data_4gsw_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 4gsw _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 2' ' ' ASN . . . . . 0.473 ' ND2' ' O2 ' ' A' ' 101' ' ' SO4 . 26.6 t30 . . . . . 0 CA--C 1.546 0.814 0 N-CA-C 113.897 1.073 . . . . 67.069999999999993 113.897 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -48.41 152.55 0.88 Allowed 'General case' 0 CA--C 1.553 1.069 0 N-CA-C 114.623 1.342 . . . . 48.780000000000001 114.623 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 15.5 ptt? -151.47 155.91 39.52 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 112.883 0.698 . . . . 58.969999999999999 112.883 175.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -93.03 129.37 38.98 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 124.085 0.954 . . . . 56.640000000000001 110.683 -178.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.1 pt -126.48 168.74 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.813 0 N-CA-C 108.873 -0.788 . . . . 41.729999999999997 108.873 168.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -124.13 152.59 42.6 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 114.064 1.135 . . . . 38.829999999999998 114.064 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 33.0 t -124.04 122.29 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.147 0 C-N-CA 118.16 -1.416 . . . . 33.229999999999997 107.474 173.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.3 tttp -77.94 112.98 15.4 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.325 -0.991 . . . . 67.950000000000003 108.325 172.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 8.2 p -81.74 -168.63 1.98 Allowed 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.602 -0.726 . . . . 43.009999999999998 111.378 -174.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.3 mt -76.78 -21.46 55.13 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 114.093 1.145 . . . . 43.549999999999997 114.093 -176.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 53.4 p -79.59 -16.25 56.2 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.167 0.803 . . . . 45.399999999999999 113.167 172.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 99.17 -13.43 61.79 Favored Glycine 0 CA--C 1.525 0.674 0 C-N-CA 119.081 -1.533 . . . . 43.049999999999997 111.294 -175.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -75.27 164.89 25.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.051 0.54 . . . . 57.5 109.715 171.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 30.0 p -117.28 145.06 44.22 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 121.433 0.635 . . . . 40.100000000000001 112.013 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 15.6 pt -107.27 154.57 8.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 C-N-CA 117.825 -1.55 . . . . 39.840000000000003 109.131 167.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 51.8 m -101.65 132.72 47.19 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.558 -0.905 . . . . 47.869999999999997 108.558 -176.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.8 mt -120.69 144.79 48.02 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 118.793 0.724 . . . . 38.049999999999997 112.072 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . 0.647 ' O ' ' NZ ' ' A' ' 32' ' ' LYS . 66.4 mm-40 -101.32 121.45 41.91 Favored 'General case' 0 CA--C 1.493 -1.247 0 N-CA-C 108.105 -1.072 . . . . 73.260000000000005 108.105 169.462 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.3 m -138.7 163.82 27.16 Favored 'Isoleucine or valine' 0 C--O 1.248 0.979 0 N-CA-C 108.483 -0.932 . . . . 41.899999999999999 108.483 -170.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLU . . . . . 0.414 ' N ' ' OD2' ' A' ' 24' ' ' ASP . 36.5 mm-40 -101.91 149.66 36.71 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 114.373 -1.285 . . . . 66.719999999999999 108.805 173.19 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -54.4 -40.27 83.78 Favored 'Trans proline' 0 CA--C 1.51 -0.708 0 C-N-CA 121.775 1.65 . . . . 48.079999999999998 113.216 -173.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -96.81 16.52 18.99 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 116.997 2.221 . . . . 39.670000000000002 116.997 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . 0.414 ' OD2' ' N ' ' A' ' 21' ' ' GLU . 10.4 m-20 -56.25 143.04 35.26 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 110.247 -0.279 . . . . 41.18 110.247 177.813 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.9 p -73.36 160.86 31.18 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 118.217 -1.393 . . . . 34.920000000000002 109.357 176.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 25.6 mm -60.63 -34.2 57.66 Favored 'Isoleucine or valine' 0 C--O 1.244 0.808 0 N-CA-C 109.309 -0.626 . . . . 43.219999999999999 109.309 172.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -56.26 -39.83 73.23 Favored 'General case' 0 N--CA 1.485 1.289 0 CA-C-O 121.745 0.783 . . . . 52.950000000000003 112.29 176.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.69 -34.43 73.91 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 120.824 -1.173 . . . . 34.859999999999999 111.863 178.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 11.6 mm -65.98 -43.48 92.65 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 O-C-N 121.75 -0.594 . . . . 40.359999999999999 109.668 177.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -64.71 -34.95 79.53 Favored 'General case' 0 C--O 1.264 1.822 0 CA-C-O 121.6 0.714 . . . . 36.329999999999998 109.902 -177.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.88 -38.02 76.23 Favored 'General case' 0 N--CA 1.443 -0.822 0 C-N-CA 119.17 -1.012 . . . . 36.25 109.266 -178.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LYS . . . . . 0.647 ' NZ ' ' O ' ' A' ' 19' ' ' GLU . 89.5 mttt -65.59 -34.83 79.16 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.431 -0.793 . . . . 44.219999999999999 112.857 173.518 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 97.2 mt -66.26 -39.22 83.68 Favored 'Isoleucine or valine' 0 C--O 1.245 0.858 0 N-CA-C 108.767 -0.827 . . . . 36.119999999999997 108.767 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 18.3 tm0? -61.23 -44.48 97.2 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.327 0.392 . . . . 36.829999999999998 111.921 177.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -62.34 -28.67 69.91 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.66 0.615 . . . . 45.82 112.66 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -100.59 -31.14 11.39 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 114.357 1.243 . . . . 51.869999999999997 114.357 -176.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -106.14 -20.84 13.28 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.082 0.771 . . . . 44.32 113.082 -175.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.97 16.77 80.49 Favored Glycine 0 C--N 1.34 0.774 0 N-CA-C 114.762 0.665 . . . . 50.189999999999998 114.762 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 31.6 mt -95.67 126.36 45.65 Favored Pre-proline 0 C--N 1.324 -0.516 0 O-C-N 122.464 -0.433 . . . . 42.969999999999999 110.04 174.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -59.2 140.95 97.16 Favored 'Trans proline' 0 C--O 1.213 -0.772 0 CA-C-O 118.635 -0.652 . . . . 43.710000000000001 112.682 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -53.05 -34.75 69.3 Favored 'Trans proline' 0 CA--C 1.508 -0.784 0 O-C-N 123.114 1.06 . . . . 37.780000000000001 109.797 -178.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -68.34 -13.58 62.37 Favored 'General case' 0 C--O 1.213 -0.828 0 C-N-CA 117.022 -1.871 . . . . 45.009999999999998 112.801 -177.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -102.04 3.13 38.47 Favored 'General case' 0 C--O 1.26 1.631 0 CA-C-N 118.831 0.741 . . . . 61.920000000000002 112.781 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -96.26 133.63 40.37 Favored 'General case' 0 C--O 1.244 0.798 0 CA-C-N 115.859 -0.61 . . . . 46.479999999999997 110.793 178.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.4 ttp180 -120.14 126.25 50.23 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 105.871 -1.9 . . . . 45.159999999999997 105.871 168.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 69.0 mt -115.93 138.03 51.56 Favored 'General case' 0 C--O 1.25 1.131 0 N-CA-C 115.528 1.677 . . . . 36.549999999999997 115.528 -178.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.5 mm -125.19 139.54 50.87 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 N-CA-C 109.018 -0.734 . . . . 44.899999999999999 109.018 -175.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -140.0 126.52 20.3 Favored 'General case' 0 C--O 1.25 1.092 0 N-CA-C 111.312 0.115 . . . . 41.009999999999998 111.312 169.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 45.39 43.47 8.58 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.247 0.546 . . . . 41.990000000000002 111.959 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 86.49 0.04 86.66 Favored Glycine 0 C--O 1.209 -1.433 0 N-CA-C 115.502 0.961 . . . . 45.0 115.502 176.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.6 mttt -111.05 139.85 46.07 Favored 'General case' 0 C--O 1.244 0.779 0 CA-C-N 117.977 0.889 . . . . 66.859999999999999 111.606 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLN . . . . . 0.663 ' NE2' ' O ' ' A' ' 202' ' ' HOH . 7.3 tp60 -74.96 123.03 24.4 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-N 115.008 -0.996 . . . . 43.710000000000001 109.053 172.261 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 8.0 mt -89.81 113.66 25.26 Favored 'General case' 0 C--O 1.219 -0.519 0 C-N-CA 119.706 -0.797 . . . . 42.0 109.734 -178.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -108.63 152.13 25.2 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 116.686 2.106 . . . . 79.530000000000001 116.686 -172.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -57.63 145.06 35.28 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.535 -0.757 . . . . 56.079999999999998 110.811 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.33 -20.55 33.34 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 115.34 -0.845 . . . . 