data_3exc_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 3exc _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' X' X ' 1' ' ' MSE . . . . . . . . . . . . . 1.6 mmt . . . . . 0 CA--C 1.579 2.084 0 N-CA-C 116.403 2.001 . . . . 99.5 116.403 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.0 171.22 7.58 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 122.554 1.168 . . . . 49.380000000000003 113.558 177.559 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 3' ' ' LEU . . . . . . . . . . . . . 1.9 pp -147.35 154.9 41.48 Favored 'General case' 0 CA--C 1.447 -2.996 0 C-N-CA 118.434 -1.306 . . . . 45.409999999999997 111.099 162.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 4' ' ' LEU . . . . . . . . . . . . 0.29 96.1 mt -114.34 140.1 48.91 Favored 'General case' 0 C--O 1.25 1.113 0 O-C-N 125.029 1.456 . . . . 49.130000000000003 107.344 175.911 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 5' ' ' VAL . . . . . . . . . . . . . 66.9 t -118.95 121.98 68.2 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.189 0 N-CA-C 104.549 -2.389 . . . . 33.289999999999999 104.549 168.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 6' ' ' VAL . . . . . . . . . . . . . 59.5 t -119.18 130.1 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.856 0 N-CA-C 107.314 -1.365 . . . . 30.859999999999999 107.314 177.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 7' ' ' TYR . . . . . . . . . . . . . 34.3 p90 -129.73 158.46 39.33 Favored 'General case' 0 C--O 1.279 2.629 0 N-CA-C 116.008 1.855 . . . . 36.439999999999998 116.008 -177.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 8' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -137.78 90.03 2.46 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 101.433 -3.543 . . . . 38.5 101.433 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 9' ' ' VAL . . . . . 0.634 ' O ' ' NH1' ' X' ' 15' ' ' ARG . 55.8 t -113.94 111.72 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.35 0 CA-C-N 114.632 -1.167 . . . . 37.229999999999997 108.692 -175.18 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 10' ' ' SER . . . . . . . . . . . . . 4.5 m -60.32 -57.28 13.44 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 116.569 2.063 . . . . 45.869999999999997 116.569 -179.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 11' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -60.54 110.12 1.2 Allowed 'General case' 0 CA--C 1.578 2.028 0 N-CA-C 114.775 1.398 . . . . 55.719999999999999 114.775 177.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -38.71 -43.34 0.89 Allowed 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 125.36 1.464 . . . . 55.020000000000003 113.982 175.331 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 11.6 t -75.29 -37.73 60.72 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 113.333 0.864 . . . . 48.600000000000001 113.333 -175.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 14' ' ' LYS . . . . . . . . . . . . . 13.7 mttm -66.79 -38.64 86.92 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-O 119.012 -0.518 . . . . 56.060000000000002 110.472 174.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 15' ' ' ARG . . . . . 0.634 ' NH1' ' O ' ' X' ' 9' ' ' VAL . 12.0 ttp-105 -56.1 -43.8 78.42 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 113.306 0.854 . . . . 64.0 113.306 177.639 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 16' ' ' ASN . . . . . 0.643 ' N ' ' ND2' ' X' ' 16' ' ' ASN . 0.0 OUTLIER -88.29 -19.94 26.09 Favored 'General case' 0 CA--C 1.506 -0.734 0 C-N-CA 113.874 -3.13 . . . . 52.310000000000002 116.657 -179.601 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' X' X ' 17' ' ' LYS . . . . . . . . . . . . . 34.0 tttt -52.61 -47.35 67.01 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 119.469 -0.892 . . . . 37.659999999999997 110.375 160.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 53.8 tp -63.54 -49.17 74.54 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 119.076 -0.488 . . . . 31.609999999999999 111.388 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.09 -44.91 71.62 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 108.903 -0.777 . . . . 34.829999999999998 108.903 176.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 20' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -62.8 -43.83 97.76 Favored 'General case' 0 CA--C 1.5 -0.976 0 O-C-N 123.253 0.345 . . . . 47.130000000000003 111.784 -178.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -70.6 -39.62 73.71 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 117.279 2.326 . . . . 37.909999999999997 117.279 178.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 22' ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.11 -42.4 76.78 Favored 'General case' 0 CA--C 1.568 1.658 0 CA-C-O 118.726 -0.654 . . . . 35.25 112.528 168.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 23' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -61.65 -45.18 95.14 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 120.266 1.394 . . . . 52.619999999999997 107.889 175.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 24' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -57.38 -37.55 72.84 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 120.556 -0.458 . . . . 48.5 111.794 -175.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 25' ' ' LEU . . . . . . . . . . . . . 28.8 mt -77.63 8.98 3.73 Favored 'General case' 0 C--O 1.257 1.496 0 CA-C-O 119.181 -0.438 . . . . 42.710000000000001 111.049 179.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 79.54 9.05 87.28 Favored Glycine 0 CA--C 1.544 1.902 0 N-CA-C 121.168 3.227 . . . . 40.310000000000002 121.168 -174.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 27' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.57 160.26 28.7 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 119.722 -2.046 . . . . 42.939999999999998 109.627 173.666 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 28' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -118.2 136.28 53.74 Favored 'General case' 0 CA--C 1.494 -1.2 0 CA-C-N 117.903 0.319 . . . . 60.009999999999998 111.0 -177.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 29' ' ' ARG . . . . . . . . . . . . . 49.2 ttm-85 -68.52 130.79 43.91 Favored 'General case' 0 C--O 1.193 -1.905 0 C-N-CA 118.203 -1.399 . . . . 47.119999999999997 111.369 179.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 30' ' ' ILE . . . . . . . . . . . . . 43.9 pt -111.68 -21.4 5.61 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.809 0 CA-C-O 118.255 -0.879 . . . . 