data_4oo5_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 4oo5 _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 . . . . . . . . . . . . . 6.8 ttm . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 122.594 1.188 . . . . 55.23 111.126 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 41.6 t -93.14 122.37 44.57 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.387 0 CA-C-N 113.735 -1.575 . . . . 35.61 113.644 172.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . 0.769 ' CD ' ' O ' ' A' ' 257' ' ' HOH . 1.9 mmpt? -79.09 111.62 15.49 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-O 123.923 1.82 . . . . 32.81 108.044 175.73 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -75.71 112.97 12.63 Favored 'General case' 0 CA--C 1.578 2.037 0 O-C-N 120.599 -1.313 . . . . 42.15 114.21 166.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 40.5 mm -94.32 126.26 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 CA-C-N 119.022 0.828 . . . . 26.97 111.885 -173.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -132.7 22.34 4.27 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 114.69 1.367 . . . . 37.71 114.69 -175.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 92.7 p -162.98 162.43 26.03 Favored 'General case' 0 C--O 1.26 1.653 0 O-C-N 124.173 0.921 . . . . 26.64 108.948 163.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . 0.518 ' NZ ' ' OE1' ' A' ' 68' ' ' GLU . 82.7 tttt -61.32 -38.17 85.92 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 114.495 -1.23 . . . . 40.14 112.695 168.766 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 67.8 p -64.44 -38.84 92.42 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 117.41 -1.716 . . . . 41.23 114.31 174.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.59 -36.22 82.11 Favored 'General case' 0 N--CA 1.417 -2.092 0 O-C-N 121.537 -0.727 . . . . 25.45 109.188 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -62.13 -51.95 65.81 Favored 'General case' 0 C--O 1.26 1.611 0 O-C-N 124.199 0.937 . . . . 28.13 110.033 179.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -61.87 -41.74 98.22 Favored 'General case' 0 C--O 1.262 1.755 0 CA-C-N 114.804 -1.089 . . . . 57.33 111.63 179.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.91 -37.64 85.4 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 122.337 1.065 . . . . 55.86 113.512 177.885 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.49 -46.86 74.9 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.732 -1.122 . . . . 29.23 108.382 177.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.8 mt -60.85 -30.96 70.43 Favored 'General case' 0 C--O 1.263 1.768 0 C-N-CA 120.286 -0.566 . . . . 32.74 111.082 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . 0.434 ' OD2' ' O ' ' A' ' 219' ' ' HOH . 85.4 m-20 -77.06 -49.03 16.24 Favored 'General case' 0 C--O 1.214 -0.789 0 O-C-N 124.088 0.867 . . . . 55.58 110.431 -179.954 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.23 -16.71 63.83 Favored 'General case' 0 CA--C 1.57 1.722 0 N-CA-C 114.123 1.157 . . . . 39.11 114.123 179.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.81 -23.75 13.18 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 115.506 1.669 . . . . 37.42 115.506 174.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.93 -126.86 43.19 Favored Glycine 0 N--CA 1.439 -1.123 0 C-N-CA 119.187 -1.482 . . . . 40.46 109.942 -171.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -92.1 2.7 56.42 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.579 0.955 . . . . 49.04 113.579 -177.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -77.71 142.57 38.67 Favored 'General case' 0 C--O 1.254 1.291 0 CA-C-O 122.531 1.158 . . . . 44.0 112.153 -173.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 15.7 tp -51.12 131.95 27.75 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 123.893 1.806 . . . . 28.89 113.167 160.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 62.1 t -115.99 126.63 73.57 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.852 0 CA-C-N 113.911 -1.495 . . . . 26.68 109.023 170.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 59.7 t -112.75 125.63 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 O-C-N 125.142 1.526 . . . . 27.26 108.204 177.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 20.0 t -118.98 122.53 69.55 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 CA-C-N 115.908 -0.587 . . . . 22.82 111.509 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 59.8 t0 -95.56 109.96 22.11 Favored 'General case' 0 C--N 1.313 -1.0 0 O-C-N 125.676 1.86 . . . . 22.59 108.406 177.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -93.61 119.69 32.96 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 106.015 -1.846 . . . . 21.38 106.015 172.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.9 m -133.59 161.06 35.66 Favored 'General case' 0 C--O 1.24 0.602 0 O-C-N 121.395 -0.815 . . . . 20.34 109.482 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -139.39 149.08 43.69 Favored 'General case' 0 C--O 1.246 0.869 0 N-CA-C 105.726 -1.954 . . . . 26.55 105.726 -177.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.9 p -64.78 -30.15 71.15 Favored 'General case' 0 CA--C 1.554 1.129 0 CA-C-O 122.217 1.008 . . . . 36.22 113.627 -176.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 56.3 p-90 -76.12 -3.72 37.64 Favored 'General case' 0 N--CA 1.51 2.569 0 N-CA-C 115.68 1.733 . . . . 31.61 115.68 177.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 13.7 t -97.57 96.07 8.05 Favored 'General case' 0 C--O 1.163 -3.476 0 N-CA-C 106.275 -1.75 . . . . 27.28 106.275 -173.44 169.55 -139.632 76.768 99.751 2.099 99.587 83.495 -67.65 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -46.61 -55.54 8.0 Favored Glycine 0 C--O 1.276 2.762 0 CA-C-O 118.056 -1.414 . . . . 32.22 116.334 178.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -60.84 -30.12 89.5 Favored 'Trans proline' 0 CA--C 1.49 -1.713 1 C-N-CA 128.447 6.098 . . . . 33.24 111.342 178.485 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 85.2 m -62.75 -45.39 92.9 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-O 122.76 1.266 . . . . 28.09 110.612 169.46 -67.65 83.495 76.768 99.587 2.099 99.751 -139.632 169.55 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.1 mtmt -70.74 -32.66 69.91 Favored 'General case' 0 CA--C 1.575 1.924 0 O-C-N 120.777 -1.202 . . . . 53.38 110.132 176.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 5.0 ptp -67.89 -37.61 81.96 Favored 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 119.023 -1.071 . . . . 95.47 110.687 179.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.5 tt -83.32 -9.81 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 N-CA-C 114.234 1.198 . . . . 36.4 114.234 -177.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . 0.464 ' NZ ' ' OE1' ' A' ' 56' ' ' GLU . 39.0 tttm -60.85 -43.82 92.86 Favored Pre-proline 0 CA--C 1.563 1.448 0 N-CA-C 113.617 0.969 . . . . 36.39 113.617 -173.799 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -56.84 -44.99 39.68 Favored 'Trans proline' 0 C--O 1.256 1.4 0 CA-C-O 118.067 -0.889 . . . . 36.24 114.342 174.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -60.55 -39.03 86.44 Favored 'General case' 0 C--O 1.252 1.197 0 O-C-N 124.987 1.429 . . . . 25.86 111.774 174.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -56.68 -48.57 77.35 Favored 'General case' 0 CA--C 1.564 1.516 0 N-CA-C 113.904 1.075 . . . . 22.46 113.904 172.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' HIS . . . . . 0.687 ' CD2' ' O ' ' A' ' 261' ' ' HOH . 60.1 m-70 -56.99 -44.11 82.41 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 124.569 1.168 . . . . 36.3 110.861 173.999 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.7 p -57.08 -43.19 81.92 Favored 'General case' 0 N--CA 1.5 2.07 0 CA-C-O 122.77 1.271 . . . . 26.5 113.271 175.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 66.3 mt -61.63 -39.1 90.11 Favored 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 119.401 -2.062 . . . . 25.15 109.912 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.8 p -66.88 -34.1 77.05 Favored 'General case' 0 N--CA 1.437 -1.105 0 O-C-N 124.637 1.21 . . . . 34.69 111.755 -178.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -72.43 -41.06 66.59 Favored 'General case' 0 C--O 1.215 -0.738 0 O-C-N 124.478 1.111 . . . . 71.56 111.569 173.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -68.04 -48.75 64.8 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.935 1.087 . . . . 37.04 113.935 178.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -102.49 81.94 2.1 Favored 'General case' 0 N--CA 1.412 -2.362 0 N-CA-C 106.191 -1.781 . . . . 31.8 106.191 -175.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.4 p -73.92 -12.65 60.72 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 119.703 -0.799 . . . . 42.31 109.432 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -77.07 -5.77 50.18 Favored 'General case' 0 CA--C 1.566 1.594 0 N-CA-C 117.396 2.369 . . . . 44.59 117.396 174.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 41.1 t -127.96 146.24 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 N-CA-C 101.076 -3.675 . . . . 32.15 101.076 -167.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 94.8 mt -104.61 130.89 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 N-CA-C 108.923 -0.769 . . . . 32.5 108.923 179.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -115.61 126.3 54.01 Favored 'General case' 0 N--CA 1.523 3.188 0 O-C-N 128.676 3.735 . . . . 27.86 109.187 -177.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.8 mt -123.97 147.87 47.4 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 113.674 -1.603 . . . . 33.07 109.476 176.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLU . . . . . 0.832 ' CG ' ' O ' ' A' ' 278' ' ' HOH . 7.1 mm-40 -114.23 132.84 55.99 Favored 'General case' 0 C--N 1.31 -1.125 0 N-CA-C 108.627 -0.879 . . . . 26.45 108.627 171.692 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 55.0 t -126.56 118.82 52.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 N-CA-C 105.84 -1.911 . . . . 23.55 105.84 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -89.83 119.15 29.97 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 105.777 -1.934 . . . . 40.71 105.777 174.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.3 m -63.16 -26.27 40.51 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 115.168 1.544 . . . . 27.85 115.168 -171.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -76.46 -34.09 58.72 Favored 'General case' 0 C--O 1.252 1.186 0 O-C-N 123.737 0.648 . . . . 32.15 110.362 178.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -68.86 -30.26 68.74 Favored 'General case' 0 C--O 1.207 -1.169 0 CA-C-O 122.764 1.268 . . . . 33.39 113.831 170.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' SNC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLN . . . . . 0.708 ' NE2' ' O ' ' A' ' 283' ' ' HOH . 87.8 mt-30 -66.08 -37.11 84.97 Favored 'General case' 0 C--O 1.255 1.371 0 O-C-N 124.826 1.329 . . . . 67.4 112.592 -175.84 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 33.8 p-10 -59.85 -49.26 78.38 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.109 1.151 . . . . 43.49 114.109 173.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 71.8 t -62.99 -44.38 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.715 0 CA-C-N 115.078 -0.965 . . . . 27.78 108.615 178.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.28 -49.7 76.21 Favored 'General case' 0 C--O 1.26 1.608 0 CA-C-O 121.176 0.512 . . . . 25.81 111.56 179.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 32.9 t -60.12 -50.1 75.05 Favored 'General case' 0 C--O 1.258 1.539 0 CA-C-N 114.757 -1.11 . . . . 27.34 111.071 176.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLU . . . . . 0.518 ' OE1' ' NZ ' ' A' ' 8' ' ' LYS . 73.8 mt-10 -62.2 -31.19 71.69 Favored 'General case' 0 C--O 1.273 2.318 0 O-C-N 124.062 0.851 . . . . 44.39 112.108 -177.098 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 63.8 m -82.56 -6.3 59.26 Favored 'General case' 0 C--O 1.259 1.556 0 N-CA-C 113.383 0.883 . . . . 29.51 113.383 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 60.89 32.92 20.04 Favored 'General case' 0 C--O 1.2 -1.55 0 CA-C-O 122.809 1.29 . . . . 58.69 111.816 177.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 78.9 t -62.51 134.66 27.69 Favored 'Isoleucine or valine' 0 C--O 1.266 1.933 0 CA-C-N 114.512 -1.222 . . . . 32.29 111.035 173.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -124.18 -44.55 2.02 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 126.102 2.126 . . . . 55.46 116.012 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.1 m -102.8 162.5 12.88 Favored 'General case' 0 CA--C 1.56 1.359 0 CA-C-O 117.339 -1.315 . . . . 32.82 112.121 176.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.8 mmt -122.06 131.11 24.47 Favored Pre-proline 0 CA--C 1.585 2.304 0 C-N-CA 127.312 2.245 . . . . 33.0 105.662 -177.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -78.38 158.55 93.04 Favored 'Cis proline' 0 C--O 1.266 1.889 0 C-N-CA 123.421 -1.491 . . . . 23.14 112.86 -12.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.1 m -117.17 134.19 55.08 Favored 'General case' 0 N--CA 1.425 -1.691 0 N-CA-C 108.41 -0.959 . . . . 23.12 108.41 167.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -106.84 119.27 38.88 Favored 'General case' 0 N--CA 1.438 -1.031 0 O-C-N 124.282 0.989 . . . . 20.05 108.413 173.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -110.06 150.59 28.34 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 124.122 0.889 . . . . 25.98 110.347 170.