55.340000000000003 111.142 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 23.3 mmmt -88.09 176.97 7.05 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 107.763 -1.199 . . . . 45.609999999999999 107.763 176.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.0 p -126.83 166.04 18.2 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 122.005 -0.434 . . . . 38.82 110.252 -175.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.8 mt -58.34 -41.71 85.23 Favored 'General case' 0 C--O 1.255 1.367 0 CA-C-O 122.332 1.063 . . . . 42.719999999999999 112.151 179.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.5 p -64.58 -22.15 66.89 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 113.916 -1.493 . . . . 34.770000000000003 113.329 -177.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -62.41 -25.68 68.08 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.303 0.573 . . . . 38.450000000000003 110.265 174.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -115.32 12.96 16.52 Favored 'General case' 0 C--O 1.248 1.006 0 C-N-CA 119.082 -1.047 . . . . 48.149999999999999 111.57 -176.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 56.37 41.29 29.18 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 114.46 1.282 . . . . 70.879999999999995 114.46 -179.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 69.2 mt -81.81 105.18 11.4 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.658 0 N-CA-C 108.223 -1.028 . . . . 44.039999999999999 108.223 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 59.6 mt-30 -99.46 -176.48 3.3 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.649 1.18 . . . . 59.649999999999999 108.41 -176.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -53.8 140.18 30.82 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.484 0.55 . . . . 56.630000000000003 112.484 177.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 75.36 11.96 3.32 Favored 'General case' 0 CA--C 1.507 -0.707 0 O-C-N 123.947 0.78 . . . . 74.590000000000003 112.357 171.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.2 m -67.96 144.17 55.31 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.219 -0.66 . . . . 34.840000000000003 109.219 172.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.9 m -111.08 116.07 30.51 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.107 -1.442 . . . . 38.560000000000002 107.107 173.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 13.7 mt -87.16 153.14 21.74 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 106.012 -1.848 . . . . 38.350000000000001 106.012 173.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 43.8 m170 -108.09 128.22 54.48 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-O 121.994 0.902 . . . . 36.149999999999999 111.687 174.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 46.0 tp -93.14 132.31 37.39 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.835 -0.62 . . . . 32.130000000000003 110.767 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 48.0 t -125.02 140.82 47.0 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.779 0 N-CA-C 107.346 -1.353 . . . . 38.880000000000003 107.346 173.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 24.3 tp -80.23 147.02 31.4 Favored 'General case' 0 C--O 1.216 -0.694 0 N-CA-C 112.458 0.54 . . . . 49.68 112.458 -178.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 92.3 mtt-85 . . . . . 0 C--O 1.21 -0.982 0 C-N-CA 119.515 -0.874 . . . . 43.740000000000002 109.742 172.847 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 20.3 ptt? . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 116.499 2.037 . . . . 66.540000000000006 116.499 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' GLN . . . . . 0.432 ' NE2' ' OE2' ' B' ' 67' ' ' GLU . 23.5 tt0 -89.83 131.86 35.55 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.862 -1.063 . . . . 57.229999999999997 113.868 -178.345 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 23.0 pt -130.41 163.8 35.08 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 C-N-CA 119.417 -0.913 . . . . 43.630000000000003 110.987 167.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -117.68 151.64 36.83 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 121.732 0.777 . . . . 40.93 112.262 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 72.5 t -129.19 116.11 38.66 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 CA-C-N 114.212 -1.358 . . . . 38.090000000000003 111.326 175.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 27.1 mttm -79.19 116.74 19.65 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 118.515 -1.274 . . . . 74.209999999999994 109.611 175.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 14.0 p -78.18 -166.72 0.87 Allowed 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 113.336 0.865 . . . . 63.030000000000001 113.336 -170.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 57.5 mt -76.78 -32.12 57.47 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 120.107 -0.637 . . . . 66.980000000000004 112.622 -177.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 14.8 p -82.13 178.22 8.39 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 100.642 -3.836 . . . . 68.569999999999993 100.642 168.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.52 -7.17 38.82 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 116.954 -2.546 . . . . 70.430000000000007 115.695 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -74.02 153.2 39.79 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 114.625 1.343 . . . . 85.780000000000001 114.625 -165.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 61.9 m -114.04 130.07 56.57 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 106.679 -1.6 . . . . 55.380000000000003 106.679 -177.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ILE . . . . . . . . . . . . . 13.1 pt -104.8 154.11 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 CA-C-O 121.706 0.765 . . . . 52.340000000000003 109.477 171.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' THR . . . . . . . . . . . . . 8.2 t -110.13 137.67 47.56 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 105.895 -1.891 . . . . 56.780000000000001 105.895 -178.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 81.3 mt -122.74 143.97 49.47 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 108.593 -0.892 . . . . 49.380000000000003 108.593 175.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -98.82 124.5 43.76 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 106.838 -1.541 . . . . 75.819999999999993 106.838 171.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 35.9 m -136.68 164.89 29.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 112.068 0.395 . . . . 56.579999999999998 112.068 -170.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -100.99 149.45 36.23 Favored Pre-proline 0 N--CA 1.449 -0.483 0 N-CA-C 109.206 -0.664 . . . . 96.670000000000002 109.206 173.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -55.41 -39.31 91.73 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 124.827 3.685 . . . . 59.530000000000001 112.444 -177.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -97.8 13.9 28.86 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 114.356 1.243 . . . . 79.640000000000001 114.356 177.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -57.63 141.41 48.29 Favored 'General case' 0 CA--C 1.513 -0.466 0 O-C-N 121.379 -0.826 . . . . 52.060000000000002 109.786 174.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 52.1 p -75.95 161.81 28.61 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.154 -0.618 . . . . 42.020000000000003 110.448 178.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 29.3 mm -60.39 -37.2 73.57 Favored 'Isoleucine or valine' 0 C--O 1.247 0.969 0 CA-C-O 122.118 0.961 . . . . 36.18 109.661 174.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -53.9 -42.01 68.24 Favored 'General case' 0 C--O 1.257 1.453 0 CA-C-N 113.839 -1.528 . . . . 40.979999999999997 113.775 177.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.61 -36.07 82.64 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 124.653 1.221 . . . . 34.280000000000001 110.703 177.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ILE . . . . . . . . . . . . . 15.0 mm -69.13 -43.65 81.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 N-CA-C 109.906 -0.405 . . . . 36.82 109.906 177.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 77.1 mttt -63.28 -34.91 78.71 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 109.38 -0.6 . . . . 31.989999999999998 109.38 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.48 -37.92 74.32 Favored 'General case' 0 C--O 1.248 1.011 0 C-N-CA 120.54 -0.464 . . . . 31.719999999999999 110.905 -177.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -64.04 -37.34 87.06 Favored 'General case' 0 CA--C 1.557 1.247 0 O-C-N 123.343 0.402 . . . . 38.450000000000003 111.577 173.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 82.5 mt -68.3 -35.89 72.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-O 121.297 0.57 . . . . 31.879999999999999 110.39 172.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLN . . . . . . . . . . . . . 19.3 tm0? -62.95 -43.89 97.55 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 117.783 -1.567 . . . . 34.979999999999997 108.615 178.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -64.62 -32.96 74.84 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 115.306 1.595 . . . . 48.159999999999997 115.306 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 3.1 ptpt -101.93 -22.84 14.23 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 114.963 -2.695 . . . . 81.340000000000003 114.733 -175.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -106.27 -22.77 12.74 Favored 'General case' 0 C--O 1.238 0.483 0 O-C-N 123.511 0.507 . . . . 49.560000000000002 110.074 -179.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.34 14.18 80.66 Favored Glycine 0 N--CA 1.448 -0.557 0 N-CA-C 115.705 1.042 . . . . 32.560000000000002 115.705 177.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ILE . . . . . . . . . . . . . 