33.840000000000003 111.216 172.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 31' ' ' GLN . . . . . . . . . . . . 0.371 52.2 mt-30 -155.34 176.71 12.22 Favored 'General case' 0 CA--C 1.464 -2.354 0 N-CA-C 107.109 -1.441 . . . . 35.030000000000001 107.109 177.182 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 32' ' ' ARG . . . . . . . . . . . . . 12.5 ttt85 -51.43 -34.96 37.21 Favored 'General case' 0 C--O 1.251 1.156 0 N-CA-C 115.412 1.634 . . . . 61.43 115.412 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 33' ' ' SER . . . . . . . . . . . . . 27.5 m -133.5 43.22 2.92 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 114.485 -2.886 . . . . 39.630000000000003 111.192 179.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 34' ' ' ALA . . . . . . . . . . . . . . . -152.57 140.13 19.74 Favored 'General case' 0 C--O 1.215 -0.762 0 N-CA-C 107.339 -1.356 . . . . 31.390000000000001 107.339 -175.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 35' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -134.58 155.96 49.53 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 106.766 -1.568 . . . . 32.649999999999999 106.766 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -133.26 157.85 44.39 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 109.192 -0.67 . . . . 55.399999999999999 109.192 171.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 37' ' ' GLY . . . . . . . . . . . . . . . -168.07 177.47 42.24 Favored Glycine 0 C--O 1.214 -1.122 0 N-CA-C 106.293 -2.723 . . . . 43.469999999999999 106.293 -179.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 38' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -98.77 138.13 36.37 Favored 'General case' 0 N--CA 1.421 -1.886 0 N-CA-C 109.199 -0.667 . . . . 55.880000000000003 109.199 -179.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 39' ' ' MSE . . . . . . . . . . . . . 0.1 OUTLIER -33.64 119.64 0.38 Allowed 'General case' 0 CA--C 1.576 1.96 0 N-CA-C 120.454 3.501 . . . . 105.18000000000001 120.454 153.92 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 40' ' ' ASP . . . . . 0.522 ' C ' ' O ' ' X' ' 128' ' ' HOH . 9.9 m-20 . . . . . 0 C--O 1.26 1.633 0 N-CA-C 118.99 2.959 . . . . 68.049999999999997 118.99 -164.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.612 0 N-CA-C 112.76 0.652 . . . . 66.090000000000003 112.76 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 44' ' ' MSE . . . . . . . . . . . . . 1.1 tpt -52.23 -52.96 49.38 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.482 -0.761 . . . . 94.659999999999997 110.66 -172.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 45' ' ' LYS . . . . . . . . . . . . . 6.1 tptm -60.09 -35.94 76.3 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 123.529 0.518 . . . . 64.040000000000006 111.28 -175.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -68.64 -40.49 80.23 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 115.037 1.495 . . . . 59.420000000000002 115.037 174.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 47' ' ' LEU . . . . . . . . . . . . . 60.7 tp -54.25 -52.8 60.22 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 124.829 1.33 . . . . 44.090000000000003 111.774 172.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 48' ' ' VAL . . . . . . . . . . . . . 69.5 t -62.57 -43.58 98.58 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.178 0 C-N-CA 120.361 -0.536 . . . . 40.719999999999999 110.889 -179.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.9 -46.63 89.89 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 108.66 -0.867 . . . . 49.640000000000001 108.66 179.975 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 50' ' ' VAL . . . . . . . . . . . . . 4.0 t -55.91 -50.52 68.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 O-C-N 120.079 -1.638 . . . . 37.079999999999998 113.659 177.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 51' ' ' VAL . . . . . . . . . . . . . 55.4 t -60.18 -49.87 82.43 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.748 0 C-N-CA 119.462 -0.895 . . . . 33.57 109.48 -178.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 52' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -57.65 -36.22 71.58 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 114.136 1.161 . . . . 57.460000000000001 114.136 -177.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 53' ' ' LEU . . . . . . . . . . . . . 90.7 mt -74.29 -29.69 61.75 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.892 -0.781 . . . . 32.270000000000003 108.892 -175.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 54' ' ' ILE . . . . . . . . . . . . . 68.2 mt -89.44 -45.13 15.33 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.694 0 N-CA-C 112.893 0.701 . . . . 31.940000000000001 112.893 -173.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 55' ' ' VAL . . . . . . . . . . . . . 18.2 m -84.43 159.15 3.5 Favored 'Isoleucine or valine' 0 C--O 1.252 1.225 0 C-N-CA 117.805 -1.558 . . . . 37.939999999999998 109.323 -171.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 56' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -80.65 107.12 13.19 Favored 'General case' 0 C--O 1.19 -2.032 0 N-CA-C 107.58 -1.267 . . . . 41.890000000000001 107.58 168.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 57' ' ' THR . . . . . . . . . . . . . 1.6 m -66.25 -11.45 50.27 Favored 'General case' 0 C--O 1.253 1.245 0 N-CA-C 118.908 2.929 . . . . 53.560000000000002 118.908 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 58' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -90.45 -13.61 34.48 Favored 'General case' 0 CA--C 1.481 -1.703 0 C-N-CA 118.533 -1.267 . . . . 54.579999999999998 112.444 175.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 59' ' ' THR . . . . . . . . . . . . . 20.4 m -125.74 -40.87 2.02 Favored 'General case' 0 CA--C 1.502 -0.885 0 C-N-CA 126.703 2.001 . . . . 46.25 111.817 -162.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 60' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -95.48 164.79 12.65 Favored 'General case' 0 C--O 1.265 1.878 0 CA-C-O 117.975 -1.012 . . . . 41.149999999999999 109.837 -172.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 61' ' ' ILE . . . . . . . . . . . . . 13.4 mt -137.63 133.85 45.79 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.832 0 O-C-N 126.094 2.121 . . . . 40.149999999999999 106.388 178.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 62' ' ' VAL . . . . . . . . . . . . . 