data_1opd_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 1opd _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 ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.246 0.897 0 N-CA-C 112.876 0.695 . . . . 34.2 112.876 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -136.86 142.64 42.81 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.131 -1.063 . . . . 15.9 108.131 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -149.13 157.02 43.05 Favored 'General case' 0 CA--C 1.492 -1.266 0 N-CA-C 114.573 1.323 . . . . 24.69 114.573 179.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -154.29 147.82 25.14 Favored 'General case' 0 N--CA 1.445 -0.714 0 O-C-N 125.805 1.94 . . . . 23.67 108.639 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -96.33 150.43 20.58 Favored 'General case' 0 C--O 1.254 1.304 0 O-C-N 124.391 1.057 . . . . 26.86 113.169 177.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.8 p -151.0 149.38 14.25 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 CA-C-O 123.4 1.572 . . . . 12.15 107.827 175.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.9 m -100.84 128.41 46.9 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.056 -1.027 . . . . 11.9 111.435 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 86.8 mt -75.44 115.6 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 N-CA-C 104.653 -2.351 . . . . 14.94 104.653 176.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 65.0 p -109.0 -2.63 18.07 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 119.958 -1.714 . . . . 16.56 113.797 -179.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.89 140.17 91.26 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 114.377 1.251 . . . . 13.47 114.377 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.28 135.93 66.83 Favored 'Trans proline' 0 N--CA 1.495 1.566 0 C-N-CA 124.277 3.318 . . . . 15.23 108.15 168.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 33.6 m120 66.56 14.38 9.72 Favored 'General case' 0 C--O 1.243 0.735 0 N-CA-C 114.334 1.235 . . . . 27.97 114.334 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.79 -144.69 26.2 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-O 123.888 1.826 . . . . 15.57 115.231 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.94 80.08 9.1 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 118.281 -1.368 . . . . 20.53 109.715 179.017 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -71.83 178.74 3.49 Favored 'General case' 0 C--O 1.245 0.868 0 O-C-N 121.426 -0.796 . . . . 15.41 111.272 179.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.2 m -56.97 -50.47 72.55 Favored 'General case' 0 C--O 1.252 1.205 1 N-CA-C 122.145 4.128 . . . . 22.07 122.145 -173.721 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 35.5 ttt85 -64.47 -49.66 70.17 Favored Pre-proline 0 C--O 1.256 1.442 0 CA-C-O 116.702 -1.618 . . . . 18.41 111.567 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -64.72 -32.1 57.56 Favored 'Trans proline' 0 C--N 1.348 0.546 0 CA-C-N 125.714 3.077 . . . . 12.19 112.691 175.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.96 -44.55 96.53 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-O 122.775 1.274 . . . . 11.57 108.771 178.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.73 -34.86 79.31 Favored 'General case' 0 C--O 1.263 1.816 0 O-C-N 119.427 -2.045 . . . . 12.51 111.9 177.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -70.46 -34.52 72.51 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 118.959 -2.338 . . . . 21.81 109.933 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -66.05 -47.02 75.73 Favored 'General case' 0 C--N 1.36 1.035 0 CA-C-N 115.214 -0.903 . . . . 11.51 110.491 177.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.4 t -63.72 -40.72 90.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-O 121.673 0.749 . . . . 10.78 110.609 177.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -61.76 -43.89 97.96 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 118.683 -2.511 . . . . 24.62 110.945 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -64.39 -42.25 96.24 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 119.596 -1.94 . . . . 32.13 108.817 177.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.24 -42.03 98.95 Favored 'General case' 0 CA--C 1.558 1.256 0 O-C-N 118.739 -2.476 . . . . 8.92 111.396 178.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -58.82 -21.03 55.56 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 121.209 -0.932 . . . . 25.94 112.51 178.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.99 -16.46 74.83 Favored Glycine 0 CA--C 1.544 1.875 0 CA-C-O 121.668 0.593 . . . . 12.04 113.939 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -99.97 146.39 26.75 Favored 'General case' 0 N--CA 1.442 -0.835 0 O-C-N 119.114 -2.404 . . . . 12.43 110.549 179.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . 0.393 0.9 OUTLIER -71.7 -37.68 70.65 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 125.443 2.544 . . . . 16.52 113.956 -177.352 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.2 m -57.45 150.36 18.84 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 117.121 2.267 . . . . 9.61 117.121 -179.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -72.57 133.11 44.57 Favored 'General case' 0 CA--C 1.567 1.611 0 N-CA-C 101.52 -3.511 . . . . 30.55 101.52 172.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 82.7 mt -130.77 132.18 64.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 N-CA-C 106.996 -1.483 . . . . 11.61 106.996 -176.