33.3 mt -93.03 127.97 45.22 Favored Pre-proline 0 C--O 1.218 -0.596 0 C-N-CA 123.338 0.655 . . . . 35.020000000000003 110.072 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -61.35 143.85 98.12 Favored 'Trans proline' 0 C--O 1.252 1.224 0 C-N-CA 121.412 1.408 . . . . 30.039999999999999 112.789 179.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_exo -51.6 -40.14 64.6 Favored 'Trans proline' 0 C--N 1.347 0.478 0 O-C-N 123.228 1.12 . . . . 31.030000000000001 113.689 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -68.57 -12.27 61.08 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 113.246 0.832 . . . . 50.240000000000002 113.246 -178.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -105.09 2.91 29.84 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 121.226 -0.921 . . . . 42.630000000000003 110.561 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -97.69 131.93 43.79 Favored 'General case' 0 N--CA 1.442 -0.84 0 N-CA-C 109.201 -0.666 . . . . 46.140000000000001 109.201 177.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 39.8 ttm-85 -111.9 121.77 45.96 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 107.137 -1.431 . . . . 40.829999999999998 107.137 167.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 90.9 mt -107.81 137.61 45.51 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 109.31 -0.626 . . . . 37.619999999999997 109.31 178.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ILE . . . . . . . . . . . . . 11.4 mm -127.1 133.2 68.8 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 O-C-N 124.295 0.997 . . . . 38.530000000000001 110.484 -173.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -139.35 122.5 16.9 Favored 'General case' 0 CA--C 1.501 -0.933 0 C-N-CA 118.829 -1.148 . . . . 43.07 108.361 175.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . 49.5 39.89 17.83 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.811 0.694 . . . . 50.130000000000003 111.002 -174.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 85.65 -2.24 87.97 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 116.808 1.483 . . . . 49.5 116.808 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 41.6 mttt -106.48 142.19 36.55 Favored 'General case' 0 CA--C 1.5 -0.971 0 C-N-CA 123.646 0.778 . . . . 62.189999999999998 112.104 -174.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -85.19 136.8 33.37 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 105.381 -2.081 . . . . 41.560000000000002 105.381 179.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 17.8 mt -91.91 130.35 37.68 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 105.443 -2.058 . . . . 35.299999999999997 105.443 -175.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -105.32 155.17 19.34 Favored 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 116.249 1.944 . . . . 70.560000000000002 116.249 -174.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -54.18 144.22 20.53 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 113.881 -1.509 . . . . 45.93 109.537 -178.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' GLY . . . . . . . . . . . . . . . 85.22 -18.62 27.11 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.376 -0.916 . . . . 48.68 114.965 175.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -85.64 170.68 12.31 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.643 0.608 . . . . 50.350000000000001 112.643 177.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 39.0 p -121.04 164.92 16.04 Favored 'General case' 0 CA--C 1.505 -0.784 0 C-N-CA 119.813 -0.755 . . . . 41.990000000000002 109.76 -174.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 58.0 mt -57.33 -38.64 74.4 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 119.576 -0.849 . . . . 49.119999999999997 110.296 178.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 19.8 p -68.32 -24.63 64.86 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 118.495 -1.282 . . . . 59.5 112.25 -176.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -65.37 -25.34 67.53 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 111.963 0.357 . . . . 60.75 111.963 -179.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -109.46 11.07 25.16 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.955 0.724 . . . . 43.93 112.955 176.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 57.42 43.31 23.31 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.534 0.939 . . . . 75.719999999999999 113.534 -179.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 54.8 mt -87.02 109.85 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 108.229 -1.026 . . . . 49.520000000000003 108.229 176.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -100.66 179.56 4.38 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.758 0.823 . . . . 66.739999999999995 111.03 -179.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -55.69 140.6 40.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 120.813 -0.355 . . . . 57.020000000000003 110.612 175.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLU . . . . . 0.432 ' OE2' ' NE2' ' B' ' 5' ' ' GLN . 14.5 mm-40 72.4 14.95 5.28 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.767 0.827 . . . . 57.509999999999998 111.946 176.622 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' SER . . . . . . . . . . . . . 10.1 m -71.93 147.39 47.06 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 120.501 -0.48 . . . . 43.090000000000003 109.733 170.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' THR . . . . . . . . . . . . . 96.6 m -110.46 121.78 46.14 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 113.797 1.036 . . . . 43.359999999999999 113.797 175.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 11.2 mt -93.65 150.86 20.07 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.408 0.623 . . . . 37.530000000000001 111.683 172.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -110.24 122.5 47.8 Favored 'General case' 0 CA--C 1.495 -1.146 0 C-N-CA 119.333 -0.947 . . . . 52.420000000000002 111.153 174.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 30.3 tp -93.25 125.5 37.88 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.581 0.705 . . . . 41.119999999999997 112.21 176.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 42.2 t -125.53 138.55 54.05 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 N-CA-C 107.832 -1.173 . . . . 48.109999999999999 107.832 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 24.7 tp -79.02 140.95 37.83 Favored 'General case' 0 C--O 1.217 -0.626 0 N-CA-C 108.936 -0.764 . . . . 49.530000000000001 108.936 -176.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -112.9 130.67 56.03 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 112.659 0.614 . . . . 63.670000000000002 112.659 169.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 26.2 mt . . . . . 0 N--CA 1.446 -0.652 0 C-N-CA 119.061 -1.056 . . . . 65.329999999999998 111.058 172.218 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' SO4 . . . . . 0.473 ' O2 ' ' ND2' ' A' ' 2' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . 0.663 ' O ' ' NE2' ' A' ' 52' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . 0.433 ' O ' ' N ' ' A' ' 2' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ASN . . . . . 0.469 ' ND2' ' O2 ' ' A' ' 101' ' ' SO4 . 26.6 t30 . . . . . 0 CA--C 1.546 0.814 0 N-CA-C 113.897 1.073 . . . . 67.069999999999993 113.897 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -48.41 152.55 0.88 Allowed 'General case' 0 CA--C 1.553 1.069 0 N-CA-C 114.623 1.342 . . . . 48.780000000000001 114.623 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 15.5 ptt? -151.47 155.91 39.52 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 112.883 0.698 . . . . 58.969999999999999 112.883 175.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -93.03 129.37 38.98 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 124.085 0.954 . . . . 56.640000000000001 110.683 -178.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.1 pt -126.48 168.74 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.813 0 N-CA-C 108.873 -0.788 . . . . 41.729999999999997 108.873 168.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -124.13 152.59 42.6 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 114.064 1.135 . . . . 38.829999999999998 114.064 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 33.0 t -124.04 122.29 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.147 0 C-N-CA 118.16 -1.416 . . . . 33.229999999999997 107.474 173.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.3 tttp -77.94 112.98 15.4 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.325 -0.991 . . . . 67.950000000000003 108.325 172.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 8.2 p -81.74 -168.63 1.98 Allowed 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.602 -0.726 . . . . 43.009999999999998 111.378 -174.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.3 mt -76.78 -21.46 55.13 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 114.093 1.145 . . . . 43.549999999999997 114.093 -176.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 53.4 p -79.59 -16.25 56.2 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.167 0.803 . . . . 45.399999999999999 113.167 172.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 99.17 -13.43 61.79 Favored Glycine 0 CA--C 1.525 0.674 0 C-N-CA 119.081 -1.533 . . . . 43.049999999999997 111.294 -175.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -75.27 164.89 25.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.051 0.54 . . . . 57.5 109.715 171.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 30.0 p -117.28 145.06 44.22 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 121.433 0.635 . . . . 40.100000000000001 112.013 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 15.6 pt -107.27 154.57 8.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 C-N-CA 117.825 -1.55 . . . . 39.840000000000003 109.131 167.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 51.8 m -101.65 132.72 47.19 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.558 -0.905 . . . . 47.869999999999997 108.558 -176.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.8 mt -120.69 144.79 48.02 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 118.793 0.724 . . . . 