48.7 t -135.48 131.44 51.28 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.198 0 N-CA-C 107.484 -1.302 . . . . 30.199999999999999 107.484 175.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 63' ' ' HIS . . . . . . . . . . . . . 21.6 m80 -110.21 129.07 55.79 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 109.413 -0.588 . . . . 28.559999999999999 109.413 175.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 64' ' ' ILE . . . . . . . . . . . . . 71.0 mt -116.22 113.68 43.87 Favored 'Isoleucine or valine' 0 C--O 1.251 1.145 0 N-CA-C 104.72 -2.326 . . . . 26.920000000000002 104.72 176.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 65' ' ' ILE . . . . . . . . . . . . . 82.9 mt -124.33 117.7 26.62 Favored Pre-proline 0 C--O 1.215 -0.727 0 CA-C-N 114.244 -1.343 . . . . 31.02 109.972 -164.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 66' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.3 140.78 19.82 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 C-N-CA 120.923 1.082 . . . . 32.380000000000003 110.658 175.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 67' ' ' LEU . . . . . 0.549 ' N ' ' CD2' ' X' ' 67' ' ' LEU . 0.3 OUTLIER -143.44 160.25 40.91 Favored 'General case' 0 C--O 1.197 -1.695 0 CA-C-N 119.402 1.001 . . . . 45.75 112.749 166.401 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' X' X ' 68' ' ' GLY . . . . . . . . . . . . . . . -76.96 154.23 42.93 Favored Glycine 0 C--O 1.246 0.899 0 N-CA-C 106.415 -2.674 . . . . 28.52 106.415 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 69' ' ' ILE . . . . . . . . . . . . . 5.8 tp -54.05 -43.03 57.56 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.502 0 O-C-N 121.571 -0.958 . . . . 38.759999999999998 111.379 177.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 70' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -68.94 -34.97 76.24 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-O 118.424 -0.798 . . . . 27.289999999999999 111.039 -176.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 71' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -63.61 -42.84 98.19 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.854 0.752 . . . . 50.990000000000002 110.613 174.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 72' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -63.31 -46.33 87.22 Favored 'General case' 0 C--O 1.255 1.344 0 CA-C-O 123.98 1.848 . . . . 32.560000000000002 111.053 177.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 73' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -55.09 -38.02 67.56 Favored 'General case' 0 C--O 1.188 -2.174 0 CA-C-N 114.491 -1.231 . . . . 38.079999999999998 113.087 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 74' ' ' ARG . . . . . . . . . . . . . 14.9 mtp-105 -89.75 11.76 19.06 Favored 'General case' 0 C--O 1.183 -2.402 0 O-C-N 121.549 -0.719 . . . . 31.289999999999999 112.564 -177.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 75' ' ' ARG . . . . . . . . . . . . . 34.3 ptt-85 -57.09 160.12 3.89 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 119.989 1.268 . . . . 35.280000000000001 109.325 170.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 76' ' ' ILE . . . . . . . . . . . . . 69.4 mt -110.58 126.86 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 C-N-CA 124.932 1.293 . . . . 35.560000000000002 108.256 166.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 77' ' ' VAL . . . . . . . . . . . . . 14.0 t -112.23 125.61 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.759 0 CA-C-O 122.897 1.332 . . . . 35.710000000000001 109.004 176.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 78' ' ' ILE . . . . . . . . . . . . . 10.0 mt -104.39 134.96 44.3 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 N-CA-C 107.905 -1.146 . . . . 40.289999999999999 107.905 176.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 79' ' ' GLY . . . . . . . . . . . . . . . 95.39 -168.41 26.82 Favored Glycine 0 C--O 1.253 1.312 0 C-N-CA 124.246 0.927 . . . . 50.759999999999998 114.566 169.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 80' ' ' ARG . . . . . 1.0 ' CB ' ' NH1' ' X' ' 80' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.556 1.21 0 N-CA-C 116.891 2.182 . . . . 83.989999999999995 116.891 -167.575 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 89' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 90' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 128' ' ' HOH . . . . . 0.522 ' O ' ' C ' ' X' ' 40' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 1' ' ' MSE . . . . . . . . . . . . . 1.6 mmt . . . . . 0 CA--C 1.579 2.084 0 N-CA-C 116.403 2.001 . . . . 99.5 116.403 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.0 171.22 7.58 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 122.554 1.168 . . . . 49.380000000000003 113.558 177.559 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 3' ' ' LEU . . . . . 0.464 ' C ' HD12 ' X' ' 3' ' ' LEU . 1.9 pp -147.35 154.9 41.48 Favored 'General case' 0 CA--C 1.447 -2.996 0 C-N-CA 118.434 -1.306 . . . . 45.409999999999997 111.099 162.484 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 4' ' ' LEU . . . . . . . . . . . . 0.29 96.1 mt -114.34 140.1 48.91 Favored 'General case' 0 C--O 1.25 1.113 0 O-C-N 125.029 1.456 . . . . 49.130000000000003 107.344 175.911 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 5' ' ' VAL . . . . . . . . . . . . . 66.9 t -118.95 121.98 68.2 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.189 0 N-CA-C 104.549 -2.389 . . . . 33.289999999999999 104.549 168.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 6' ' ' VAL . . . . . . . . . . . . . 59.5 t -119.18 130.1 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.856 0 N-CA-C 107.314 -1.365 . . . . 30.859999999999999 107.314 177.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 7' ' ' TYR . . . . . 0.403 ' HE2' ' HG3' ' X' ' 15' ' ' ARG . 34.3 p90 -129.73 158.46 39.33 Favored 'General case' 0 C--O 1.279 2.629 0 N-CA-C 116.008 1.855 . . . . 36.439999999999998 116.008 -177.845 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 8' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -137.78 90.03 2.46 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 101.433 -3.543 . . . . 38.5 101.433 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 9' ' ' VAL . . . . . 0.634 ' O ' ' NH1' ' X' ' 15' ' ' ARG . 55.8 t -113.94 111.72 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.35 0 CA-C-N 114.632 -1.167 . . . . 37.229999999999997 108.692 -175.18 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 10' ' ' SER . . . . . . . . . . . . . 