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -120.52 137.01 54.6 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 113.042 -1.89 . . . . 10.56 111.938 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 88.8 t -108.64 127.42 65.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 N-CA-C 104.395 -2.446 . . . . 10.2 104.395 174.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.8 m -122.93 137.92 54.81 Favored 'General case' 0 C--O 1.251 1.136 0 O-C-N 120.176 -1.578 . . . . 9.12 110.84 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.2 t -140.52 122.2 15.3 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 106.365 -1.717 . . . . 19.96 106.365 177.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 67.0 t30 47.28 48.9 15.97 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-O 123.577 1.656 . . . . 17.82 114.937 -178.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.95 8.15 82.37 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 113.507 -1.679 . . . . 12.69 117.005 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -118.55 130.02 55.67 Favored 'General case' 0 C--O 1.262 1.745 0 O-C-N 117.545 -3.327 . . . . 16.18 105.188 179.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 50.1 m -115.38 157.42 23.91 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 116.249 1.944 . . . . 10.31 116.249 -176.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.03 148.0 27.18 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 113.291 -1.777 . . . . 8.76 109.193 177.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.4 t -65.74 133.32 50.79 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 108.496 -0.927 . . . . 10.59 108.496 174.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.27 -12.85 61.33 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 122.576 1.179 . . . . 9.93 113.779 177.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -92.77 0.36 57.4 Favored 'General case' 0 C--N 1.349 0.564 0 N-CA-C 114.493 1.294 . . . . 10.82 114.493 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -125.24 103.36 7.91 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 120.388 -1.445 . . . . 22.27 109.374 -179.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 58.7 tp -60.1 -38.26 82.4 Favored 'General case' 0 C--O 1.251 1.151 0 O-C-N 121.163 -0.96 . . . . 16.82 113.213 -178.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -60.04 -48.58 81.14 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 118.368 -1.333 . . . . 15.38 110.469 -179.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 4.5 ttpm? -69.04 -40.83 78.33 Favored 'General case' 0 C--N 1.347 0.491 0 C-N-CA 119.768 -0.773 . . . . 23.47 111.964 -179.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -42.56 79.55 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 120.106 -1.621 . . . . 16.53 110.784 178.796 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -68.54 -16.18 63.79 Favored 'General case' 0 C--O 1.248 1.0 0 N-CA-C 114.707 1.373 . . . . 25.24 114.707 -179.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.6 p -73.9 -15.14 61.15 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.792 1.178 . . . . 14.05 109.133 177.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.2 mp -72.07 -22.43 61.37 Favored 'General case' 0 C--O 1.25 1.113 0 O-C-N 120.142 -1.599 . . . . 18.62 112.691 179.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 53.81 54.63 29.82 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 118.07 1.988 . . . . 23.25 118.07 178.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.27 86.04 0.79 Allowed 'General case' 0 C--O 1.241 0.632 0 C-N-CA 129.554 3.142 . . . . 23.15 115.058 -178.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 67.7 p -86.44 166.06 15.83 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.48 -1.236 . . . . 14.67 113.91 -178.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -55.5 132.54 48.77 Favored 'General case' 0 C--O 1.217 -0.611 0 O-C-N 121.025 -1.047 . . . . 14.58 110.791 178.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 91.85 -4.47 78.69 Favored Glycine 0 C--N 1.305 -1.149 0 O-C-N 124.38 1.05 . . . . 11.55 113.189 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 85.3 m -71.45 128.73 36.8 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 120.449 -1.618 . . . . 13.18 112.877 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 98.6 t -90.2 127.36 42.79 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.013 0 O-C-N 120.124 -1.61 . . . . 12.34 107.95 174.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.9 m -123.06 151.24 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 CA-C-O 123.491 1.615 . . . . 15.2 109.37 176.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 96.9 m -107.08 128.45 54.39 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 113.041 -1.89 . . . . 11.18 107.52 177.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 79.0 mt -106.3 121.52 58.92 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.056 0 N-CA-C 106.184 -1.784 . . . . 11.67 106.184 177.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.2 p -125.37 148.43 48.76 Favored 'General case' 0 C--N 1.355 0.844 0 C-N-CA 119.082 -1.047 . . . . 14.12 110.273 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -139.09 150.5 45.78 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 122.28 1.038 . . . . 7.62 110.597 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -136.04 116.17 13.4 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 105.887 -1.894 . . . . 27.15 105.887 178.