38.049999999999997 112.072 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . 0.641 ' O ' ' NZ ' ' A' ' 32' ' ' LYS . 66.4 mm-40 -101.32 121.45 41.91 Favored 'General case' 0 CA--C 1.493 -1.247 0 N-CA-C 108.105 -1.072 . . . . 73.260000000000005 108.105 169.462 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.3 m -138.7 163.82 27.16 Favored 'Isoleucine or valine' 0 C--O 1.248 0.979 0 N-CA-C 108.483 -0.932 . . . . 41.899999999999999 108.483 -170.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -101.91 149.66 36.71 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 114.373 -1.285 . . . . 66.719999999999999 108.805 173.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -54.4 -40.27 83.78 Favored 'Trans proline' 0 CA--C 1.51 -0.708 0 C-N-CA 121.775 1.65 . . . . 48.079999999999998 113.216 -173.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -96.81 16.52 18.99 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 116.997 2.221 . . . . 39.670000000000002 116.997 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -56.25 143.04 35.26 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 110.247 -0.279 . . . . 41.18 110.247 177.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.9 p -73.36 160.86 31.18 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 118.217 -1.393 . . . . 34.920000000000002 109.357 176.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 25.6 mm -60.63 -34.2 57.66 Favored 'Isoleucine or valine' 0 C--O 1.244 0.808 0 N-CA-C 109.309 -0.626 . . . . 43.219999999999999 109.309 172.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -56.26 -39.83 73.23 Favored 'General case' 0 N--CA 1.485 1.289 0 CA-C-O 121.745 0.783 . . . . 52.950000000000003 112.29 176.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.69 -34.43 73.91 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 120.824 -1.173 . . . . 34.859999999999999 111.863 178.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ILE . . . . . 0.483 HG13 HD21 ' A' ' 59' ' ' LEU . 11.6 mm -65.98 -43.48 92.65 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 O-C-N 121.75 -0.594 . . . . 40.359999999999999 109.668 177.619 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -64.71 -34.95 79.53 Favored 'General case' 0 C--O 1.264 1.822 0 CA-C-O 121.6 0.714 . . . . 36.329999999999998 109.902 -177.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.88 -38.02 76.23 Favored 'General case' 0 N--CA 1.443 -0.822 0 C-N-CA 119.17 -1.012 . . . . 36.25 109.266 -178.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LYS . . . . . 0.641 ' NZ ' ' O ' ' A' ' 19' ' ' GLU . 89.5 mttt -65.59 -34.83 79.16 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.431 -0.793 . . . . 44.219999999999999 112.857 173.518 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 97.2 mt -66.26 -39.22 83.68 Favored 'Isoleucine or valine' 0 C--O 1.245 0.858 0 N-CA-C 108.767 -0.827 . . . . 36.119999999999997 108.767 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 18.3 tm0? -61.23 -44.48 97.2 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.327 0.392 . . . . 36.829999999999998 111.921 177.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -62.34 -28.67 69.91 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.66 0.615 . . . . 45.82 112.66 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -100.59 -31.14 11.39 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 114.357 1.243 . . . . 51.869999999999997 114.357 -176.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -106.14 -20.84 13.28 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.082 0.771 . . . . 44.32 113.082 -175.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.97 16.77 80.49 Favored Glycine 0 C--N 1.34 0.774 0 N-CA-C 114.762 0.665 . . . . 50.189999999999998 114.762 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 31.6 mt -95.67 126.36 45.65 Favored Pre-proline 0 C--N 1.324 -0.516 0 O-C-N 122.464 -0.433 . . . . 42.969999999999999 110.04 174.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -59.2 140.95 97.16 Favored 'Trans proline' 0 C--O 1.213 -0.772 0 CA-C-O 118.635 -0.652 . . . . 43.710000000000001 112.682 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -53.05 -34.75 69.3 Favored 'Trans proline' 0 CA--C 1.508 -0.784 0 O-C-N 123.114 1.06 . . . . 37.780000000000001 109.797 -178.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -68.34 -13.58 62.37 Favored 'General case' 0 C--O 1.213 -0.828 0 C-N-CA 117.022 -1.871 . . . . 45.009999999999998 112.801 -177.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -102.04 3.13 38.47 Favored 'General case' 0 C--O 1.26 1.631 0 CA-C-N 118.831 0.741 . . . . 61.920000000000002 112.781 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -96.26 133.63 40.37 Favored 'General case' 0 C--O 1.244 0.798 0 CA-C-N 115.859 -0.61 . . . . 46.479999999999997 110.793 178.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . 0.401 ' HG3' ' NH2' ' A' ' 75' ' ' ARG . 3.4 ttp180 -120.14 126.25 50.23 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 105.871 -1.9 . . . . 45.159999999999997 105.871 168.623 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 69.0 mt -115.93 138.03 51.56 Favored 'General case' 0 C--O 1.25 1.131 0 N-CA-C 115.528 1.677 . . . . 36.549999999999997 115.528 -178.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.5 mm -125.19 139.54 50.87 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 N-CA-C 109.018 -0.734 . . . . 44.899999999999999 109.018 -175.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PHE . . . . . 0.454 ' HB3' HD21 ' A' ' 53' ' ' LEU . 68.8 t80 -140.0 126.52 20.3 Favored 'General case' 0 C--O 1.25 1.092 0 N-CA-C 111.312 0.115 . . . . 41.009999999999998 111.312 169.485 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 45.39 43.47 8.58 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.247 0.546 . . . . 41.990000000000002 111.959 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 86.49 0.04 86.66 Favored Glycine 0 C--O 1.209 -1.433 0 N-CA-C 115.502 0.961 . . . . 45.0 115.502 176.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.6 mttt -111.05 139.85 46.07 Favored 'General case' 0 C--O 1.244 0.779 0 CA-C-N 117.977 0.889 . . . . 66.859999999999999 111.606 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLN . . . . . 0.663 ' NE2' ' O ' ' A' ' 202' ' ' HOH . 7.3 tp60 -74.96 123.03 24.4 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-N 115.008 -0.996 . . . . 43.710000000000001 109.053 172.261 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . 0.454 HD21 ' HB3' ' A' ' 48' ' ' PHE . 8.0 mt -89.81 113.66 25.26 Favored 'General case' 0 C--O 1.219 -0.519 0 C-N-CA 119.706 -0.797 . . . . 42.0 109.734 -178.326 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . 0.415 ' HG3' ' HG3' ' A' ' 57' ' ' LYS . 6.5 pt-20 -108.63 152.13 25.2 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 116.686 2.106 . . . . 79.530000000000001 116.686 -172.793 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -57.63 145.06 35.28 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.535 -0.757 . . . . 56.079999999999998 110.811 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.33 -20.55 33.34 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 115.34 -0.845 . . . . 55.340000000000003 111.142 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . 0.415 ' HG3' ' HG3' ' A' ' 54' ' ' GLU . 23.3 mmmt -88.09 176.97 7.05 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 107.763 -1.199 . . . . 45.609999999999999 107.763 176.629 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.0 p -126.83 166.04 18.2 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 122.005 -0.434 . . . . 38.82 110.252 -175.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LEU . . . . . 0.483 HD21 HG13 ' A' ' 29' ' ' ILE . 58.8 mt -58.34 -41.71 85.23 Favored 'General case' 0 C--O 1.255 1.367 0 CA-C-O 122.332 1.063 . . . . 42.719999999999999 112.151 179.912 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.5 p -64.58 -22.15 66.89 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 113.916 -1.493 . . . . 34.770000000000003 113.329 -177.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -62.41 -25.68 68.08 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.303 0.573 . . . . 38.450000000000003 110.265 174.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -115.32 12.96 16.52 Favored 'General case' 0 C--O 1.248 1.006 0 C-N-CA 119.082 -1.047 . . . . 48.149999999999999 111.57 -176.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 56.37 41.29 29.18 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 114.46 1.282 . . . . 70.879999999999995 114.46 -179.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 69.2 mt -81.81 105.18 11.4 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.658 0 N-CA-C 108.223 -1.028 . . . . 44.039999999999999 108.223 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 59.6 mt-30 -99.46 -176.48 3.3 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.649 1.18 . . . . 59.649999999999999 108.41 -176.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -53.8 140.18 30.82 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.484 0.55 . . . . 56.630000000000003 112.484 177.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 75.36 11.96 3.32 Favored 'General case' 0 CA--C 1.507 -0.707 0 O-C-N 123.947 0.78 . . . . 74.590000000000003 112.357 171.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.2 m -67.96 144.17 55.31 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.219 -0.66 . . . . 34.840000000000003 109.219 172.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.9 m -111.08 116.07 30.51 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.107 -1.442 . . . . 38.560000000000002 107.107 173.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 13.7 mt -87.16 153.14 21.74 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 106.012 -1.848 . . . . 38.350000000000001 106.012 173.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 43.8 m170 -108.09 128.22 54.48 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-O 121.994 0.902 . . . . 36.149999999999999 111.687 174.