4.5 m -60.32 -57.28 13.44 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 116.569 2.063 . . . . 45.869999999999997 116.569 -179.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 11' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -60.54 110.12 1.2 Allowed 'General case' 0 CA--C 1.578 2.028 0 N-CA-C 114.775 1.398 . . . . 55.719999999999999 114.775 177.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -38.71 -43.34 0.89 Allowed 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 125.36 1.464 . . . . 55.020000000000003 113.982 175.331 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 11.6 t -75.29 -37.73 60.72 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 113.333 0.864 . . . . 48.600000000000001 113.333 -175.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 14' ' ' LYS . . . . . . . . . . . . . 13.7 mttm -66.79 -38.64 86.92 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-O 119.012 -0.518 . . . . 56.060000000000002 110.472 174.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 15' ' ' ARG . . . . . 0.634 ' NH1' ' O ' ' X' ' 9' ' ' VAL . 12.0 ttp-105 -56.1 -43.8 78.42 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 113.306 0.854 . . . . 64.0 113.306 177.639 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 16' ' ' ASN . . . . . 0.443 ' OD1' ' N ' ' X' ' 16' ' ' ASN . 4.0 p30 -88.29 -19.94 26.09 Favored 'General case' 0 CA--C 1.506 -0.734 0 C-N-CA 113.874 -3.13 . . . . 52.310000000000002 116.657 -179.601 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 17' ' ' LYS . . . . . . . . . . . . . 34.0 tttt -52.61 -47.35 67.01 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 119.469 -0.892 . . . . 37.659999999999997 110.375 160.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 53.8 tp -63.54 -49.17 74.54 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 119.076 -0.488 . . . . 31.609999999999999 111.388 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.09 -44.91 71.62 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 108.903 -0.777 . . . . 34.829999999999998 108.903 176.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 20' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -62.8 -43.83 97.76 Favored 'General case' 0 CA--C 1.5 -0.976 0 O-C-N 123.253 0.345 . . . . 47.130000000000003 111.784 -178.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -70.6 -39.62 73.71 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 117.279 2.326 . . . . 37.909999999999997 117.279 178.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 22' ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.11 -42.4 76.78 Favored 'General case' 0 CA--C 1.568 1.658 0 CA-C-O 118.726 -0.654 . . . . 35.25 112.528 168.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 23' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -61.65 -45.18 95.14 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 120.266 1.394 . . . . 52.619999999999997 107.889 175.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 24' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -57.38 -37.55 72.84 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 120.556 -0.458 . . . . 48.5 111.794 -175.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 25' ' ' LEU . . . . . . . . . . . . . 28.8 mt -77.63 8.98 3.73 Favored 'General case' 0 C--O 1.257 1.496 0 CA-C-O 119.181 -0.438 . . . . 42.710000000000001 111.049 179.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 79.54 9.05 87.28 Favored Glycine 0 CA--C 1.544 1.902 0 N-CA-C 121.168 3.227 . . . . 40.310000000000002 121.168 -174.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 27' ' ' LEU . . . . . 0.567 HD23 ' N ' ' X' ' 27' ' ' LEU . 0.3 OUTLIER -77.57 160.26 28.7 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 119.722 -2.046 . . . . 42.939999999999998 109.627 173.666 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' X' X ' 28' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -118.2 136.28 53.74 Favored 'General case' 0 CA--C 1.494 -1.2 0 CA-C-N 117.903 0.319 . . . . 60.009999999999998 111.0 -177.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 29' ' ' ARG . . . . . . . . . . . . . 49.2 ttm-85 -68.52 130.79 43.91 Favored 'General case' 0 C--O 1.193 -1.905 0 C-N-CA 118.203 -1.399 . . . . 47.119999999999997 111.369 179.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 30' ' ' ILE . . . . . . . . . . . . . 43.9 pt -111.68 -21.4 5.61 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.809 0 CA-C-O 118.255 -0.879 . . . . 33.840000000000003 111.216 172.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 31' ' ' GLN . . . . . . . . . . . . 0.371 52.2 mt-30 -155.34 176.71 12.22 Favored 'General case' 0 CA--C 1.464 -2.354 0 N-CA-C 107.109 -1.441 . . . . 35.030000000000001 107.109 177.182 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 32' ' ' ARG . . . . . . . . . . . . . 12.5 ttt85 -51.43 -34.96 37.21 Favored 'General case' 0 C--O 1.251 1.156 0 N-CA-C 115.412 1.634 . . . . 61.43 115.412 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 33' ' ' SER . . . . . . . . . . . . . 27.5 m -133.5 43.22 2.92 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 114.485 -2.886 . . . . 39.630000000000003 111.192 179.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 34' ' ' ALA . . . . . . . . . . . . . . . -152.57 140.13 19.74 Favored 'General case' 0 C--O 1.215 -0.762 0 N-CA-C 107.339 -1.356 . . . . 31.390000000000001 107.339 -175.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 35' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -134.58 155.96 49.53 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 106.766 -1.568 . . . . 32.649999999999999 106.766 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -133.26 157.85 44.39 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 109.192 -0.67 . . . . 55.399999999999999 109.192 171.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 37' ' ' GLY . . . . . . . . . . . . . . . -168.07 177.47 42.24 Favored Glycine 0 C--O 1.214 -1.122 0 N-CA-C 106.293 -2.723 . . . . 43.469999999999999 106.293 -179.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 38' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -98.77 138.13 36.37 Favored 'General case' 0 N--CA 1.421 -1.886 0 N-CA-C 109.199 -0.667 . . . . 55.880000000000003 109.199 -179.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 39' ' ' MSE . . . . . . . . . . . . . 0.1 OUTLIER -33.64 119.64 0.38 Allowed 'General case' 0 CA--C 1.576 1.96 0 N-CA-C 120.454 3.501 . . . . 