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . 0.25 88.0 m-85 -129.47 133.66 47.41 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 106.404 -1.702 . . . . 23.69 106.404 -172.416 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -129.61 146.91 51.37 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-N 112.487 -2.142 . . . . 29.06 114.21 -179.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -142.78 129.3 20.18 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 106.413 -1.699 . . . . 32.41 106.413 169.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 14.6 mttt 55.73 48.26 18.73 Favored 'General case' 0 N--CA 1.512 2.633 0 CA-C-O 122.845 1.307 . . . . 64.59 112.989 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 70.38 -3.61 10.89 Favored Glycine 0 C--O 1.224 -0.478 0 N-CA-C 118.573 2.189 . . . . 42.16 118.573 -178.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 27.8 mm100 -103.42 139.92 38.15 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 117.922 0.861 . . . . 52.32 109.123 -176.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -76.42 119.62 20.53 Favored 'General case' 0 C--O 1.25 1.126 0 O-C-N 124.638 1.211 . . . . 43.81 111.868 173.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.9 m -114.31 0.69 8.71 Favored 'Isoleucine or valine' 0 C--O 1.251 1.175 0 CA-C-N 114.669 -1.151 . . . . 37.55 113.038 -179.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -169.64 160.31 33.39 Favored Glycine 0 CA--C 1.495 -1.197 0 C-N-CA 119.489 -1.339 . . . . 29.25 113.552 172.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -163.33 141.79 8.06 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 113.472 0.915 . . . . 40.05 113.472 172.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -156.15 168.13 28.24 Favored 'General case' 0 C--O 1.262 1.739 0 CA-C-O 121.538 0.685 . . . . 23.46 109.935 164.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 71.4 p -120.63 158.1 28.12 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 116.18 -0.464 . . . . 23.22 111.281 174.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 104.59 147.02 16.12 Favored Glycine 0 C--O 1.264 1.993 0 O-C-N 125.407 1.692 . . . . 22.57 110.051 176.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.13 59.8 4.6 Favored 'General case' 0 N--CA 1.528 3.45 0 CA-C-N 113.24 -1.48 . . . . 32.63 112.783 -177.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -102.51 104.51 14.94 Favored 'General case' 0 C--O 1.272 2.25 0 N-CA-C 106.209 -1.774 . . . . 31.97 106.209 -176.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.03 -47.18 85.88 Favored 'General case' 0 N--CA 1.495 1.822 0 CA-C-O 122.69 1.233 . . . . 32.72 113.998 -176.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -62.13 -44.12 97.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.094 -0.957 . . . . 65.63 111.535 -178.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -65.65 -39.69 91.69 Favored 'General case' 0 C--O 1.282 2.772 0 CA-C-N 115.114 -0.948 . . . . 35.63 111.841 178.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 24.8 tp -56.87 -50.05 73.64 Favored 'General case' 0 C--O 1.282 2.768 0 CA-C-O 122.225 1.012 . . . . 23.39 109.637 178.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 64.4 tt0 -69.58 -39.83 77.08 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 118.063 -1.455 . . . . 26.89 110.238 -175.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.48 -44.79 95.54 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 106.624 -1.621 . . . . 34.57 106.624 -177.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 62.4 m -59.82 -43.88 94.3 Favored 'General case' 0 C--O 1.288 3.101 0 C-N-CA 119.519 -0.872 . . . . 27.3 111.49 -179.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 79.7 mt -57.33 -48.3 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.316 0 O-C-N 120.967 -1.083 . . . . 29.43 108.525 177.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 -66.16 -31.97 73.13 Favored 'General case' 0 CA--C 1.569 1.68 0 C-N-CA 117.284 -1.766 . . . . 39.8 109.797 -175.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -62.98 -32.8 74.21 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.869 1.433 . . . . 29.07 114.869 174.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 79.8 mt -103.28 -29.72 11.08 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 115.749 1.759 . . . . 35.16 115.749 -171.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 C--O 1.277 2.514 0 CA-C-O 123.519 1.628 . . . . 42.76 107.288 -175.136 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . 0.434 ' O ' ' OD2' ' A' ' 16' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 257' ' ' HOH . . . . . 0.769 ' O ' ' CD ' ' A' ' 3' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 261' ' ' HOH . . . . . 0.687 ' O ' ' CD2' ' A' ' 43' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 278' ' ' HOH . . . . . 0.832 ' O ' ' CG ' ' A' ' 56' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 279' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 283' ' ' HOH . . . . . 0.708 ' O ' ' NE2' ' A' ' 63' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 287' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 288' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 289' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 290' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 291' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 292' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 293' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 294' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 295' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 296' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 297' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 298' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 299' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.8 ttm . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 122.594 1.188 . . . . 55.229999999999997 111.126 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . 0.564 HG11 ' HG3' ' A' ' 56' ' ' GLU . 41.6 t -93.14 122.37 44.57 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.387 0 CA-C-N 113.735 -1.575 . . . . 35.609999999999999 113.644 172.684 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . 1.033 ' HA ' ' HE2' ' A' ' 3' ' ' LYS . 1.9 mmpt? -79.09 111.62 15.49 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-O 123.923 1.82 . . . . 32.810000000000002 108.044 175.73 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -75.71 112.97 12.63 Favored 'General case' 0 CA--C 1.578 2.037 0 O-C-N 120.599 -1.313 . . . . 42.149999999999999 114.21 166.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 40.5 mm -94.32 126.26 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 CA-C-N 119.022 0.828 . . . . 26.969999999999999 111.885 -173.