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 46.0 tp -93.14 132.31 37.39 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.835 -0.62 . . . . 32.130000000000003 110.767 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 48.0 t -125.02 140.82 47.0 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.779 0 N-CA-C 107.346 -1.353 . . . . 38.880000000000003 107.346 173.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 24.3 tp -80.23 147.02 31.4 Favored 'General case' 0 C--O 1.216 -0.694 0 N-CA-C 112.458 0.54 . . . . 49.68 112.458 -178.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ARG . . . . . 0.401 ' NH2' ' HG3' ' A' ' 45' ' ' ARG . 92.3 mtt-85 . . . . . 0 C--O 1.21 -0.982 0 C-N-CA 119.515 -0.874 . . . . 43.740000000000002 109.742 172.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 20.3 ptt? . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 116.499 2.037 . . . . 66.540000000000006 116.499 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -89.83 131.86 35.55 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.862 -1.063 . . . . 57.229999999999997 113.868 -178.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 23.0 pt -130.41 163.8 35.08 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 C-N-CA 119.417 -0.913 . . . . 43.630000000000003 110.987 167.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -117.68 151.64 36.83 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 121.732 0.777 . . . . 40.93 112.262 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 72.5 t -129.19 116.11 38.66 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 CA-C-N 114.212 -1.358 . . . . 38.090000000000003 111.326 175.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 27.1 mttm -79.19 116.74 19.65 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 118.515 -1.274 . . . . 74.209999999999994 109.611 175.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 14.0 p -78.18 -166.72 0.87 Allowed 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 113.336 0.865 . . . . 63.030000000000001 113.336 -170.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 57.5 mt -76.78 -32.12 57.47 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 120.107 -0.637 . . . . 66.980000000000004 112.622 -177.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 14.8 p -82.13 178.22 8.39 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 100.642 -3.836 . . . . 68.569999999999993 100.642 168.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.52 -7.17 38.82 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 116.954 -2.546 . . . . 70.430000000000007 115.695 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -74.02 153.2 39.79 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 114.625 1.343 . . . . 85.780000000000001 114.625 -165.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 61.9 m -114.04 130.07 56.57 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 106.679 -1.6 . . . . 55.380000000000003 106.679 -177.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ILE . . . . . . . . . . . . . 13.1 pt -104.8 154.11 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 CA-C-O 121.706 0.765 . . . . 52.340000000000003 109.477 171.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' THR . . . . . . . . . . . . . 8.2 t -110.13 137.67 47.56 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 105.895 -1.891 . . . . 56.780000000000001 105.895 -178.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 81.3 mt -122.74 143.97 49.47 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 108.593 -0.892 . . . . 49.380000000000003 108.593 175.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -98.82 124.5 43.76 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 106.838 -1.541 . . . . 75.819999999999993 106.838 171.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 35.9 m -136.68 164.89 29.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 112.068 0.395 . . . . 56.579999999999998 112.068 -170.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -100.99 149.45 36.23 Favored Pre-proline 0 N--CA 1.449 -0.483 0 N-CA-C 109.206 -0.664 . . . . 96.670000000000002 109.206 173.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -55.41 -39.31 91.73 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 124.827 3.685 . . . . 59.530000000000001 112.444 -177.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -97.8 13.9 28.86 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 114.356 1.243 . . . . 79.640000000000001 114.356 177.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -57.63 141.41 48.29 Favored 'General case' 0 CA--C 1.513 -0.466 0 O-C-N 121.379 -0.826 . . . . 52.060000000000002 109.786 174.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 52.1 p -75.95 161.81 28.61 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.154 -0.618 . . . . 42.020000000000003 110.448 178.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 29.3 mm -60.39 -37.2 73.57 Favored 'Isoleucine or valine' 0 C--O 1.247 0.969 0 CA-C-O 122.118 0.961 . . . . 36.18 109.661 174.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -53.9 -42.01 68.24 Favored 'General case' 0 C--O 1.257 1.453 0 CA-C-N 113.839 -1.528 . . . . 40.979999999999997 113.775 177.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.61 -36.07 82.64 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 124.653 1.221 . . . . 34.280000000000001 110.703 177.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ILE . . . . . . . . . . . . . 15.0 mm -69.13 -43.65 81.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 N-CA-C 109.906 -0.405 . . . . 36.82 109.906 177.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 77.1 mttt -63.28 -34.91 78.71 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 109.38 -0.6 . . . . 31.989999999999998 109.38 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.48 -37.92 74.32 Favored 'General case' 0 C--O 1.248 1.011 0 C-N-CA 120.54 -0.464 . . . . 31.719999999999999 110.905 -177.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -64.04 -37.34 87.06 Favored 'General case' 0 CA--C 1.557 1.247 0 O-C-N 123.343 0.402 . . . . 38.450000000000003 111.577 173.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 82.5 mt -68.3 -35.89 72.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-O 121.297 0.57 . . . . 31.879999999999999 110.39 172.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLN . . . . . . . . . . . . . 19.3 tm0? -62.95 -43.89 97.55 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 117.783 -1.567 . . . . 34.979999999999997 108.615 178.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -64.62 -32.96 74.84 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 115.306 1.595 . . . . 48.159999999999997 115.306 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 3.1 ptpt -101.93 -22.84 14.23 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 114.963 -2.695 . . . . 81.340000000000003 114.733 -175.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -106.27 -22.77 12.74 Favored 'General case' 0 C--O 1.238 0.483 0 O-C-N 123.511 0.507 . . . . 49.560000000000002 110.074 -179.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.34 14.18 80.66 Favored Glycine 0 N--CA 1.448 -0.557 0 N-CA-C 115.705 1.042 . . . . 32.560000000000002 115.705 177.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ILE . . . . . . . . . . . . . 33.3 mt -93.03 127.97 45.22 Favored Pre-proline 0 C--O 1.218 -0.596 0 C-N-CA 123.338 0.655 . . . . 35.020000000000003 110.072 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -61.35 143.85 98.12 Favored 'Trans proline' 0 C--O 1.252 1.224 0 C-N-CA 121.412 1.408 . . . . 30.039999999999999 112.789 179.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_exo -51.6 -40.14 64.6 Favored 'Trans proline' 0 C--N 1.347 0.478 0 O-C-N 123.228 1.12 . . . . 31.030000000000001 113.689 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -68.57 -12.27 61.08 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 113.246 0.832 . . . . 50.240000000000002 113.246 -178.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -105.09 2.91 29.84 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 121.226 -0.921 . . . . 42.630000000000003 110.561 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -97.69 131.93 43.79 Favored 'General case' 0 N--CA 1.442 -0.84 0 N-CA-C 109.201 -0.666 . . . . 46.140000000000001 109.201 177.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 39.8 ttm-85 -111.9 121.77 45.96 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 107.137 -1.431 . . . . 40.829999999999998 107.137 167.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 90.9 mt -107.81 137.61 45.51 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 109.31 -0.626 . . . . 37.619999999999997 109.31 178.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ILE . . . . . 0.41 ' HB ' ' HB2' ' B' ' 71' ' ' HIS . 11.4 mm -127.1 133.2 68.8 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 O-C-N 124.295 0.997 . . . . 38.530000000000001 110.484 -173.115 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -139.35 122.5 16.9 Favored 'General case' 0 CA--C 1.501 -0.933 0 C-N-CA 118.829 -1.148 . . . . 43.07 108.361 175.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . 49.5 39.89 17.83 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.811 0.694 . . . . 50.130000000000003 111.002 -174.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 85.65 -2.24 87.97 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 116.808 1.483 . . . . 49.5 116.808 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 41.6 mttt -106.48 142.19 36.55 Favored 'General case' 0 CA--C 1.5 -0.971 0 C-N-CA 123.646 0.778 . . . . 62.189999999999998 112.104 -174.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -85.19 136.8 33.37 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 105.381 -2.081 . . . . 41.560000000000002 105.381 179.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 17.8 mt -91.91 130.35 37.68 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 105.443 -2.058 . . . . 35.299999999999997 105.443 -175.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' GLU . . . . . 0.577 ' HG2' ' OH ' ' B' ' 62' ' ' TYR . 7.4 pt-20 -105.32 155.17 19.34 Favored 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 116.249 1.944 . . . . 