105.18000000000001 120.454 153.92 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 40' ' ' ASP . . . . . 0.755 ' HB2' ' HG2' ' X' ' 43' ' ' ARG . 9.9 m-20 . . . . . 0 C--O 1.26 1.633 0 N-CA-C 118.99 2.959 . . . . 68.049999999999997 118.99 -164.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 43' ' ' ARG . . . . . 0.755 ' HG2' ' HB2' ' X' ' 40' ' ' ASP . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.612 0 N-CA-C 112.76 0.652 . . . . 66.090000000000003 112.76 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 44' ' ' MSE . . . . . 0.421 ' N ' ' HG3' ' X' ' 43' ' ' ARG . 1.1 tpt -52.23 -52.96 49.38 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.482 -0.761 . . . . 94.659999999999997 110.66 -172.033 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 45' ' ' LYS . . . . . . . . . . . . . 6.1 tptm -60.09 -35.94 76.3 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 123.529 0.518 . . . . 64.040000000000006 111.28 -175.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -68.64 -40.49 80.23 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 115.037 1.495 . . . . 59.420000000000002 115.037 174.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 47' ' ' LEU . . . . . . . . . . . . . 60.7 tp -54.25 -52.8 60.22 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 124.829 1.33 . . . . 44.090000000000003 111.774 172.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 48' ' ' VAL . . . . . . . . . . . . . 69.5 t -62.57 -43.58 98.58 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.178 0 C-N-CA 120.361 -0.536 . . . . 40.719999999999999 110.889 -179.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.9 -46.63 89.89 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 108.66 -0.867 . . . . 49.640000000000001 108.66 179.975 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 50' ' ' VAL . . . . . . . . . . . . . 4.0 t -55.91 -50.52 68.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 O-C-N 120.079 -1.638 . . . . 37.079999999999998 113.659 177.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 51' ' ' VAL . . . . . . . . . . . . . 55.4 t -60.18 -49.87 82.43 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.748 0 C-N-CA 119.462 -0.895 . . . . 33.57 109.48 -178.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 52' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -57.65 -36.22 71.58 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 114.136 1.161 . . . . 57.460000000000001 114.136 -177.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 53' ' ' LEU . . . . . . . . . . . . . 90.7 mt -74.29 -29.69 61.75 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.892 -0.781 . . . . 32.270000000000003 108.892 -175.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 54' ' ' ILE . . . . . . . . . . . . . 68.2 mt -89.44 -45.13 15.33 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.694 0 N-CA-C 112.893 0.701 . . . . 31.940000000000001 112.893 -173.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 55' ' ' VAL . . . . . . . . . . . . . 18.2 m -84.43 159.15 3.5 Favored 'Isoleucine or valine' 0 C--O 1.252 1.225 0 C-N-CA 117.805 -1.558 . . . . 37.939999999999998 109.323 -171.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 56' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -80.65 107.12 13.19 Favored 'General case' 0 C--O 1.19 -2.032 0 N-CA-C 107.58 -1.267 . . . . 41.890000000000001 107.58 168.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 57' ' ' THR . . . . . . . . . . . . . 1.6 m -66.25 -11.45 50.27 Favored 'General case' 0 C--O 1.253 1.245 0 N-CA-C 118.908 2.929 . . . . 53.560000000000002 118.908 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 58' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -90.45 -13.61 34.48 Favored 'General case' 0 CA--C 1.481 -1.703 0 C-N-CA 118.533 -1.267 . . . . 54.579999999999998 112.444 175.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 59' ' ' THR . . . . . 0.493 HG22 ' OD1' ' X' ' 60' ' ' ASP . 20.4 m -125.74 -40.87 2.02 Favored 'General case' 0 CA--C 1.502 -0.885 0 C-N-CA 126.703 2.001 . . . . 46.25 111.817 -162.616 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 60' ' ' ASP . . . . . 0.493 ' OD1' HG22 ' X' ' 59' ' ' THR . 76.1 m-20 -95.48 164.79 12.65 Favored 'General case' 0 C--O 1.265 1.878 0 CA-C-O 117.975 -1.012 . . . . 41.149999999999999 109.837 -172.05 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 61' ' ' ILE . . . . . . . . . . . . . 13.4 mt -137.63 133.85 45.79 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.832 0 O-C-N 126.094 2.121 . . . . 40.149999999999999 106.388 178.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 62' ' ' VAL . . . . . . . . . . . . . 48.7 t -135.48 131.44 51.28 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.198 0 N-CA-C 107.484 -1.302 . . . . 30.199999999999999 107.484 175.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 63' ' ' HIS . . . . . . . . . . . . . 21.6 m80 -110.21 129.07 55.79 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 109.413 -0.588 . . . . 28.559999999999999 109.413 175.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 64' ' ' ILE . . . . . . . . . . . . . 71.0 mt -116.22 113.68 43.87 Favored 'Isoleucine or valine' 0 C--O 1.251 1.145 0 N-CA-C 104.72 -2.326 . . . . 26.920000000000002 104.72 176.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 65' ' ' ILE . . . . . . . . . . . . . 82.9 mt -124.33 117.7 26.62 Favored Pre-proline 0 C--O 1.215 -0.727 0 CA-C-N 114.244 -1.343 . . . . 31.02 109.972 -164.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 66' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.3 140.78 19.82 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 C-N-CA 120.923 1.082 . . . . 32.380000000000003 110.658 175.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 67' ' ' LEU . . . . . 0.741 ' N ' HD23 ' X' ' 67' ' ' LEU . 0.3 OUTLIER -143.44 160.25 40.91 Favored 'General case' 0 C--O 1.197 -1.695 0 CA-C-N 119.402 1.001 . . . . 45.75 112.749 166.401 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' X' X ' 68' ' ' GLY . . . . . . . . . . . . . . . -76.96 154.23 42.93 Favored Glycine 0 C--O 1.246 0.899 0 N-CA-C 106.415 -2.674 . . . . 28.52 106.415 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 69' ' ' ILE . . . . . . . . . . . . . 5.8 tp -54.05 -43.03 57.56 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.502 0 O-C-N 121.571 -0.958 . . . . 38.759999999999998 111.379 177.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 70' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -68.94 -34.97 76.24 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-O 118.424 -0.798 . . . . 