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 158.39 -171.23 35.19 Favored Glycine 0 N--CA 1.475 1.271 0 O-C-N 120.507 -1.371 . . . . 10.35 113.56 -178.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -65.9 -24.57 66.87 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 118.506 2.78 . . . . 25.77 118.506 -177.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 48.3 p30 -125.46 30.82 5.69 Favored 'General case' 0 C--N 1.316 -0.874 0 O-C-N 120.105 -1.622 . . . . 10.85 108.96 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -56.21 -39.42 72.44 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 119.004 2.965 . . . . 13.37 119.004 -175.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -69.84 -45.54 67.57 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 119.515 1.052 . . . . 32.18 109.158 179.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -60.75 -40.5 92.67 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 119.522 -1.986 . . . . 21.29 114.028 178.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.56 -48.74 79.63 Favored 'General case' 0 C--O 1.249 1.068 0 O-C-N 121.473 -0.767 . . . . 11.21 111.899 178.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.5 m -79.07 -29.42 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.034 0 C-N-CA 114.034 -3.067 . . . . 15.02 110.642 -176.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -64.69 -39.73 94.17 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-N 124.014 3.097 . . . . 32.23 108.83 177.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -65.59 -44.28 87.12 Favored 'General case' 0 C--N 1.349 0.544 0 O-C-N 118.516 -2.615 . . . . 25.41 112.562 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -36.05 77.23 Favored 'General case' 0 C--O 1.245 0.831 0 O-C-N 119.975 -1.703 . . . . 16.87 112.919 -179.518 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 8.0 t -63.53 -47.16 92.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 N-CA-C 107.864 -1.162 . . . . 14.75 107.864 176.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.8 tpmp? -59.46 -44.53 92.98 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 121.1 -1.0 . . . . 32.37 110.593 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 62.5 tp -61.23 -48.64 80.56 Favored 'General case' 0 CA--C 1.556 1.185 0 O-C-N 120.493 -1.38 . . . . 16.59 112.395 179.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 33.3 tpp -57.31 -38.12 73.53 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 124.208 1.956 . . . . 31.33 115.879 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.18 -22.65 62.01 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.301 -1.318 . . . . 25.55 111.824 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -105.98 -12.47 15.8 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 114.333 1.235 . . . . 35.36 114.333 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 51.6 mt -66.29 138.22 57.48 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 118.172 -2.83 . . . . 29.15 114.384 178.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.307 -1.265 1 CA-C-N 108.266 -4.061 . . . . 35.7 114.046 -179.966 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.246 0.897 0 N-CA-C 112.876 0.695 . . . . 34.200000000000003 112.876 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -136.86 142.64 42.81 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.131 -1.063 . . . . 15.9 108.131 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -149.13 157.02 43.05 Favored 'General case' 0 CA--C 1.492 -1.266 0 N-CA-C 114.573 1.323 . . . . 24.690000000000001 114.573 179.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -154.29 147.82 25.14 Favored 'General case' 0 N--CA 1.445 -0.714 0 O-C-N 125.805 1.94 . . . . 23.670000000000002 108.639 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -96.33 150.43 20.58 Favored 'General case' 0 C--O 1.254 1.304 0 O-C-N 124.391 1.057 . . . . 26.859999999999999 113.169 177.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.8 p -151.0 149.38 14.25 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 CA-C-O 123.4 1.572 . . . . 12.15 107.827 175.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.9 m -100.84 128.41 46.9 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.056 -1.027 . . . . 11.9 111.435 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 86.8 mt -75.44 115.6 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 N-CA-C 104.653 -2.351 . . . . 14.94 104.653 176.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 65.0 p -109.0 -2.63 18.07 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 119.958 -1.714 . . . . 16.559999999999999 113.797 -179.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.89 140.17 91.26 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 114.377 1.251 . . . . 13.470000000000001 114.377 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.28 135.93 66.83 Favored 'Trans proline' 0 N--CA 1.495 1.566 0 C-N-CA 124.277 3.318 . . . . 15.23 108.15 168.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 33.6 m120 66.56 14.38 9.72 Favored 'General case' 0 C--O 1.243 0.735 0 N-CA-C 114.334 1.235 . . . . 27.969999999999999 114.334 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.79 -144.69 26.2 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-O 123.888 1.826 . . . . 15.57 115.231 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.94 80.08 9.1 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 118.281 -1.368 . . . . 20.530000000000001 109.715 179.017 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -71.83 178.74 3.49 Favored 'General case' 0 C--O 1.245 0.868 0 O-C-N 121.426 -0.796 . . . . 