70.560000000000002 116.249 -174.297 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -54.18 144.22 20.53 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 113.881 -1.509 . . . . 45.93 109.537 -178.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' GLY . . . . . . . . . . . . . . . 85.22 -18.62 27.11 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.376 -0.916 . . . . 48.68 114.965 175.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -85.64 170.68 12.31 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.643 0.608 . . . . 50.350000000000001 112.643 177.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 39.0 p -121.04 164.92 16.04 Favored 'General case' 0 CA--C 1.505 -0.784 0 C-N-CA 119.813 -0.755 . . . . 41.990000000000002 109.76 -174.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 58.0 mt -57.33 -38.64 74.4 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 119.576 -0.849 . . . . 49.119999999999997 110.296 178.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 19.8 p -68.32 -24.63 64.86 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 118.495 -1.282 . . . . 59.5 112.25 -176.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -65.37 -25.34 67.53 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 111.963 0.357 . . . . 60.75 111.963 -179.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' TYR . . . . . 0.577 ' OH ' ' HG2' ' B' ' 54' ' ' GLU . 96.1 m-85 -109.46 11.07 25.16 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.955 0.724 . . . . 43.93 112.955 176.873 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 57.42 43.31 23.31 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.534 0.939 . . . . 75.719999999999999 113.534 -179.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 54.8 mt -87.02 109.85 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 108.229 -1.026 . . . . 49.520000000000003 108.229 176.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -100.66 179.56 4.38 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.758 0.823 . . . . 66.739999999999995 111.03 -179.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -55.69 140.6 40.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 120.813 -0.355 . . . . 57.020000000000003 110.612 175.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 72.4 14.95 5.28 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.767 0.827 . . . . 57.509999999999998 111.946 176.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' SER . . . . . . . . . . . . . 10.1 m -71.93 147.39 47.06 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 120.501 -0.48 . . . . 43.090000000000003 109.733 170.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' THR . . . . . . . . . . . . . 96.6 m -110.46 121.78 46.14 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 113.797 1.036 . . . . 43.359999999999999 113.797 175.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 11.2 mt -93.65 150.86 20.07 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.408 0.623 . . . . 37.530000000000001 111.683 172.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' HIS . . . . . 0.41 ' HB2' ' HB ' ' B' ' 47' ' ' ILE . 82.9 m-70 -110.24 122.5 47.8 Favored 'General case' 0 CA--C 1.495 -1.146 0 C-N-CA 119.333 -0.947 . . . . 52.420000000000002 111.153 174.504 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 30.3 tp -93.25 125.5 37.88 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.581 0.705 . . . . 41.119999999999997 112.21 176.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 42.2 t -125.53 138.55 54.05 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 N-CA-C 107.832 -1.173 . . . . 48.109999999999999 107.832 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 24.7 tp -79.02 140.95 37.83 Favored 'General case' 0 C--O 1.217 -0.626 0 N-CA-C 108.936 -0.764 . . . . 49.530000000000001 108.936 -176.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -112.9 130.67 56.03 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 112.659 0.614 . . . . 63.670000000000002 112.659 169.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 26.2 mt . . . . . 0 N--CA 1.446 -0.652 0 C-N-CA 119.061 -1.056 . . . . 65.329999999999998 111.058 172.218 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' SO4 . . . . . 0.469 ' O2 ' ' ND2' ' A' ' 2' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . 0.663 ' O ' ' NE2' ' A' ' 52' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . 0.433 ' O ' ' N ' ' A' ' 2' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.469 ' ND2' ' O2 ' ' A' ' 101' ' ' SO4 . 26.6 t30 . . . . . 0 CA--C 1.546 0.814 0 N-CA-C 113.897 1.073 . . . . 67.07 113.897 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -48.41 152.55 0.88 Allowed 'General case' 0 CA--C 1.553 1.069 0 N-CA-C 114.623 1.342 . . . . 48.78 114.623 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 15.5 ptt? -151.47 155.91 39.52 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 112.883 0.698 . . . . 58.97 112.883 175.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -93.03 129.37 38.98 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 124.085 0.954 . . . . 56.64 110.683 -178.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.1 pt -126.48 168.74 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.813 0 N-CA-C 108.873 -0.788 . . . . 41.73 108.873 168.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -124.13 152.59 42.6 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 114.064 1.135 . . . . 38.83 114.064 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 33.0 t -124.04 122.29 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.147 0 C-N-CA 118.16 -1.416 . . . . 33.23 107.474 173.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.3 tttp -77.94 112.98 15.4 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.325 -0.991 . . . . 67.95 108.325 172.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 8.2 p -81.74 -168.63 1.98 Allowed 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.602 -0.726 . . . . 43.01 111.378 -174.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.3 mt -76.78 -21.46 55.13 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 114.093 1.145 . . . . 43.55 114.093 -176.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 53.4 p -79.59 -16.25 56.2 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.167 0.803 . . . . 45.4 113.167 172.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 99.17 -13.43 61.79 Favored Glycine 0 CA--C 1.525 0.674 0 C-N-CA 119.081 -1.533 . . . . 43.05 111.294 -175.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -75.27 164.89 25.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.051 0.54 . . . . 57.5 109.715 171.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 30.0 p -117.28 145.06 44.22 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 121.433 0.635 . . . . 40.1 112.013 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 15.6 pt -107.27 154.57 8.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 C-N-CA 117.825 -1.55 . . . . 39.84 109.131 167.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 51.8 m -101.65 132.72 47.19 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.558 -0.905 . . . . 47.87 108.558 -176.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.8 mt -120.69 144.79 48.02 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 118.793 0.724 . . . . 38.05 112.072 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.641 ' O ' ' NZ ' ' A' ' 32' ' ' LYS . 66.4 mm-40 -101.32 121.45 41.91 Favored 'General case' 0 CA--C 1.493 -1.247 0 N-CA-C 108.105 -1.072 . . . . 73.26 108.105 169.462 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.3 m -138.7 163.82 27.16 Favored 'Isoleucine or valine' 0 C--O 1.248 0.979 0 N-CA-C 108.483 -0.932 . . . . 41.9 108.483 -170.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -101.91 149.66 36.71 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 114.373 -1.285 . . . . 66.72 108.805 173.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -54.4 -40.27 83.78 Favored 'Trans proline' 0 CA--C 1.51 -0.708 0 C-N-CA 121.775 1.65 . . . . 48.08 113.216 -173.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -96.81 16.52 18.99 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 116.997 2.221 . . . . 39.67 116.997 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -56.25 143.04 35.26 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 110.247 -0.279 . . . . 41.18 110.247 177.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.9 p -73.36 160.86 31.18 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 118.217 -1.393 . . . . 34.92 109.357 176.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 25.6 mm -60.63 -34.2 57.66 Favored 'Isoleucine or valine' 0 C--O 1.244 0.808 0 N-CA-C 109.309 -0.626 . . . . 43.22 109.309 172.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -56.26 -39.83 73.23 Favored 'General case' 0 N--CA 1.485 1.289 0 CA-C-O 121.745 0.783 . . . . 52.95 112.29 176.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.69 -34.43 73.91 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 120.824 -1.173 . . . . 34.86 111.863 178.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.483 HG13 HD21 ' A' ' 59' ' ' LEU . 11.6 mm -65.98 -43.48 92.65 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 O-C-N 121.75 -0.594 . . . . 40.36 109.668 177.619 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -64.71 -34.95 79.53 Favored 'General case' 0 C--O 1.264 1.822 0 CA-C-O 121.6 0.714 . . . . 36.33 109.902 -177.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.88 -38.02 76.23 Favored 'General case' 0 N--CA 1.443 -0.822 0 C-N-CA 119.17 -1.012 . . . . 36.25 109.266 -178.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.641 ' NZ ' ' O ' ' A' ' 19' ' ' GLU . 89.5 mttt -65.59 -34.83 79.16 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.431 -0.793 . . . . 44.22 112.857 173.518 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 97.2 mt -66.26 -39.22 83.68 Favored 'Isoleucine or valine' 0 C--O 1.245 0.858 0 N-CA-C 108.767 -0.827 . . . . 36.12 108.767 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 18.3 tm0? -61.23 -44.48 97.2 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.327 0.392 . . . . 36.83 111.921 177.