27.289999999999999 111.039 -176.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 71' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -63.61 -42.84 98.19 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.854 0.752 . . . . 50.990000000000002 110.613 174.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 72' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -63.31 -46.33 87.22 Favored 'General case' 0 C--O 1.255 1.344 0 CA-C-O 123.98 1.848 . . . . 32.560000000000002 111.053 177.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 73' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -55.09 -38.02 67.56 Favored 'General case' 0 C--O 1.188 -2.174 0 CA-C-N 114.491 -1.231 . . . . 38.079999999999998 113.087 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 74' ' ' ARG . . . . . . . . . . . . . 14.9 mtp-105 -89.75 11.76 19.06 Favored 'General case' 0 C--O 1.183 -2.402 0 O-C-N 121.549 -0.719 . . . . 31.289999999999999 112.564 -177.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 75' ' ' ARG . . . . . . . . . . . . . 34.3 ptt-85 -57.09 160.12 3.89 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 119.989 1.268 . . . . 35.280000000000001 109.325 170.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 76' ' ' ILE . . . . . . . . . . . . . 69.4 mt -110.58 126.86 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 C-N-CA 124.932 1.293 . . . . 35.560000000000002 108.256 166.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 77' ' ' VAL . . . . . . . . . . . . . 14.0 t -112.23 125.61 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.759 0 CA-C-O 122.897 1.332 . . . . 35.710000000000001 109.004 176.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 78' ' ' ILE . . . . . . . . . . . . . 10.0 mt -104.39 134.96 44.3 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 N-CA-C 107.905 -1.146 . . . . 40.289999999999999 107.905 176.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 79' ' ' GLY . . . . . . . . . . . . . . . 95.39 -168.41 26.82 Favored Glycine 0 C--O 1.253 1.312 0 C-N-CA 124.246 0.927 . . . . 50.759999999999998 114.566 169.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 80' ' ' ARG . . . . . 1.433 ' HB3' ' NH1' ' X' ' 80' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.556 1.21 0 N-CA-C 116.891 2.182 . . . . 83.989999999999995 116.891 -167.575 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 89' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 90' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 128' ' ' HOH . . . . . 0.522 ' O ' ' C ' ' X' ' 40' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 1' ' ' MSE . . . . . . . . . . . . . 1.6 mmt . . . . . 0 CA--C 1.579 2.084 0 N-CA-C 116.403 2.001 . . . . 99.5 116.403 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.0 171.22 7.58 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 122.554 1.168 . . . . 49.38 113.558 177.559 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 3' ' ' LEU . . . . . 0.464 HD12 ' C ' ' X' ' 3' ' ' LEU . 1.9 pp -147.35 154.9 41.48 Favored 'General case' 0 CA--C 1.447 -2.996 0 C-N-CA 118.434 -1.306 . . . . 45.41 111.099 162.484 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 4' ' ' LEU . . . . . . . . . . . . 0.29 96.1 mt -114.34 140.1 48.91 Favored 'General case' 0 C--O 1.25 1.113 0 O-C-N 125.029 1.456 . . . . 49.13 107.344 175.911 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 5' ' ' VAL . . . . . . . . . . . . . 66.9 t -118.95 121.98 68.2 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.189 0 N-CA-C 104.549 -2.389 . . . . 33.29 104.549 168.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 6' ' ' VAL . . . . . . . . . . . . . 59.5 t -119.18 130.1 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.856 0 N-CA-C 107.314 -1.365 . . . . 30.86 107.314 177.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 7' ' ' TYR . . . . . 0.403 ' HE2' ' HG3' ' X' ' 15' ' ' ARG . 34.3 p90 -129.73 158.46 39.33 Favored 'General case' 0 C--O 1.279 2.629 0 N-CA-C 116.008 1.855 . . . . 36.44 116.008 -177.845 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 8' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -137.78 90.03 2.46 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 101.433 -3.543 . . . . 38.5 101.433 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 9' ' ' VAL . . . . . 0.634 ' O ' ' NH1' ' X' ' 15' ' ' ARG . 55.8 t -113.94 111.72 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.35 0 CA-C-N 114.632 -1.167 . . . . 37.23 108.692 -175.18 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 10' ' ' SER . . . . . . . . . . . . . 4.5 m -60.32 -57.28 13.44 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 116.569 2.063 . . . . 45.87 116.569 -179.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 11' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -60.54 110.12 1.2 Allowed 'General case' 0 CA--C 1.578 2.028 0 N-CA-C 114.775 1.398 . . . . 55.72 114.775 177.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 12' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -38.71 -43.34 0.89 Allowed 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 125.36 1.464 . . . . 55.02 113.982 175.331 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 11.6 t -75.29 -37.73 60.72 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 113.333 0.864 . . . . 48.6 113.333 -175.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 14' ' ' LYS . . . . . . . . . . . . . 13.7 mttm -66.79 -38.64 86.92 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-O 119.012 -0.518 . . . . 56.06 110.472 174.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 15' ' ' ARG . . . . . 0.634 ' NH1' ' O ' ' X' ' 9' ' ' VAL . 12.0 ttp-105 -56.1 -43.8 78.42 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 113.306 0.854 . . . . 64.0 113.306 177.639 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 16' ' ' ASN . . . . . 0.735 ' H ' ' ND2' ' X' ' 16' ' ' ASN . 0.0 OUTLIER -88.29 -19.94 26.09 Favored 'General case' 0 CA--C 1.506 -0.734 0 C-N-CA 113.874 -3.13 . . . . 52.31 116.657 -179.601 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' X' X ' 17' ' ' LYS . . . . . . . . . . . . . 34.0 tttt -52.61 -47.35 67.01 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 119.469 -0.892 . . . . 37.66 110.375 160.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 53.8 tp -63.54 -49.17 74.54 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 119.076 -0.488 . . . . 31.61 111.388 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.09 -44.91 71.62 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 108.903 -0.777 . . . . 