15.41 111.272 179.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.2 m -56.97 -50.47 72.55 Favored 'General case' 0 C--O 1.252 1.205 1 N-CA-C 122.145 4.128 . . . . 22.07 122.145 -173.721 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 35.5 ttt85 -64.47 -49.66 70.17 Favored Pre-proline 0 C--O 1.256 1.442 0 CA-C-O 116.702 -1.618 . . . . 18.41 111.567 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -64.72 -32.1 57.56 Favored 'Trans proline' 0 C--N 1.348 0.546 0 CA-C-N 125.714 3.077 . . . . 12.19 112.691 175.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.96 -44.55 96.53 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-O 122.775 1.274 . . . . 11.57 108.771 178.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.73 -34.86 79.31 Favored 'General case' 0 C--O 1.263 1.816 0 O-C-N 119.427 -2.045 . . . . 12.51 111.9 177.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -70.46 -34.52 72.51 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 118.959 -2.338 . . . . 21.809999999999999 109.933 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -66.05 -47.02 75.73 Favored 'General case' 0 C--N 1.36 1.035 0 CA-C-N 115.214 -0.903 . . . . 11.51 110.491 177.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.4 t -63.72 -40.72 90.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-O 121.673 0.749 . . . . 10.779999999999999 110.609 177.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -61.76 -43.89 97.96 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 118.683 -2.511 . . . . 24.620000000000001 110.945 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -64.39 -42.25 96.24 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 119.596 -1.94 . . . . 32.130000000000003 108.817 177.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.24 -42.03 98.95 Favored 'General case' 0 CA--C 1.558 1.256 0 O-C-N 118.739 -2.476 . . . . 8.9199999999999999 111.396 178.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -58.82 -21.03 55.56 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 121.209 -0.932 . . . . 25.940000000000001 112.51 178.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.99 -16.46 74.83 Favored Glycine 0 CA--C 1.544 1.875 0 CA-C-O 121.668 0.593 . . . . 12.039999999999999 113.939 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -99.97 146.39 26.75 Favored 'General case' 0 N--CA 1.442 -0.835 0 O-C-N 119.114 -2.404 . . . . 12.43 110.549 179.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . 0.482 HG21 ' O ' ' A' ' 136' ' ' HOH 0.393 0.9 OUTLIER -71.7 -37.68 70.65 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 125.443 2.544 . . . . 16.52 113.956 -177.352 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.2 m -57.45 150.36 18.84 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 117.121 2.267 . . . . 9.6099999999999994 117.121 -179.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -72.57 133.11 44.57 Favored 'General case' 0 CA--C 1.567 1.611 0 N-CA-C 101.52 -3.511 . . . . 30.550000000000001 101.52 172.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 82.7 mt -130.77 132.18 64.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 N-CA-C 106.996 -1.483 . . . . 11.609999999999999 106.996 -176.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -120.52 137.01 54.6 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 113.042 -1.89 . . . . 10.56 111.938 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 88.8 t -108.64 127.42 65.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 N-CA-C 104.395 -2.446 . . . . 10.199999999999999 104.395 174.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.8 m -122.93 137.92 54.81 Favored 'General case' 0 C--O 1.251 1.136 0 O-C-N 120.176 -1.578 . . . . 9.1199999999999992 110.84 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.2 t -140.52 122.2 15.3 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 106.365 -1.717 . . . . 19.960000000000001 106.365 177.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 67.0 t30 47.28 48.9 15.97 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-O 123.577 1.656 . . . . 17.82 114.937 -178.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.95 8.15 82.37 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 113.507 -1.679 . . . . 12.69 117.005 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -118.55 130.02 55.67 Favored 'General case' 0 C--O 1.262 1.745 0 O-C-N 117.545 -3.327 . . . . 16.18 105.188 179.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 50.1 m -115.38 157.42 23.91 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 116.249 1.944 . . . . 10.31 116.249 -176.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . 0.65 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . . . -152.03 148.0 27.18 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 113.291 -1.777 . . . . 8.7599999999999998 109.193 177.233 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' SER . . . . . 0.54 ' H ' ' NZ ' ' A' ' 49' ' ' LYS . 31.4 t -65.74 133.32 50.79 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 108.496 -0.927 . . . . 10.59 108.496 174.519 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.27 -12.85 61.33 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 122.576 1.179 . . . . 9.9299999999999997 113.779 177.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -92.77 0.36 57.4 Favored 'General case' 0 C--N 1.349 0.564 0 N-CA-C 114.493 1.294 . . . . 10.82 114.493 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -125.24 103.36 7.91 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 120.388 -1.445 . . . . 