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -132.7 22.34 4.27 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 114.69 1.367 . . . . 37.710000000000001 114.69 -175.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 92.7 p -162.98 162.43 26.03 Favored 'General case' 0 C--O 1.26 1.653 0 O-C-N 124.173 0.921 . . . . 26.640000000000001 108.948 163.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . 0.478 ' NZ ' ' OE1' ' A' ' 68' ' ' GLU . 82.7 tttt -61.32 -38.17 85.92 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 114.495 -1.23 . . . . 40.140000000000001 112.695 168.766 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 67.8 p -64.44 -38.84 92.42 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 117.41 -1.716 . . . . 41.229999999999997 114.31 174.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.59 -36.22 82.11 Favored 'General case' 0 N--CA 1.417 -2.092 0 O-C-N 121.537 -0.727 . . . . 25.449999999999999 109.188 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -62.13 -51.95 65.81 Favored 'General case' 0 C--O 1.26 1.611 0 O-C-N 124.199 0.937 . . . . 28.129999999999999 110.033 179.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -61.87 -41.74 98.22 Favored 'General case' 0 C--O 1.262 1.755 0 CA-C-N 114.804 -1.089 . . . . 57.329999999999998 111.63 179.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.91 -37.64 85.4 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 122.337 1.065 . . . . 55.859999999999999 113.512 177.885 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.49 -46.86 74.9 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.732 -1.122 . . . . 29.23 108.382 177.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.8 mt -60.85 -30.96 70.43 Favored 'General case' 0 C--O 1.263 1.768 0 C-N-CA 120.286 -0.566 . . . . 32.740000000000002 111.082 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . 0.434 ' OD2' ' O ' ' A' ' 219' ' ' HOH . 85.4 m-20 -77.06 -49.03 16.24 Favored 'General case' 0 C--O 1.214 -0.789 0 O-C-N 124.088 0.867 . . . . 55.579999999999998 110.431 -179.954 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.23 -16.71 63.83 Favored 'General case' 0 CA--C 1.57 1.722 0 N-CA-C 114.123 1.157 . . . . 39.109999999999999 114.123 179.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.81 -23.75 13.18 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 115.506 1.669 . . . . 37.420000000000002 115.506 174.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.93 -126.86 43.19 Favored Glycine 0 N--CA 1.439 -1.123 0 C-N-CA 119.187 -1.482 . . . . 40.460000000000001 109.942 -171.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -92.1 2.7 56.42 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.579 0.955 . . . . 49.039999999999999 113.579 -177.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -77.71 142.57 38.67 Favored 'General case' 0 C--O 1.254 1.291 0 CA-C-O 122.531 1.158 . . . . 44.0 112.153 -173.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 15.7 tp -51.12 131.95 27.75 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 123.893 1.806 . . . . 28.890000000000001 113.167 160.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 62.1 t -115.99 126.63 73.57 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.852 0 CA-C-N 113.911 -1.495 . . . . 26.68 109.023 170.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 59.7 t -112.75 125.63 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 O-C-N 125.142 1.526 . . . . 27.260000000000002 108.204 177.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 20.0 t -118.98 122.53 69.55 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 CA-C-N 115.908 -0.587 . . . . 22.82 111.509 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 59.8 t0 -95.56 109.96 22.11 Favored 'General case' 0 C--N 1.313 -1.0 0 O-C-N 125.676 1.86 . . . . 22.59 108.406 177.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -93.61 119.69 32.96 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 106.015 -1.846 . . . . 21.379999999999999 106.015 172.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.9 m -133.59 161.06 35.66 Favored 'General case' 0 C--O 1.24 0.602 0 O-C-N 121.395 -0.815 . . . . 20.34 109.482 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -139.39 149.08 43.69 Favored 'General case' 0 C--O 1.246 0.869 0 N-CA-C 105.726 -1.954 . . . . 26.550000000000001 105.726 -177.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.9 p -64.78 -30.15 71.15 Favored 'General case' 0 CA--C 1.554 1.129 0 CA-C-O 122.217 1.008 . . . . 36.219999999999999 113.627 -176.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 56.3 p-90 -76.12 -3.72 37.64 Favored 'General case' 0 N--CA 1.51 2.569 0 N-CA-C 115.68 1.733 . . . . 31.609999999999999 115.68 177.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 13.7 t -97.57 96.07 8.05 Favored 'General case' 0 C--O 1.163 -3.476 0 N-CA-C 106.275 -1.75 . . . . 27.280000000000001 106.275 -173.44 169.55 -139.632 76.768 99.751 2.099 99.587 83.495 -67.65 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -46.61 -55.54 8.0 Favored Glycine 0 C--O 1.276 2.762 0 CA-C-O 118.056 -1.414 . . . . 32.219999999999999 116.334 178.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PRO . . . . . 0.516 ' HA ' ' HG2' ' A' ' 37' ' ' MET . 49.0 Cg_exo -60.84 -30.12 89.5 Favored 'Trans proline' 0 CA--C 1.49 -1.713 1 C-N-CA 128.447 6.098 . . . . 33.240000000000002 111.342 178.485 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 85.2 m -62.75 -45.39 92.9 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-O 122.76 1.266 . . . . 28.09 110.612 169.46 -67.65 83.495 76.768 99.587 2.099 99.751 -139.632 169.55 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.1 mtmt -70.74 -32.66 69.91 Favored 'General case' 0 CA--C 1.575 1.924 0 O-C-N 120.777 -1.202 . . . . 53.380000000000003 110.132 176.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' MET . . . . . 0.516 ' HG2' ' HA ' ' A' ' 34' ' ' PRO . 5.0 ptp -67.89 -37.61 81.96 Favored 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 119.023 -1.071 . . . . 95.469999999999999 110.687 179.521 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.5 tt -83.32 -9.81 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 N-CA-C 114.234 1.198 . . . . 36.399999999999999 114.234 -177.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 39.0 tttm -60.85 -43.82 92.86 Favored Pre-proline 0 CA--C 1.563 1.448 0 N-CA-C 113.617 0.969 . . . . 47.409999999999997 113.617 -173.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -56.84 -44.99 39.68 Favored 'Trans proline' 0 C--O 1.256 1.4 0 CA-C-O 118.067 -0.889 . . . . 36.240000000000002 114.342 174.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -60.55 -39.03 86.44 Favored 'General case' 0 C--O 1.252 1.197 0 O-C-N 124.987 1.429 . . . . 25.859999999999999 111.774 174.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -56.68 -48.57 77.35 Favored 'General case' 0 CA--C 1.564 1.516 0 N-CA-C 113.904 1.075 . . . . 