34.83 108.903 176.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 20' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -62.8 -43.83 97.76 Favored 'General case' 0 CA--C 1.5 -0.976 0 O-C-N 123.253 0.345 . . . . 47.13 111.784 -178.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -70.6 -39.62 73.71 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 117.279 2.326 . . . . 37.91 117.279 178.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 22' ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.11 -42.4 76.78 Favored 'General case' 0 CA--C 1.568 1.658 0 CA-C-O 118.726 -0.654 . . . . 35.25 112.528 168.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 23' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -61.65 -45.18 95.14 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 120.266 1.394 . . . . 52.62 107.889 175.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 24' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -57.38 -37.55 72.84 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 120.556 -0.458 . . . . 48.5 111.794 -175.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 25' ' ' LEU . . . . . . . . . . . . . 28.8 mt -77.63 8.98 3.73 Favored 'General case' 0 C--O 1.257 1.496 0 CA-C-O 119.181 -0.438 . . . . 42.71 111.049 179.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 79.54 9.05 87.28 Favored Glycine 0 CA--C 1.544 1.902 0 N-CA-C 121.168 3.227 . . . . 40.31 121.168 -174.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 27' ' ' LEU . . . . . 0.567 HD23 ' N ' ' X' ' 27' ' ' LEU . 0.3 OUTLIER -77.57 160.26 28.7 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 119.722 -2.046 . . . . 42.94 109.627 173.666 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' X' X ' 28' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -118.2 136.28 53.74 Favored 'General case' 0 CA--C 1.494 -1.2 0 CA-C-N 117.903 0.319 . . . . 60.01 111.0 -177.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 29' ' ' ARG . . . . . . . . . . . . . 49.2 ttm-85 -68.52 130.79 43.91 Favored 'General case' 0 C--O 1.193 -1.905 0 C-N-CA 118.203 -1.399 . . . . 47.12 111.369 179.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 30' ' ' ILE . . . . . . . . . . . . . 43.9 pt -111.68 -21.4 5.61 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.809 0 CA-C-O 118.255 -0.879 . . . . 33.84 111.216 172.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 31' ' ' GLN . . . . . . . . . . . . 0.371 52.2 mt-30 -155.34 176.71 12.22 Favored 'General case' 0 CA--C 1.464 -2.354 0 N-CA-C 107.109 -1.441 . . . . 35.03 107.109 177.182 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 32' ' ' ARG . . . . . . . . . . . . . 12.5 ttt85 -51.43 -34.96 37.21 Favored 'General case' 0 C--O 1.251 1.156 0 N-CA-C 115.412 1.634 . . . . 61.43 115.412 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 33' ' ' SER . . . . . . . . . . . . . 27.5 m -133.5 43.22 2.92 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 114.485 -2.886 . . . . 39.63 111.192 179.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 34' ' ' ALA . . . . . . . . . . . . . . . -152.57 140.13 19.74 Favored 'General case' 0 C--O 1.215 -0.762 0 N-CA-C 107.339 -1.356 . . . . 31.39 107.339 -175.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 35' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -134.58 155.96 49.53 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 106.766 -1.568 . . . . 32.65 106.766 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -133.26 157.85 44.39 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 109.192 -0.67 . . . . 55.4 109.192 171.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 37' ' ' GLY . . . . . . . . . . . . . . . -168.07 177.47 42.24 Favored Glycine 0 C--O 1.214 -1.122 0 N-CA-C 106.293 -2.723 . . . . 43.47 106.293 -179.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 38' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -98.77 138.13 36.37 Favored 'General case' 0 N--CA 1.421 -1.886 0 N-CA-C 109.199 -0.667 . . . . 55.88 109.199 -179.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 39' ' ' MSE . . . . . . . . . . . . . 0.1 OUTLIER -33.64 119.64 0.38 Allowed 'General case' 0 CA--C 1.576 1.96 0 N-CA-C 120.454 3.501 . . . . 105.18 120.454 153.92 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 40' ' ' ASP . . . . . 0.755 ' HB2' ' HG2' ' X' ' 43' ' ' ARG . 9.9 m-20 . . . . . 0 C--O 1.26 1.633 0 N-CA-C 118.99 2.959 . . . . 68.05 118.99 -164.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 43' ' ' ARG . . . . . 0.755 ' HG2' ' HB2' ' X' ' 40' ' ' ASP . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.612 0 N-CA-C 112.76 0.652 . . . . 66.09 112.76 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 44' ' ' MSE . . . . . 0.421 ' N ' ' HG3' ' X' ' 43' ' ' ARG . 1.1 tpt -52.23 -52.96 49.38 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.482 -0.761 . . . . 94.66 110.66 -172.033 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 45' ' ' LYS . . . . . . . . . . . . . 6.1 tptm -60.09 -35.94 76.3 Favored 'General case' 0 C--O 1.239 0.528 0 O-C-N 123.529 0.518 . . . . 64.04 111.28 -175.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 46' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -68.64 -40.49 80.23 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 115.037 1.495 . . . . 59.42 115.037 174.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 47' ' ' LEU . . . . . . . . . . . . . 60.7 tp -54.25 -52.8 60.22 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 124.829 1.33 . . . . 44.09 111.774 172.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 48' ' ' VAL . . . . . . . . . . . . . 69.5 t -62.57 -43.58 98.58 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.178 0 C-N-CA 120.361 -0.536 . . . . 40.72 110.889 -179.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.9 -46.63 89.89 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 108.66 -0.867 . . . . 49.64 108.66 179.975 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 50' ' ' VAL . . . . . . . . . . . . . 4.0 t -55.91 -50.52 68.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 O-C-N 120.079 -1.638 . . . . 37.08 113.659 177.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 51' ' ' VAL . . . . . . . . . . . . . 55.4 t -60.18 -49.87 82.43 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.748 0 C-N-CA 119.462 -0.895 . . . . 33.57 109.48 -178.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 52' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -57.65 -36.22 71.58 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 114.136 1.161 . . . . 