22.27 109.374 -179.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 58.7 tp -60.1 -38.26 82.4 Favored 'General case' 0 C--O 1.251 1.151 0 O-C-N 121.163 -0.96 . . . . 16.82 113.213 -178.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -60.04 -48.58 81.14 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 118.368 -1.333 . . . . 15.380000000000001 110.469 -179.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . 0.65 ' HE2' ' HA ' ' A' ' 42' ' ' ALA . 4.5 ttpm? -69.04 -40.83 78.33 Favored 'General case' 0 C--N 1.347 0.491 0 C-N-CA 119.768 -0.773 . . . . 23.469999999999999 111.964 -179.231 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -42.56 79.55 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 120.106 -1.621 . . . . 16.530000000000001 110.784 178.796 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -68.54 -16.18 63.79 Favored 'General case' 0 C--O 1.248 1.0 0 N-CA-C 114.707 1.373 . . . . 25.239999999999998 114.707 -179.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.6 p -73.9 -15.14 61.15 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.792 1.178 . . . . 14.050000000000001 109.133 177.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.2 mp -72.07 -22.43 61.37 Favored 'General case' 0 C--O 1.25 1.113 0 O-C-N 120.142 -1.599 . . . . 18.620000000000001 112.691 179.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 53.81 54.63 29.82 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 118.07 1.988 . . . . 23.25 118.07 178.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . 0.518 ' H ' HD12 ' A' ' 55' ' ' LEU . 1.8 mp -71.27 86.04 0.79 Allowed 'General case' 0 C--O 1.241 0.632 0 C-N-CA 129.554 3.142 . . . . 23.149999999999999 115.058 -178.331 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 67.7 p -86.44 166.06 15.83 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.48 -1.236 . . . . 14.67 113.91 -178.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -55.5 132.54 48.77 Favored 'General case' 0 C--O 1.217 -0.611 0 O-C-N 121.025 -1.047 . . . . 14.58 110.791 178.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 91.85 -4.47 78.69 Favored Glycine 0 C--N 1.305 -1.149 0 O-C-N 124.38 1.05 . . . . 11.550000000000001 113.189 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 85.3 m -71.45 128.73 36.8 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 120.449 -1.618 . . . . 13.18 112.877 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 98.6 t -90.2 127.36 42.79 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.013 0 O-C-N 120.124 -1.61 . . . . 12.34 107.95 174.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.9 m -123.06 151.24 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 CA-C-O 123.491 1.615 . . . . 15.199999999999999 109.37 176.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 96.9 m -107.08 128.45 54.39 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 113.041 -1.89 . . . . 11.18 107.52 177.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 79.0 mt -106.3 121.52 58.92 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.056 0 N-CA-C 106.184 -1.784 . . . . 11.67 106.184 177.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.2 p -125.37 148.43 48.76 Favored 'General case' 0 C--N 1.355 0.844 0 C-N-CA 119.082 -1.047 . . . . 14.119999999999999 110.273 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -139.09 150.5 45.78 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 122.28 1.038 . . . . 7.6200000000000001 110.597 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -136.04 116.17 13.4 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 105.887 -1.894 . . . . 27.149999999999999 105.887 178.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 158.39 -171.23 35.19 Favored Glycine 0 N--CA 1.475 1.271 0 O-C-N 120.507 -1.371 . . . . 10.35 113.56 -178.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -65.9 -24.57 66.87 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 118.506 2.78 . . . . 25.77 118.506 -177.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 48.3 p30 -125.46 30.82 5.69 Favored 'General case' 0 C--N 1.316 -0.874 0 O-C-N 120.105 -1.622 . . . . 10.85 108.96 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -56.21 -39.42 72.44 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 119.004 2.965 . . . . 13.369999999999999 119.004 -175.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -69.84 -45.54 67.57 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 119.515 1.052 . . . . 32.18 109.158 179.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -60.75 -40.5 92.67 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 119.522 -1.986 . . . . 21.289999999999999 114.028 178.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.56 -48.74 79.63 Favored 'General case' 0 C--O 1.249 1.068 0 O-C-N 121.473 -0.767 . . . . 11.210000000000001 111.899 178.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.5 m -79.07 -29.42 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.034 0 C-N-CA 114.034 -3.067 . . . . 15.02 110.642 -176.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -64.69 -39.73 94.17 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-N 124.014 3.097 . . . . 32.229999999999997 108.83 177.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -65.59 -44.28 87.12 Favored 'General case' 0 C--N 1.349 0.544 0 O-C-N 118.516 -2.615 . . . . 25.41 112.562 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -36.05 77.23 Favored 'General case' 0 C--O 1.245 0.831 0 O-C-N 119.975 -1.703 . . . . 