22.460000000000001 113.904 172.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' HIS . . . . . 0.687 ' CD2' ' O ' ' A' ' 261' ' ' HOH . 60.1 m-70 -56.99 -44.11 82.41 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 124.569 1.168 . . . . 36.299999999999997 110.861 173.999 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.7 p -57.08 -43.19 81.92 Favored 'General case' 0 N--CA 1.5 2.07 0 CA-C-O 122.77 1.271 . . . . 26.5 113.271 175.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 66.3 mt -61.63 -39.1 90.11 Favored 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 119.401 -2.062 . . . . 25.149999999999999 109.912 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.8 p -66.88 -34.1 77.05 Favored 'General case' 0 N--CA 1.437 -1.105 0 O-C-N 124.637 1.21 . . . . 34.689999999999998 111.755 -178.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -72.43 -41.06 66.59 Favored 'General case' 0 C--O 1.215 -0.738 0 O-C-N 124.478 1.111 . . . . 71.560000000000002 111.569 173.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -68.04 -48.75 64.8 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.935 1.087 . . . . 37.039999999999999 113.935 178.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -102.49 81.94 2.1 Favored 'General case' 0 N--CA 1.412 -2.362 0 N-CA-C 106.191 -1.781 . . . . 31.800000000000001 106.191 -175.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.4 p -73.92 -12.65 60.72 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 119.703 -0.799 . . . . 42.310000000000002 109.432 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -77.07 -5.77 50.18 Favored 'General case' 0 CA--C 1.566 1.594 0 N-CA-C 117.396 2.369 . . . . 44.590000000000003 117.396 174.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 41.1 t -127.96 146.24 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 N-CA-C 101.076 -3.675 . . . . 32.149999999999999 101.076 -167.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 94.8 mt -104.61 130.89 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 N-CA-C 108.923 -0.769 . . . . 32.5 108.923 179.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -115.61 126.3 54.01 Favored 'General case' 0 N--CA 1.523 3.188 0 O-C-N 128.676 3.735 . . . . 27.859999999999999 109.187 -177.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . 0.429 HD23 ' HB2' ' A' ' 3' ' ' LYS . 7.8 mt -123.97 147.87 47.4 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 113.674 -1.603 . . . . 33.07 109.476 176.839 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLU . . . . . 1.161 ' HG3' ' O ' ' A' ' 278' ' ' HOH . 7.1 mm-40 -114.23 132.84 55.99 Favored 'General case' 0 C--N 1.31 -1.125 0 N-CA-C 108.627 -0.879 . . . . 27.890000000000001 108.627 171.692 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 55.0 t -126.56 118.82 52.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 N-CA-C 105.84 -1.911 . . . . 23.550000000000001 105.84 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -89.83 119.15 29.97 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 105.777 -1.934 . . . . 40.710000000000001 105.777 174.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.3 m -63.16 -26.27 40.51 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 115.168 1.544 . . . . 27.850000000000001 115.168 -171.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -76.46 -34.09 58.72 Favored 'General case' 0 C--O 1.252 1.186 0 O-C-N 123.737 0.648 . . . . 32.340000000000003 110.362 178.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -68.86 -30.26 68.74 Favored 'General case' 0 C--O 1.207 -1.169 0 CA-C-O 122.764 1.268 . . . . 33.390000000000001 113.831 170.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' SNC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLN . . . . . 0.708 ' NE2' ' O ' ' A' ' 283' ' ' HOH . 87.8 mt-30 -66.08 -37.11 84.97 Favored 'General case' 0 C--O 1.255 1.371 0 O-C-N 124.826 1.329 . . . . 67.400000000000006 112.592 -175.84 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 33.8 p-10 -59.85 -49.26 78.38 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.109 1.151 . . . . 43.490000000000002 114.109 173.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 71.8 t -62.99 -44.38 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.715 0 CA-C-N 115.078 -0.965 . . . . 27.780000000000001 108.615 178.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.28 -49.7 76.21 Favored 'General case' 0 C--O 1.26 1.608 0 CA-C-O 121.176 0.512 . . . . 25.809999999999999 111.56 179.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 32.9 t -60.12 -50.1 75.05 Favored 'General case' 0 C--O 1.258 1.539 0 CA-C-N 114.757 -1.11 . . . . 27.34 111.071 176.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLU . . . . . 0.478 ' OE1' ' NZ ' ' A' ' 8' ' ' LYS . 73.8 mt-10 -62.2 -31.19 71.69 Favored 'General case' 0 C--O 1.273 2.318 0 O-C-N 124.062 0.851 . . . . 44.390000000000001 112.108 -177.098 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 63.8 m -82.56 -6.3 59.26 Favored 'General case' 0 C--O 1.259 1.556 0 N-CA-C 113.383 0.883 . . . . 29.510000000000002 113.383 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 60.89 32.92 20.04 Favored 'General case' 0 C--O 1.2 -1.55 0 CA-C-O 122.809 1.29 . . . . 58.689999999999998 111.816 177.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . 0.557 HG11 ' HE1' ' A' ' 74' ' ' MET . 78.9 t -62.51 134.66 27.69 Favored 'Isoleucine or valine' 0 C--O 1.266 1.933 0 CA-C-N 114.512 -1.222 . . . . 32.289999999999999 111.035 173.358 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -124.18 -44.55 2.02 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 126.102 2.126 . . . . 55.460000000000001 116.012 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' SER . . . . . 0.517 ' HB3' ' HB3' ' A' ' 90' ' ' SER . 1.1 m -102.8 162.5 12.88 Favored 'General case' 0 CA--C 1.56 1.359 0 CA-C-O 117.339 -1.315 . . . . 32.82 112.121 176.579 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' MET . . . . . 0.557 ' HE1' HG11 ' A' ' 71' ' ' VAL . 32.8 mmt -122.06 131.11 24.47 Favored Pre-proline 0 CA--C 1.585 2.304 0 C-N-CA 127.312 2.245 . . . . 33.0 105.662 -177.923 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -78.38 158.55 93.04 Favored 'Cis proline' 0 C--O 1.266 1.889 0 C-N-CA 123.421 -1.491 . . . . 23.140000000000001 112.86 -12.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.1 m -117.17 134.19 55.08 Favored 'General case' 0 N--CA 1.425 -1.691 0 N-CA-C 108.41 -0.959 . . . . 23.120000000000001 108.41 167.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -106.84 119.27 38.88 Favored 'General case' 0 N--CA 1.438 -1.031 0 O-C-N 124.282 0.989 . . . . 20.050000000000001 108.413 173.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -110.06 150.59 28.34 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 124.122 0.889 . . . . 