57.46 114.136 -177.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 53' ' ' LEU . . . . . . . . . . . . . 90.7 mt -74.29 -29.69 61.75 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.892 -0.781 . . . . 32.27 108.892 -175.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 54' ' ' ILE . . . . . . . . . . . . . 68.2 mt -89.44 -45.13 15.33 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.694 0 N-CA-C 112.893 0.701 . . . . 31.94 112.893 -173.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 55' ' ' VAL . . . . . . . . . . . . . 18.2 m -84.43 159.15 3.5 Favored 'Isoleucine or valine' 0 C--O 1.252 1.225 0 C-N-CA 117.805 -1.558 . . . . 37.94 109.323 -171.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 56' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -80.65 107.12 13.19 Favored 'General case' 0 C--O 1.19 -2.032 0 N-CA-C 107.58 -1.267 . . . . 41.89 107.58 168.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 57' ' ' THR . . . . . . . . . . . . . 1.6 m -66.25 -11.45 50.27 Favored 'General case' 0 C--O 1.253 1.245 0 N-CA-C 118.908 2.929 . . . . 53.56 118.908 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 58' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -90.45 -13.61 34.48 Favored 'General case' 0 CA--C 1.481 -1.703 0 C-N-CA 118.533 -1.267 . . . . 54.58 112.444 175.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 59' ' ' THR . . . . . 0.493 HG22 ' OD1' ' X' ' 60' ' ' ASP . 20.4 m -125.74 -40.87 2.02 Favored 'General case' 0 CA--C 1.502 -0.885 0 C-N-CA 126.703 2.001 . . . . 46.25 111.817 -162.616 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 60' ' ' ASP . . . . . 0.493 ' OD1' HG22 ' X' ' 59' ' ' THR . 76.1 m-20 -95.48 164.79 12.65 Favored 'General case' 0 C--O 1.265 1.878 0 CA-C-O 117.975 -1.012 . . . . 41.15 109.837 -172.05 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 61' ' ' ILE . . . . . . . . . . . . . 13.4 mt -137.63 133.85 45.79 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.832 0 O-C-N 126.094 2.121 . . . . 40.15 106.388 178.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 62' ' ' VAL . . . . . . . . . . . . . 48.7 t -135.48 131.44 51.28 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.198 0 N-CA-C 107.484 -1.302 . . . . 30.2 107.484 175.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 63' ' ' HIS . . . . . . . . . . . . . 21.6 m80 -110.21 129.07 55.79 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 109.413 -0.588 . . . . 28.56 109.413 175.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 64' ' ' ILE . . . . . . . . . . . . . 71.0 mt -116.22 113.68 43.87 Favored 'Isoleucine or valine' 0 C--O 1.251 1.145 0 N-CA-C 104.72 -2.326 . . . . 26.92 104.72 176.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 65' ' ' ILE . . . . . . . . . . . . . 82.9 mt -124.33 117.7 26.62 Favored Pre-proline 0 C--O 1.215 -0.727 0 CA-C-N 114.244 -1.343 . . . . 31.02 109.972 -164.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 66' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.3 140.78 19.82 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 C-N-CA 120.923 1.082 . . . . 32.38 110.658 175.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 67' ' ' LEU . . . . . 0.741 HD23 ' N ' ' X' ' 67' ' ' LEU . 0.3 OUTLIER -143.44 160.25 40.91 Favored 'General case' 0 C--O 1.197 -1.695 0 CA-C-N 119.402 1.001 . . . . 45.75 112.749 166.401 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' X' X ' 68' ' ' GLY . . . . . . . . . . . . . . . -76.96 154.23 42.93 Favored Glycine 0 C--O 1.246 0.899 0 N-CA-C 106.415 -2.674 . . . . 28.52 106.415 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 69' ' ' ILE . . . . . . . . . . . . . 5.8 tp -54.05 -43.03 57.56 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.502 0 O-C-N 121.571 -0.958 . . . . 38.76 111.379 177.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 70' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -68.94 -34.97 76.24 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-O 118.424 -0.798 . . . . 27.29 111.039 -176.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 71' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -63.61 -42.84 98.19 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.854 0.752 . . . . 50.99 110.613 174.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 72' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -63.31 -46.33 87.22 Favored 'General case' 0 C--O 1.255 1.344 0 CA-C-O 123.98 1.848 . . . . 32.56 111.053 177.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 73' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -55.09 -38.02 67.56 Favored 'General case' 0 C--O 1.188 -2.174 0 CA-C-N 114.491 -1.231 . . . . 38.08 113.087 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 74' ' ' ARG . . . . . . . . . . . . . 14.9 mtp-105 -89.75 11.76 19.06 Favored 'General case' 0 C--O 1.183 -2.402 0 O-C-N 121.549 -0.719 . . . . 31.29 112.564 -177.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 75' ' ' ARG . . . . . . . . . . . . . 34.3 ptt-85 -57.09 160.12 3.89 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 119.989 1.268 . . . . 35.28 109.325 170.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 76' ' ' ILE . . . . . . . . . . . . . 69.4 mt -110.58 126.86 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 C-N-CA 124.932 1.293 . . . . 35.56 108.256 166.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 77' ' ' VAL . . . . . . . . . . . . . 14.0 t -112.23 125.61 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.759 0 CA-C-O 122.897 1.332 . . . . 35.71 109.004 176.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 78' ' ' ILE . . . . . . . . . . . . . 10.0 mt -104.39 134.96 44.3 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 N-CA-C 107.905 -1.146 . . . . 40.29 107.905 176.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 79' ' ' GLY . . . . . . . . . . . . . . . 95.39 -168.41 26.82 Favored Glycine 0 C--O 1.253 1.312 0 C-N-CA 124.246 0.927 . . . . 50.76 114.566 169.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 80' ' ' ARG . . . . . 1.433 ' NH1' ' HB3' ' X' ' 80' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.556 1.21 0 N-CA-C 116.891 2.182 . . . . 83.99 116.891 -167.575 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 89' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 90' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 128' ' ' HOH . . . . . 0.522 ' O ' ' C ' ' X' ' 40' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_