16.870000000000001 112.919 -179.518 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 8.0 t -63.53 -47.16 92.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 N-CA-C 107.864 -1.162 . . . . 14.75 107.864 176.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.8 tpmp? -59.46 -44.53 92.98 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 121.1 -1.0 . . . . 32.369999999999997 110.593 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 62.5 tp -61.23 -48.64 80.56 Favored 'General case' 0 CA--C 1.556 1.185 0 O-C-N 120.493 -1.38 . . . . 16.59 112.395 179.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 33.3 tpp -57.31 -38.12 73.53 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 124.208 1.956 . . . . 31.329999999999998 115.879 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.18 -22.65 62.01 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.301 -1.318 . . . . 25.550000000000001 111.824 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -105.98 -12.47 15.8 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 114.333 1.235 . . . . 35.359999999999999 114.333 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 51.6 mt -66.29 138.22 57.48 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 118.172 -2.83 . . . . 29.149999999999999 114.384 178.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.307 -1.265 1 CA-C-N 108.266 -4.061 . . . . 35.700000000000003 114.046 -179.966 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 156' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . 0.482 ' O ' HG21 ' A' ' 30' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.246 0.897 0 N-CA-C 112.876 0.695 . . . . 34.200000000000003 112.876 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -136.86 142.64 42.81 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.131 -1.063 . . . . 15.9 108.131 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -149.13 157.02 43.05 Favored 'General case' 0 CA--C 1.492 -1.266 0 N-CA-C 114.573 1.323 . . . . 24.690000000000001 114.573 179.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -154.29 147.82 25.14 Favored 'General case' 0 N--CA 1.445 -0.714 0 O-C-N 125.805 1.94 . . . . 23.670000000000002 108.639 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -96.33 150.43 20.58 Favored 'General case' 0 C--O 1.254 1.304 0 O-C-N 124.391 1.057 . . . . 26.859999999999999 113.169 177.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.8 p -151.0 149.38 14.25 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 CA-C-O 123.4 1.572 . . . . 12.15 107.827 175.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.9 m -100.84 128.41 46.9 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.056 -1.027 . . . . 11.9 111.435 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 86.8 mt -75.44 115.6 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 N-CA-C 104.653 -2.351 . . . . 14.94 104.653 176.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 65.0 p -109.0 -2.63 18.07 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 119.958 -1.714 . . . . 16.559999999999999 113.797 -179.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.89 140.17 91.26 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 114.377 1.251 . . . . 13.470000000000001 114.377 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.28 135.93 66.83 Favored 'Trans proline' 0 N--CA 1.495 1.566 0 C-N-CA 124.277 3.318 . . . . 15.23 108.15 168.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 33.6 m120 66.56 14.38 9.72 Favored 'General case' 0 C--O 1.243 0.735 0 N-CA-C 114.334 1.235 . . . . 27.969999999999999 114.334 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.79 -144.69 26.2 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-O 123.888 1.826 . . . . 15.57 115.231 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.94 80.08 9.1 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 118.281 -1.368 . . . . 20.530000000000001 109.715 179.017 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -71.83 178.74 3.49 Favored 'General case' 0 C--O 1.245 0.868 0 O-C-N 121.426 -0.796 . . . . 15.41 111.272 179.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.2 m -56.97 -50.47 72.55 Favored 'General case' 0 C--O 1.252 1.205 1 N-CA-C 122.145 4.128 . . . . 22.07 122.145 -173.721 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 35.5 ttt85 -64.47 -49.66 70.17 Favored Pre-proline 0 C--O 1.256 1.442 0 CA-C-O 116.702 -1.618 . . . . 18.41 111.567 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -64.72 -32.1 57.56 Favored 'Trans proline' 0 C--N 1.348 0.546 0 CA-C-N 125.714 3.077 . . . . 12.19 112.691 175.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.96 -44.55 96.53 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-O 122.775 1.274 . . . . 11.57 108.771 178.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.73 -34.86 79.31 Favored 'General case' 0 C--O 1.263 1.816 0 O-C-N 119.427 -2.045 . . . . 12.51 111.9 177.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -70.46 -34.52 72.51 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 118.959 -2.338 . . . . 21.809999999999999 109.933 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -66.05 -47.02 75.73 Favored 'General case' 0 C--N 1.36 1.035 0 CA-C-N 115.214 -0.903 . . . . 11.51 110.491 177.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.4 t -63.72 -40.72 90.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-O 121.673 0.749 . . . . 10.779999999999999 110.609 177.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -61.76 -43.89 97.96 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 118.683 -2.511 . . . . 