90.2 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.365 -0.534 . . . . 99.599999999999994 110.91 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 116' ' ' GLY . . . . . . . . . . . . . . . -58.5 -43.83 95.74 Favored Glycine 0 C--N 1.334 0.424 0 C-N-CA 119.895 -1.145 . . . . 42.369999999999997 112.448 177.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 117' ' ' ALA . . . . . . . . . . . . . . . -64.77 -38.45 91.01 Favored 'General case' 0 C--O 1.238 0.455 0 O-C-N 122.233 -0.569 . . . . 42.670000000000002 111.238 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 118' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -66.05 -35.29 80.14 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.18 -0.608 . . . . 59.049999999999997 111.185 176.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 119' ' ' GLU . . . . . 0.778 ' OE1' ' NH2' ' B' ' 115' ' ' ARG . 25.9 mm-40 -64.44 -39.45 93.85 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.487 -0.485 . . . . 91.950000000000003 111.094 177.371 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 120' ' ' LYS . . . . . . . . . . . . . . . -64.79 -43.07 94.41 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.553 -0.459 . . . . 53.93 111.005 176.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 121' ' ' VAL . . . . . 0.468 HG21 ' HB2' ' C' ' 37' ' ' ALA . 40.6 t -62.09 -41.16 90.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 C-N-CA 120.375 -0.53 . . . . 51.25 110.421 177.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 122' ' ' LEU . . . . . . . . . . . . . 9.9 mt -65.91 -44.14 86.1 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 121.91 -0.494 . . . . 50.240000000000002 111.333 178.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 123' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -57.03 -48.44 78.5 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.599 -0.44 . . . . 66.030000000000001 110.922 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 124' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -57.62 -54.08 50.9 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.322 -0.551 . . . . 76.709999999999994 110.63 176.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 125' ' ' LEU . . . . . . . . . . . . . 30.6 mt -48.4 -43.83 34.4 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 122.204 -0.31 . . . . 43.469999999999999 111.697 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 126' ' ' ARG . . . . . . . . . . . . . 23.9 ttp-105 -58.79 -47.39 84.92 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 120.014 -0.674 . . . . 66.780000000000001 110.725 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 127' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -64.09 -38.11 89.86 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.189 -0.604 . . . . 75.159999999999997 111.288 -178.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 128' ' ' ILE . . . . . 0.473 HG23 HD22 ' C' ' 26' ' ' LEU . 7.2 mt -64.13 -41.84 93.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 C-N-CA 120.174 -0.61 . . . . 45.609999999999999 110.191 177.578 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 129' ' ' ILE . . . . . . . . . . . . . 37.3 mt -62.68 -36.4 75.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 C-N-CA 120.43 -0.508 . . . . 49.5 110.515 -178.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 130' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -77.6 -31.68 53.1 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.034 -0.666 . . . . 76.379999999999995 112.094 -177.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 131' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -65.73 -41.39 92.26 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.771 -0.772 . . . . 74.390000000000001 110.465 169.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 132' ' ' ILE . . . . . . . . . . . . . 44.5 mt -58.49 -55.71 20.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-O 121.343 0.592 . . . . 39.240000000000002 110.091 174.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 133' ' ' ARG . . . . . . . . . . . . . 44.5 mtp180 -62.44 -30.52 71.29 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.197 -0.601 . . . . 85.989999999999995 111.523 -177.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 134' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -62.91 -37.85 88.64 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.016 -0.674 . . . . 69.159999999999997 110.603 170.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 135' ' ' LEU . . . . . . . . . . . . . 85.1 mt -68.87 -35.49 76.95 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.42 -0.512 . . . . 48.700000000000003 110.996 177.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 136' ' ' LEU . . . . . 0.422 HD21 ' HE2' ' B' ' 100' ' ' MET . 87.0 mt -68.07 -27.35 66.43 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.828 -0.749 . . . . 47.850000000000001 111.432 175.714 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 137' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -66.48 -48.16 70.74 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.439 -0.504 . . . . 79.420000000000002 110.706 173.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 138' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -62.54 -42.5 99.57 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.121 -0.632 . . . . 62.140000000000001 110.854 177.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 139' ' ' SER . . . . . . . . . . . . . 27.3 t -57.13 -40.25 76.74 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.136 -0.626 . . . . 47.640000000000001 111.021 176.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 140' ' ' ARG . . . . . . . . . . . . . . . -65.09 -32.98 74.96 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.224 -0.59 . . . . 57.009999999999998 111.544 177.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 141' ' ' LYS . . . . . . . . . . . . . 20.1 mmtt -68.67 -43.78 75.42 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.082 -0.647 . . . . 71.989999999999995 110.928 175.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 142' ' ' ILE . . . . . 0.46 HD11 ' HG2' ' C' ' 15' ' ' GLU . 93.3 mt -56.28 -48.17 79.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 120.341 -0.543 . . . . 49.299999999999997 110.156 178.024 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 143' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -64.04 -40.19 95.74 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.621 -0.832 . . . . 67.840000000000003 111.091 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 144' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -58.9 -50.65 73.23 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.405 -0.518 . . . . 79.879999999999995 110.657 176.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 145' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -58.92 -41.46 87.34 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.716 -0.394 . . . . 51.329999999999998 111.058 176.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 146' ' ' SER . . . . . . . . . . . . . 5.7 m -62.83 -36.82 84.44 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.257 -0.577 . . . . 59.909999999999997 111.075 177.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 147' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -65.48 -37.8 87.9 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.302 -0.559 . . . . 66.25 110.926 175.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 148' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -62.27 -47.17 85.54 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 120.843 0.354 . . . . 67.129999999999995 111.43 179.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 149' ' ' ILE . . . . . 0.66 HG23 HD22 ' C' ' 5' ' ' LEU . 41.6 mt -57.53 -23.63 20.24 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 111.64 0.237 . . . . 74.019999999999996 111.64 -169.831 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 150' ' ' ALA . . . . . . . . . . . . . . . -102.76 13.89 33.31 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.966 0.728 . . . . 106.87 112.966 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 151' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 118.368 0.531 . . . . 99.319999999999993 111.123 178.909 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . 0.464 ' O ' ' NH1' ' A' ' 7' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' HOH . . . . . 0.594 ' O ' ' O ' ' B' ' 108' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_