25.98 110.347 170.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . 0.25 88.0 m-85 -129.47 133.66 47.41 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 106.404 -1.702 . . . . 23.690000000000001 106.404 -172.416 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -129.61 146.91 51.37 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-N 112.487 -2.142 . . . . 29.059999999999999 114.21 -179.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LYS . . . . . 0.474 ' HG3' HG21 ' A' ' 86' ' ' VAL . 41.7 mtmt -142.78 129.3 20.18 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 106.413 -1.699 . . . . 32.409999999999997 106.413 169.604 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 14.6 mttt 55.73 48.26 18.73 Favored 'General case' 0 N--CA 1.512 2.633 0 CA-C-O 122.845 1.307 . . . . 64.590000000000003 112.989 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 70.38 -3.61 10.89 Favored Glycine 0 C--O 1.224 -0.478 0 N-CA-C 118.573 2.189 . . . . 42.159999999999997 118.573 -178.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 27.8 mm100 -103.42 139.92 38.15 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 117.922 0.861 . . . . 52.32 109.123 -176.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -76.42 119.62 20.53 Favored 'General case' 0 C--O 1.25 1.126 0 O-C-N 124.638 1.211 . . . . 43.810000000000002 111.868 173.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . 0.474 HG21 ' HG3' ' A' ' 81' ' ' LYS . 33.9 m -114.31 0.69 8.71 Favored 'Isoleucine or valine' 0 C--O 1.251 1.175 0 CA-C-N 114.669 -1.151 . . . . 37.549999999999997 113.038 -179.109 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -169.64 160.31 33.39 Favored Glycine 0 CA--C 1.495 -1.197 0 C-N-CA 119.489 -1.339 . . . . 29.25 113.552 172.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -163.33 141.79 8.06 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 113.472 0.915 . . . . 40.049999999999997 113.472 172.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -156.15 168.13 28.24 Favored 'General case' 0 C--O 1.262 1.739 0 CA-C-O 121.538 0.685 . . . . 23.460000000000001 109.935 164.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . 0.517 ' HB3' ' HB3' ' A' ' 73' ' ' SER . 71.4 p -120.63 158.1 28.12 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 116.18 -0.464 . . . . 25.890000000000001 111.281 174.488 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 104.59 147.02 16.12 Favored Glycine 0 C--O 1.264 1.993 0 O-C-N 125.407 1.692 . . . . 22.57 110.051 176.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.13 59.8 4.6 Favored 'General case' 0 N--CA 1.528 3.45 0 CA-C-N 113.24 -1.48 . . . . 32.630000000000003 112.783 -177.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -102.51 104.51 14.94 Favored 'General case' 0 C--O 1.272 2.25 0 N-CA-C 106.209 -1.774 . . . . 31.969999999999999 106.209 -176.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.03 -47.18 85.88 Favored 'General case' 0 N--CA 1.495 1.822 0 CA-C-O 122.69 1.233 . . . . 32.719999999999999 113.998 -176.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -62.13 -44.12 97.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.094 -0.957 . . . . 65.629999999999995 111.535 -178.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -65.65 -39.69 91.69 Favored 'General case' 0 C--O 1.282 2.772 0 CA-C-N 115.114 -0.948 . . . . 35.630000000000003 111.841 178.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 24.8 tp -56.87 -50.05 73.64 Favored 'General case' 0 C--O 1.282 2.768 0 CA-C-O 122.225 1.012 . . . . 23.390000000000001 109.637 178.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 64.4 tt0 -69.58 -39.83 77.08 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 118.063 -1.455 . . . . 26.890000000000001 110.238 -175.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.48 -44.79 95.54 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 106.624 -1.621 . . . . 34.57 106.624 -177.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 62.4 m -59.82 -43.88 94.3 Favored 'General case' 0 C--O 1.288 3.101 0 C-N-CA 119.519 -0.872 . . . . 27.300000000000001 111.49 -179.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 79.7 mt -57.33 -48.3 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.316 0 O-C-N 120.967 -1.083 . . . . 29.43 108.525 177.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -66.16 -31.97 73.13 Favored 'General case' 0 CA--C 1.569 1.68 0 C-N-CA 117.284 -1.766 . . . . 39.799999999999997 109.797 -175.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -62.98 -32.8 74.21 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.869 1.433 . . . . 33.939999999999998 114.869 174.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 79.8 mt -103.28 -29.72 11.08 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 115.749 1.759 . . . . 35.159999999999997 115.749 -171.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 C--O 1.277 2.514 0 CA-C-O 123.519 1.628 . . . . 42.759999999999998 107.288 -175.136 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . 0.434 ' O ' ' OD2' ' A' ' 16' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 257' ' ' HOH . . . . . 0.79 ' O ' ' HD3' ' A' ' 3' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 261' ' ' HOH . . . . . 0.687 ' O ' ' CD2' ' A' ' 43' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 278' ' ' HOH . . . . . 1.161 ' O ' ' HG3' ' A' ' 56' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 279' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 283' ' ' HOH . . . . . 0.708 ' O ' ' NE2' ' A' ' 63' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 287' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 288' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 289' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 290' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 291' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 292' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 293' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 294' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 295' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 296' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 297' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 298' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 299' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.8 ttm . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 122.594 1.188 . . . . 55.229999999999997 111.126 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.564 HG11 ' HG3' ' A' ' 56' ' ' GLU . 41.6 t -93.14 122.37 44.57 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.387 0 CA-C-N 113.735 -1.575 . . . . 35.609999999999999 113.644 172.684 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . 1.033 ' HA ' ' HE2' ' A' ' 3' ' ' LYS . 1.9 mmpt? -79.09 111.62 15.49 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-O 123.923 1.82 . . . . 