24.620000000000001 110.945 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -64.39 -42.25 96.24 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 119.596 -1.94 . . . . 32.130000000000003 108.817 177.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.24 -42.03 98.95 Favored 'General case' 0 CA--C 1.558 1.256 0 O-C-N 118.739 -2.476 . . . . 8.9199999999999999 111.396 178.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -58.82 -21.03 55.56 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 121.209 -0.932 . . . . 25.940000000000001 112.51 178.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.99 -16.46 74.83 Favored Glycine 0 CA--C 1.544 1.875 0 CA-C-O 121.668 0.593 . . . . 12.039999999999999 113.939 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -99.97 146.39 26.75 Favored 'General case' 0 N--CA 1.442 -0.835 0 O-C-N 119.114 -2.404 . . . . 12.43 110.549 179.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . 0.482 HG21 ' O ' ' A' ' 136' ' ' HOH 0.393 0.9 OUTLIER -71.7 -37.68 70.65 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 125.443 2.544 . . . . 16.52 113.956 -177.352 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.2 m -57.45 150.36 18.84 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 117.121 2.267 . . . . 9.6099999999999994 117.121 -179.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -72.57 133.11 44.57 Favored 'General case' 0 CA--C 1.567 1.611 0 N-CA-C 101.52 -3.511 . . . . 30.550000000000001 101.52 172.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 82.7 mt -130.77 132.18 64.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 N-CA-C 106.996 -1.483 . . . . 11.609999999999999 106.996 -176.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -120.52 137.01 54.6 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 113.042 -1.89 . . . . 10.56 111.938 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 88.8 t -108.64 127.42 65.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 N-CA-C 104.395 -2.446 . . . . 10.199999999999999 104.395 174.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.8 m -122.93 137.92 54.81 Favored 'General case' 0 C--O 1.251 1.136 0 O-C-N 120.176 -1.578 . . . . 9.1199999999999992 110.84 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.2 t -140.52 122.2 15.3 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 106.365 -1.717 . . . . 19.960000000000001 106.365 177.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 67.0 t30 47.28 48.9 15.97 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-O 123.577 1.656 . . . . 17.82 114.937 -178.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.95 8.15 82.37 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 113.507 -1.679 . . . . 12.69 117.005 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -118.55 130.02 55.67 Favored 'General case' 0 C--O 1.262 1.745 0 O-C-N 117.545 -3.327 . . . . 16.18 105.188 179.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 50.1 m -115.38 157.42 23.91 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 116.249 1.944 . . . . 10.31 116.249 -176.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.65 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . . . -152.03 148.0 27.18 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 113.291 -1.777 . . . . 8.7599999999999998 109.193 177.233 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' SER . . . . . 0.54 ' H ' ' NZ ' ' A' ' 49' ' ' LYS . 31.4 t -65.74 133.32 50.79 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 108.496 -0.927 . . . . 10.59 108.496 174.519 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.27 -12.85 61.33 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 122.576 1.179 . . . . 9.9299999999999997 113.779 177.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -92.77 0.36 57.4 Favored 'General case' 0 C--N 1.349 0.564 0 N-CA-C 114.493 1.294 . . . . 10.82 114.493 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -125.24 103.36 7.91 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 120.388 -1.445 . . . . 22.27 109.374 -179.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 58.7 tp -60.1 -38.26 82.4 Favored 'General case' 0 C--O 1.251 1.151 0 O-C-N 121.163 -0.96 . . . . 16.82 113.213 -178.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -60.04 -48.58 81.14 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 118.368 -1.333 . . . . 15.380000000000001 110.469 -179.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.65 ' HE2' ' HA ' ' A' ' 42' ' ' ALA . 4.5 ttpm? -69.04 -40.83 78.33 Favored 'General case' 0 C--N 1.347 0.491 0 C-N-CA 119.768 -0.773 . . . . 23.469999999999999 111.964 -179.231 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -42.56 79.55 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 120.106 -1.621 . . . . 16.530000000000001 110.784 178.796 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -68.54 -16.18 63.79 Favored 'General case' 0 C--O 1.248 1.0 0 N-CA-C 114.707 1.373 . . . . 25.239999999999998 114.707 -179.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.6 p -73.9 -15.14 61.15 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.792 1.178 . . . . 14.050000000000001 109.133 177.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.2 mp -72.07 -22.43 61.37 Favored 'General case' 0 C--O 1.25 1.113 0 O-C-N 120.142 -1.599 . . . . 18.620000000000001 112.691 179.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 53.81 54.63 29.82 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 118.07 1.988 . . . . 23.25 118.07 178.