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -62.34 -28.67 69.91 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.66 0.615 . . . . 45.82 112.66 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -100.59 -31.14 11.39 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 114.357 1.243 . . . . 51.87 114.357 -176.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -106.14 -20.84 13.28 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.082 0.771 . . . . 44.32 113.082 -175.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.97 16.77 80.49 Favored Glycine 0 C--N 1.34 0.774 0 N-CA-C 114.762 0.665 . . . . 50.19 114.762 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 31.6 mt -95.67 126.36 45.65 Favored Pre-proline 0 C--N 1.324 -0.516 0 O-C-N 122.464 -0.433 . . . . 42.97 110.04 174.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -59.2 140.95 97.16 Favored 'Trans proline' 0 C--O 1.213 -0.772 0 CA-C-O 118.635 -0.652 . . . . 43.71 112.682 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -53.05 -34.75 69.3 Favored 'Trans proline' 0 CA--C 1.508 -0.784 0 O-C-N 123.114 1.06 . . . . 37.78 109.797 -178.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -68.34 -13.58 62.37 Favored 'General case' 0 C--O 1.213 -0.828 0 C-N-CA 117.022 -1.871 . . . . 45.01 112.801 -177.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -102.04 3.13 38.47 Favored 'General case' 0 C--O 1.26 1.631 0 CA-C-N 118.831 0.741 . . . . 61.92 112.781 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -96.26 133.63 40.37 Favored 'General case' 0 C--O 1.244 0.798 0 CA-C-N 115.859 -0.61 . . . . 46.48 110.793 178.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.401 ' HG3' ' NH2' ' A' ' 75' ' ' ARG . 3.4 ttp180 -120.14 126.25 50.23 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 105.871 -1.9 . . . . 45.16 105.871 168.623 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 69.0 mt -115.93 138.03 51.56 Favored 'General case' 0 C--O 1.25 1.131 0 N-CA-C 115.528 1.677 . . . . 36.55 115.528 -178.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.5 mm -125.19 139.54 50.87 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 N-CA-C 109.018 -0.734 . . . . 44.9 109.018 -175.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.454 ' HB3' HD21 ' A' ' 53' ' ' LEU . 68.8 t80 -140.0 126.52 20.3 Favored 'General case' 0 C--O 1.25 1.092 0 N-CA-C 111.312 0.115 . . . . 41.01 111.312 169.485 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 45.39 43.47 8.58 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.247 0.546 . . . . 41.99 111.959 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 86.49 0.04 86.66 Favored Glycine 0 C--O 1.209 -1.433 0 N-CA-C 115.502 0.961 . . . . 45.0 115.502 176.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.6 mttt -111.05 139.85 46.07 Favored 'General case' 0 C--O 1.244 0.779 0 CA-C-N 117.977 0.889 . . . . 66.86 111.606 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.663 ' NE2' ' O ' ' A' ' 202' ' ' HOH . 7.3 tp60 -74.96 123.03 24.4 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-N 115.008 -0.996 . . . . 43.71 109.053 172.261 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.454 HD21 ' HB3' ' A' ' 48' ' ' PHE . 8.0 mt -89.81 113.66 25.26 Favored 'General case' 0 C--O 1.219 -0.519 0 C-N-CA 119.706 -0.797 . . . . 42.0 109.734 -178.326 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.415 ' HG3' ' HG3' ' A' ' 57' ' ' LYS . 6.5 pt-20 -108.63 152.13 25.2 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 116.686 2.106 . . . . 79.53 116.686 -172.793 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -57.63 145.06 35.28 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.535 -0.757 . . . . 56.08 110.811 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.33 -20.55 33.34 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 115.34 -0.845 . . . . 55.34 111.142 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.415 ' HG3' ' HG3' ' A' ' 54' ' ' GLU . 23.3 mmmt -88.09 176.97 7.05 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 107.763 -1.199 . . . . 45.61 107.763 176.629 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.0 p -126.83 166.04 18.2 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 122.005 -0.434 . . . . 38.82 110.252 -175.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.483 HD21 HG13 ' A' ' 29' ' ' ILE . 58.8 mt -58.34 -41.71 85.23 Favored 'General case' 0 C--O 1.255 1.367 0 CA-C-O 122.332 1.063 . . . . 42.72 112.151 179.912 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.5 p -64.58 -22.15 66.89 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 113.916 -1.493 . . . . 34.77 113.329 -177.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -62.41 -25.68 68.08 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.303 0.573 . . . . 38.45 110.265 174.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -115.32 12.96 16.52 Favored 'General case' 0 C--O 1.248 1.006 0 C-N-CA 119.082 -1.047 . . . . 48.15 111.57 -176.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 56.37 41.29 29.18 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 114.46 1.282 . . . . 70.88 114.46 -179.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 69.2 mt -81.81 105.18 11.4 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.658 0 N-CA-C 108.223 -1.028 . . . . 44.04 108.223 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 59.6 mt-30 -99.46 -176.48 3.3 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.649 1.18 . . . . 59.65 108.41 -176.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -53.8 140.18 30.82 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.484 0.55 . . . . 56.63 112.484 177.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 75.36 11.96 3.32 Favored 'General case' 0 CA--C 1.507 -0.707 0 O-C-N 123.947 0.78 . . . . 74.59 112.357 171.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.2 m -67.96 144.17 55.31 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.219 -0.66 . . . . 34.84 109.219 172.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.9 m -111.08 116.07 30.51 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.107 -1.442 . . . . 38.56 107.107 173.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 13.7 mt -87.16 153.14 21.74 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 106.012 -1.848 . . . . 38.35 106.012 173.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 43.8 m170 -108.09 128.22 54.48 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-O 121.994 0.902 . . . . 36.15 111.687 174.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 46.0 tp -93.14 132.31 37.39 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.835 -0.62 . . . . 32.13 110.767 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 48.0 t -125.02 140.82 47.0 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.779 0 N-CA-C 107.346 -1.353 . . . . 38.88 107.346 173.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 24.3 tp -80.23 147.02 31.4 Favored 'General case' 0 C--O 1.216 -0.694 0 N-CA-C 112.458 0.54 . . . . 49.68 112.458 -178.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.401 ' NH2' ' HG3' ' A' ' 45' ' ' ARG . 92.3 mtt-85 . . . . . 0 C--O 1.21 -0.982 0 C-N-CA 119.515 -0.874 . . . . 43.74 109.742 172.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' MET . . . . . . . . . . . . . 20.3 ptt? . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 116.499 2.037 . . . . 66.54 116.499 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -89.83 131.86 35.55 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.862 -1.063 . . . . 57.23 113.868 -178.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 23.0 pt -130.41 163.8 35.08 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 C-N-CA 119.417 -0.913 . . . . 43.63 110.987 167.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -117.68 151.64 36.83 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 121.732 0.777 . . . . 40.93 112.262 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 72.5 t -129.19 116.11 38.66 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 CA-C-N 114.212 -1.358 . . . . 38.09 111.326 175.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 27.1 mttm -79.19 116.74 19.65 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 118.515 -1.274 . . . . 74.21 109.611 175.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 14.0 p -78.18 -166.72 0.87 Allowed 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 113.336 0.865 . . . . 63.03 113.336 -170.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 57.5 mt -76.78 -32.12 57.47 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 120.107 -0.637 . . . . 66.98 112.622 -177.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 14.8 p -82.13 178.22 8.39 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 100.642 -3.836 . . . . 68.57 100.642 168.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.52 -7.17 38.82 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 116.954 -2.546 . . . . 70.43 115.695 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -74.02 153.2 39.79 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 114.625 1.343 . . . . 85.78 114.625 -165.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 61.9 m -114.04 130.07 56.57 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 106.679 -1.6 . . . . 55.38 106.679 -177.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ILE . . . . . . . . . . . . . 13.1 pt -104.8 154.11 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 CA-C-O 121.706 0.765 . . . . 52.34 109.477 171.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' THR . . . . . . . . . . . . . 8.2 t -110.13 137.67 47.56 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 105.895 -1.891 . . . . 56.78 105.895 -178.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 81.3 mt -122.74 143.97 49.47 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 108.593 -0.892 . . . . 49.38 108.593 175.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -98.82 124.5 43.76 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 106.838 -1.541 . . . . 75.82 106.838 171.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 35.9 m -136.68 164.89 29.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 112.068 0.395 . . . . 