32.810000000000002 108.044 175.73 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -75.71 112.97 12.63 Favored 'General case' 0 CA--C 1.578 2.037 0 O-C-N 120.599 -1.313 . . . . 42.149999999999999 114.21 166.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 40.5 mm -94.32 126.26 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 CA-C-N 119.022 0.828 . . . . 26.969999999999999 111.885 -173.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -132.7 22.34 4.27 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 114.69 1.367 . . . . 37.710000000000001 114.69 -175.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 92.7 p -162.98 162.43 26.03 Favored 'General case' 0 C--O 1.26 1.653 0 O-C-N 124.173 0.921 . . . . 26.640000000000001 108.948 163.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.478 ' NZ ' ' OE1' ' A' ' 68' ' ' GLU . 82.7 tttt -61.32 -38.17 85.92 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 114.495 -1.23 . . . . 40.140000000000001 112.695 168.766 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 67.8 p -64.44 -38.84 92.42 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 117.41 -1.716 . . . . 41.229999999999997 114.31 174.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.59 -36.22 82.11 Favored 'General case' 0 N--CA 1.417 -2.092 0 O-C-N 121.537 -0.727 . . . . 25.449999999999999 109.188 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -62.13 -51.95 65.81 Favored 'General case' 0 C--O 1.26 1.611 0 O-C-N 124.199 0.937 . . . . 28.129999999999999 110.033 179.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -61.87 -41.74 98.22 Favored 'General case' 0 C--O 1.262 1.755 0 CA-C-N 114.804 -1.089 . . . . 57.329999999999998 111.63 179.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.91 -37.64 85.4 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 122.337 1.065 . . . . 55.859999999999999 113.512 177.885 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.49 -46.86 74.9 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.732 -1.122 . . . . 29.23 108.382 177.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.8 mt -60.85 -30.96 70.43 Favored 'General case' 0 C--O 1.263 1.768 0 C-N-CA 120.286 -0.566 . . . . 32.740000000000002 111.082 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.434 ' OD2' ' O ' ' A' ' 219' ' ' HOH . 85.4 m-20 -77.06 -49.03 16.24 Favored 'General case' 0 C--O 1.214 -0.789 0 O-C-N 124.088 0.867 . . . . 55.579999999999998 110.431 -179.954 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.23 -16.71 63.83 Favored 'General case' 0 CA--C 1.57 1.722 0 N-CA-C 114.123 1.157 . . . . 39.109999999999999 114.123 179.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.81 -23.75 13.18 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 115.506 1.669 . . . . 37.420000000000002 115.506 174.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.93 -126.86 43.19 Favored Glycine 0 N--CA 1.439 -1.123 0 C-N-CA 119.187 -1.482 . . . . 40.460000000000001 109.942 -171.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -92.1 2.7 56.42 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.579 0.955 . . . . 49.039999999999999 113.579 -177.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -77.71 142.57 38.67 Favored 'General case' 0 C--O 1.254 1.291 0 CA-C-O 122.531 1.158 . . . . 44.0 112.153 -173.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 15.7 tp -51.12 131.95 27.75 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 123.893 1.806 . . . . 28.890000000000001 113.167 160.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 62.1 t -115.99 126.63 73.57 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.852 0 CA-C-N 113.911 -1.495 . . . . 26.68 109.023 170.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 59.7 t -112.75 125.63 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 O-C-N 125.142 1.526 . . . . 27.260000000000002 108.204 177.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 20.0 t -118.98 122.53 69.55 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 CA-C-N 115.908 -0.587 . . . . 22.82 111.509 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 59.8 t0 -95.56 109.96 22.11 Favored 'General case' 0 C--N 1.313 -1.0 0 O-C-N 125.676 1.86 . . . . 22.59 108.406 177.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -93.61 119.69 32.96 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 106.015 -1.846 . . . . 21.379999999999999 106.015 172.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.9 m -133.59 161.06 35.66 Favored 'General case' 0 C--O 1.24 0.602 0 O-C-N 121.395 -0.815 . . . . 20.34 109.482 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -139.39 149.08 43.69 Favored 'General case' 0 C--O 1.246 0.869 0 N-CA-C 105.726 -1.954 . . . . 26.550000000000001 105.726 -177.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.9 p -64.78 -30.15 71.15 Favored 'General case' 0 CA--C 1.554 1.129 0 CA-C-O 122.217 1.008 . . . . 36.219999999999999 113.627 -176.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 56.3 p-90 -76.12 -3.72 37.64 Favored 'General case' 0 N--CA 1.51 2.569 0 N-CA-C 115.68 1.733 . . . . 31.609999999999999 115.68 177.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 13.7 t -97.57 96.07 8.05 Favored 'General case' 0 C--O 1.163 -3.476 0 N-CA-C 106.275 -1.75 . . . . 27.280000000000001 106.275 -173.44 169.55 -139.632 76.768 99.751 2.099 99.587 83.495 -67.65 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -46.61 -55.54 8.0 Favored Glycine 0 C--O 1.276 2.762 0 CA-C-O 118.056 -1.414 . . . . 32.219999999999999 116.334 178.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.516 ' HA ' ' HG2' ' A' ' 37' ' ' MET . 49.0 Cg_exo -60.84 -30.12 89.5 Favored 'Trans proline' 0 CA--C 1.49 -1.713 1 C-N-CA 128.447 6.098 . . . . 33.240000000000002 111.342 178.485 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 85.2 m -62.75 -45.39 92.9 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-O 122.76 1.266 . . . . 28.09 110.612 169.46 -67.65 83.495 76.768 99.587 2.099 99.751 -139.632 169.55 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.1 mtmt -70.74 -32.66 69.91 Favored 'General case' 0 CA--C 1.575 1.924 0 O-C-N 120.777 -1.202 . . . . 53.380000000000003 110.132 176.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' MET . . . . . 0.516 ' HG2' ' HA ' ' A' ' 34' ' ' PRO . 5.0 ptp -67.89 -37.61 81.96 Favored 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 119.023 -1.071 . . . . 95.469999999999999 110.687 179.521 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.5 tt -83.32 -9.81 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 N-CA-C 114.234 1.198 . . . . 36.399999999999999 114.234 -177.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 39.0 tttm -60.85 -43.82 92.86 Favored Pre-proline 0 CA--C 1.563 1.448 0 N-CA-C 113.617 0.969 . . . . 47.409999999999997 113.617 -173.