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.518 ' H ' HD12 ' A' ' 55' ' ' LEU . 1.8 mp -71.27 86.04 0.79 Allowed 'General case' 0 C--O 1.241 0.632 0 C-N-CA 129.554 3.142 . . . . 23.149999999999999 115.058 -178.331 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 67.7 p -86.44 166.06 15.83 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.48 -1.236 . . . . 14.67 113.91 -178.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -55.5 132.54 48.77 Favored 'General case' 0 C--O 1.217 -0.611 0 O-C-N 121.025 -1.047 . . . . 14.58 110.791 178.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 91.85 -4.47 78.69 Favored Glycine 0 C--N 1.305 -1.149 0 O-C-N 124.38 1.05 . . . . 11.550000000000001 113.189 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 85.3 m -71.45 128.73 36.8 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 120.449 -1.618 . . . . 13.18 112.877 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 98.6 t -90.2 127.36 42.79 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.013 0 O-C-N 120.124 -1.61 . . . . 12.34 107.95 174.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.9 m -123.06 151.24 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 CA-C-O 123.491 1.615 . . . . 15.199999999999999 109.37 176.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 96.9 m -107.08 128.45 54.39 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 113.041 -1.89 . . . . 11.18 107.52 177.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 79.0 mt -106.3 121.52 58.92 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.056 0 N-CA-C 106.184 -1.784 . . . . 11.67 106.184 177.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.2 p -125.37 148.43 48.76 Favored 'General case' 0 C--N 1.355 0.844 0 C-N-CA 119.082 -1.047 . . . . 14.119999999999999 110.273 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -139.09 150.5 45.78 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 122.28 1.038 . . . . 7.6200000000000001 110.597 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -136.04 116.17 13.4 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 105.887 -1.894 . . . . 27.149999999999999 105.887 178.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 158.39 -171.23 35.19 Favored Glycine 0 N--CA 1.475 1.271 0 O-C-N 120.507 -1.371 . . . . 10.35 113.56 -178.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -65.9 -24.57 66.87 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 118.506 2.78 . . . . 25.77 118.506 -177.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 48.3 p30 -125.46 30.82 5.69 Favored 'General case' 0 C--N 1.316 -0.874 0 O-C-N 120.105 -1.622 . . . . 10.85 108.96 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -56.21 -39.42 72.44 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 119.004 2.965 . . . . 13.369999999999999 119.004 -175.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -69.84 -45.54 67.57 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 119.515 1.052 . . . . 32.18 109.158 179.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -60.75 -40.5 92.67 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 119.522 -1.986 . . . . 21.289999999999999 114.028 178.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.56 -48.74 79.63 Favored 'General case' 0 C--O 1.249 1.068 0 O-C-N 121.473 -0.767 . . . . 11.210000000000001 111.899 178.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.5 m -79.07 -29.42 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.034 0 C-N-CA 114.034 -3.067 . . . . 15.02 110.642 -176.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -64.69 -39.73 94.17 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-N 124.014 3.097 . . . . 32.229999999999997 108.83 177.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -65.59 -44.28 87.12 Favored 'General case' 0 C--N 1.349 0.544 0 O-C-N 118.516 -2.615 . . . . 25.41 112.562 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -36.05 77.23 Favored 'General case' 0 C--O 1.245 0.831 0 O-C-N 119.975 -1.703 . . . . 16.870000000000001 112.919 -179.518 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 8.0 t -63.53 -47.16 92.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 N-CA-C 107.864 -1.162 . . . . 14.75 107.864 176.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.8 tpmp? -59.46 -44.53 92.98 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 121.1 -1.0 . . . . 32.369999999999997 110.593 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 62.5 tp -61.23 -48.64 80.56 Favored 'General case' 0 CA--C 1.556 1.185 0 O-C-N 120.493 -1.38 . . . . 16.59 112.395 179.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 33.3 tpp -57.31 -38.12 73.53 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 124.208 1.956 . . . . 31.329999999999998 115.879 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.18 -22.65 62.01 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.301 -1.318 . . . . 25.550000000000001 111.824 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -105.98 -12.47 15.8 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 114.333 1.235 . . . . 35.359999999999999 114.333 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 51.6 mt -66.29 138.22 57.48 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 118.172 -2.83 . . . . 29.149999999999999 114.384 178.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.307 -1.265 1 CA-C-N 108.266 -4.061 . . . . 35.700000000000003 114.046 -179.966 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . 0.482 ' O ' HG21 ' A' ' 30' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_