56.58 112.068 -170.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -100.99 149.45 36.23 Favored Pre-proline 0 N--CA 1.449 -0.483 0 N-CA-C 109.206 -0.664 . . . . 96.67 109.206 173.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -55.41 -39.31 91.73 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 124.827 3.685 . . . . 59.53 112.444 -177.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -97.8 13.9 28.86 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 114.356 1.243 . . . . 79.64 114.356 177.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -57.63 141.41 48.29 Favored 'General case' 0 CA--C 1.513 -0.466 0 O-C-N 121.379 -0.826 . . . . 52.06 109.786 174.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 52.1 p -75.95 161.81 28.61 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.154 -0.618 . . . . 42.02 110.448 178.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 29.3 mm -60.39 -37.2 73.57 Favored 'Isoleucine or valine' 0 C--O 1.247 0.969 0 CA-C-O 122.118 0.961 . . . . 36.18 109.661 174.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -53.9 -42.01 68.24 Favored 'General case' 0 C--O 1.257 1.453 0 CA-C-N 113.839 -1.528 . . . . 40.98 113.775 177.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.61 -36.07 82.64 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 124.653 1.221 . . . . 34.28 110.703 177.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ILE . . . . . . . . . . . . . 15.0 mm -69.13 -43.65 81.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 N-CA-C 109.906 -0.405 . . . . 36.82 109.906 177.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 77.1 mttt -63.28 -34.91 78.71 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 109.38 -0.6 . . . . 31.99 109.38 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.48 -37.92 74.32 Favored 'General case' 0 C--O 1.248 1.011 0 C-N-CA 120.54 -0.464 . . . . 31.72 110.905 -177.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -64.04 -37.34 87.06 Favored 'General case' 0 CA--C 1.557 1.247 0 O-C-N 123.343 0.402 . . . . 38.45 111.577 173.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 82.5 mt -68.3 -35.89 72.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-O 121.297 0.57 . . . . 31.88 110.39 172.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLN . . . . . . . . . . . . . 19.3 tm0? -62.95 -43.89 97.55 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 117.783 -1.567 . . . . 34.98 108.615 178.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -64.62 -32.96 74.84 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 115.306 1.595 . . . . 48.16 115.306 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 3.1 ptpt -101.93 -22.84 14.23 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 114.963 -2.695 . . . . 81.34 114.733 -175.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -106.27 -22.77 12.74 Favored 'General case' 0 C--O 1.238 0.483 0 O-C-N 123.511 0.507 . . . . 49.56 110.074 -179.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.34 14.18 80.66 Favored Glycine 0 N--CA 1.448 -0.557 0 N-CA-C 115.705 1.042 . . . . 32.56 115.705 177.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ILE . . . . . . . . . . . . . 33.3 mt -93.03 127.97 45.22 Favored Pre-proline 0 C--O 1.218 -0.596 0 C-N-CA 123.338 0.655 . . . . 35.02 110.072 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -61.35 143.85 98.12 Favored 'Trans proline' 0 C--O 1.252 1.224 0 C-N-CA 121.412 1.408 . . . . 30.04 112.789 179.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_exo -51.6 -40.14 64.6 Favored 'Trans proline' 0 C--N 1.347 0.478 0 O-C-N 123.228 1.12 . . . . 31.03 113.689 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -68.57 -12.27 61.08 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 113.246 0.832 . . . . 50.24 113.246 -178.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -105.09 2.91 29.84 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 121.226 -0.921 . . . . 42.63 110.561 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -97.69 131.93 43.79 Favored 'General case' 0 N--CA 1.442 -0.84 0 N-CA-C 109.201 -0.666 . . . . 46.14 109.201 177.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 39.8 ttm-85 -111.9 121.77 45.96 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 107.137 -1.431 . . . . 40.83 107.137 167.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 90.9 mt -107.81 137.61 45.51 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 109.31 -0.626 . . . . 37.62 109.31 178.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.41 ' HB ' ' HB2' ' B' ' 71' ' ' HIS . 11.4 mm -127.1 133.2 68.8 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 O-C-N 124.295 0.997 . . . . 38.53 110.484 -173.115 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -139.35 122.5 16.9 Favored 'General case' 0 CA--C 1.501 -0.933 0 C-N-CA 118.829 -1.148 . . . . 43.07 108.361 175.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . 49.5 39.89 17.83 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.811 0.694 . . . . 50.13 111.002 -174.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 85.65 -2.24 87.97 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 116.808 1.483 . . . . 49.5 116.808 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 41.6 mttt -106.48 142.19 36.55 Favored 'General case' 0 CA--C 1.5 -0.971 0 C-N-CA 123.646 0.778 . . . . 62.19 112.104 -174.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -85.19 136.8 33.37 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 105.381 -2.081 . . . . 41.56 105.381 179.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 17.8 mt -91.91 130.35 37.68 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 105.443 -2.058 . . . . 35.3 105.443 -175.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' GLU . . . . . 0.577 ' HG2' ' OH ' ' B' ' 62' ' ' TYR . 7.4 pt-20 -105.32 155.17 19.34 Favored 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 116.249 1.944 . . . . 70.56 116.249 -174.297 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -54.18 144.22 20.53 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 113.881 -1.509 . . . . 45.93 109.537 -178.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' GLY . . . . . . . . . . . . . . . 85.22 -18.62 27.11 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.376 -0.916 . . . . 48.68 114.965 175.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -85.64 170.68 12.31 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.643 0.608 . . . . 50.35 112.643 177.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 39.0 p -121.04 164.92 16.04 Favored 'General case' 0 CA--C 1.505 -0.784 0 C-N-CA 119.813 -0.755 . . . . 41.99 109.76 -174.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 58.0 mt -57.33 -38.64 74.4 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 119.576 -0.849 . . . . 49.12 110.296 178.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 19.8 p -68.32 -24.63 64.86 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 118.495 -1.282 . . . . 59.5 112.25 -176.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -65.37 -25.34 67.53 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 111.963 0.357 . . . . 60.75 111.963 -179.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' TYR . . . . . 0.577 ' OH ' ' HG2' ' B' ' 54' ' ' GLU . 96.1 m-85 -109.46 11.07 25.16 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.955 0.724 . . . . 43.93 112.955 176.873 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 57.42 43.31 23.31 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.534 0.939 . . . . 75.72 113.534 -179.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 54.8 mt -87.02 109.85 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 108.229 -1.026 . . . . 49.52 108.229 176.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -100.66 179.56 4.38 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.758 0.823 . . . . 66.74 111.03 -179.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -55.69 140.6 40.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 120.813 -0.355 . . . . 57.02 110.612 175.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 72.4 14.95 5.28 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.767 0.827 . . . . 57.51 111.946 176.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' SER . . . . . . . . . . . . . 10.1 m -71.93 147.39 47.06 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 120.501 -0.48 . . . . 43.09 109.733 170.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' THR . . . . . . . . . . . . . 96.6 m -110.46 121.78 46.14 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 113.797 1.036 . . . . 43.36 113.797 175.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 11.2 mt -93.65 150.86 20.07 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.408 0.623 . . . . 37.53 111.683 172.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' HIS . . . . . 0.41 ' HB2' ' HB ' ' B' ' 47' ' ' ILE . 82.9 m-70 -110.24 122.5 47.8 Favored 'General case' 0 CA--C 1.495 -1.146 0 C-N-CA 119.333 -0.947 . . . . 52.42 111.153 174.504 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 30.3 tp -93.25 125.5 37.88 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.581 0.705 . . . . 41.12 112.21 176.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 42.2 t -125.53 138.55 54.05 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 N-CA-C 107.832 -1.173 . . . . 48.11 107.832 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 24.7 tp -79.02 140.95 37.83 Favored 'General case' 0 C--O 1.217 -0.626 0 N-CA-C 108.936 -0.764 . . . . 49.53 108.936 -176.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -112.9 130.67 56.03 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 112.659 0.614 . . . . 63.67 112.659 169.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 26.2 mt . . . . . 0 N--CA 1.446 -0.652 0 C-N-CA 119.061 -1.056 . . . . 65.33 111.058 172.218 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' SO4 . . . . . 0.469 ' O2 ' ' ND2' ' A' ' 2' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . 0.663 ' O ' ' NE2' ' A' ' 52' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . 0.433 ' O ' ' N ' ' A' ' 2' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_