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -56.84 -44.99 39.68 Favored 'Trans proline' 0 C--O 1.256 1.4 0 CA-C-O 118.067 -0.889 . . . . 36.240000000000002 114.342 174.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -60.55 -39.03 86.44 Favored 'General case' 0 C--O 1.252 1.197 0 O-C-N 124.987 1.429 . . . . 25.859999999999999 111.774 174.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -56.68 -48.57 77.35 Favored 'General case' 0 CA--C 1.564 1.516 0 N-CA-C 113.904 1.075 . . . . 22.460000000000001 113.904 172.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.687 ' CD2' ' O ' ' A' ' 261' ' ' HOH . 60.1 m-70 -56.99 -44.11 82.41 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 124.569 1.168 . . . . 36.299999999999997 110.861 173.999 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.7 p -57.08 -43.19 81.92 Favored 'General case' 0 N--CA 1.5 2.07 0 CA-C-O 122.77 1.271 . . . . 26.5 113.271 175.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 66.3 mt -61.63 -39.1 90.11 Favored 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 119.401 -2.062 . . . . 25.149999999999999 109.912 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.8 p -66.88 -34.1 77.05 Favored 'General case' 0 N--CA 1.437 -1.105 0 O-C-N 124.637 1.21 . . . . 34.689999999999998 111.755 -178.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -72.43 -41.06 66.59 Favored 'General case' 0 C--O 1.215 -0.738 0 O-C-N 124.478 1.111 . . . . 71.560000000000002 111.569 173.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -68.04 -48.75 64.8 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.935 1.087 . . . . 37.039999999999999 113.935 178.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -102.49 81.94 2.1 Favored 'General case' 0 N--CA 1.412 -2.362 0 N-CA-C 106.191 -1.781 . . . . 31.800000000000001 106.191 -175.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.4 p -73.92 -12.65 60.72 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 119.703 -0.799 . . . . 42.310000000000002 109.432 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -77.07 -5.77 50.18 Favored 'General case' 0 CA--C 1.566 1.594 0 N-CA-C 117.396 2.369 . . . . 44.590000000000003 117.396 174.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 41.1 t -127.96 146.24 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 N-CA-C 101.076 -3.675 . . . . 32.149999999999999 101.076 -167.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 94.8 mt -104.61 130.89 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 N-CA-C 108.923 -0.769 . . . . 32.5 108.923 179.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -115.61 126.3 54.01 Favored 'General case' 0 N--CA 1.523 3.188 0 O-C-N 128.676 3.735 . . . . 27.859999999999999 109.187 -177.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.429 HD23 ' HB2' ' A' ' 3' ' ' LYS . 7.8 mt -123.97 147.87 47.4 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 113.674 -1.603 . . . . 33.07 109.476 176.839 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLU . . . . . 1.161 ' HG3' ' O ' ' A' ' 278' ' ' HOH . 7.1 mm-40 -114.23 132.84 55.99 Favored 'General case' 0 C--N 1.31 -1.125 0 N-CA-C 108.627 -0.879 . . . . 27.890000000000001 108.627 171.692 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 55.0 t -126.56 118.82 52.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 N-CA-C 105.84 -1.911 . . . . 23.550000000000001 105.84 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -89.83 119.15 29.97 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 105.777 -1.934 . . . . 40.710000000000001 105.777 174.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.3 m -63.16 -26.27 40.51 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 115.168 1.544 . . . . 27.850000000000001 115.168 -171.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -76.46 -34.09 58.72 Favored 'General case' 0 C--O 1.252 1.186 0 O-C-N 123.737 0.648 . . . . 32.340000000000003 110.362 178.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -68.86 -30.26 68.74 Favored 'General case' 0 C--O 1.207 -1.169 0 CA-C-O 122.764 1.268 . . . . 33.390000000000001 113.831 170.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' SNC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.708 ' NE2' ' O ' ' A' ' 283' ' ' HOH . 87.8 mt-30 -66.08 -37.11 84.97 Favored 'General case' 0 C--O 1.255 1.371 0 O-C-N 124.826 1.329 . . . . 67.400000000000006 112.592 -175.84 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 33.8 p-10 -59.85 -49.26 78.38 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.109 1.151 . . . . 43.490000000000002 114.109 173.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 71.8 t -62.99 -44.38 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.715 0 CA-C-N 115.078 -0.965 . . . . 27.780000000000001 108.615 178.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.28 -49.7 76.21 Favored 'General case' 0 C--O 1.26 1.608 0 CA-C-O 121.176 0.512 . . . . 25.809999999999999 111.56 179.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 32.9 t -60.12 -50.1 75.05 Favored 'General case' 0 C--O 1.258 1.539 0 CA-C-N 114.757 -1.11 . . . . 27.34 111.071 176.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.478 ' OE1' ' NZ ' ' A' ' 8' ' ' LYS . 73.8 mt-10 -62.2 -31.19 71.69 Favored 'General case' 0 C--O 1.273 2.318 0 O-C-N 124.062 0.851 . . . . 44.390000000000001 112.108 -177.098 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 63.8 m -82.56 -6.3 59.26 Favored 'General case' 0 C--O 1.259 1.556 0 N-CA-C 113.383 0.883 . . . . 29.510000000000002 113.383 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 60.89 32.92 20.04 Favored 'General case' 0 C--O 1.2 -1.55 0 CA-C-O 122.809 1.29 . . . . 58.689999999999998 111.816 177.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.557 HG11 ' HE1' ' A' ' 74' ' ' MET . 78.9 t -62.51 134.66 27.69 Favored 'Isoleucine or valine' 0 C--O 1.266 1.933 0 CA-C-N 114.512 -1.222 . . . . 32.289999999999999 111.035 173.358 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -124.18 -44.55 2.02 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 126.102 2.126 . . . . 55.460000000000001 116.012 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' SER . . . . . 0.517 ' HB3' ' HB3' ' A' ' 90' ' ' SER . 1.1 m -102.8 162.5 12.88 Favored 'General case' 0 CA--C 1.56 1.359 0 CA-C-O 117.339 -1.315 . . . . 32.82 112.121 176.579 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' MET . . . . . 0.557 ' HE1' HG11 ' A' ' 71' ' ' VAL . 32.8 mmt -122.06 131.11 24.47 Favored Pre-proline 0 CA--C 1.585 2.304 0 C-N-CA 127.312 2.245 . . . . 33.0 105.662 -177.923 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -78.38 158.55 93.04 Favored 'Cis proline' 0 C--O 1.266 1.889 0 C-N-CA 123.421 -1.491 . . . . 23.140000000000001 112.86 -12.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.1 m -117.17 134.19 55.08 Favored 'General case' 0 N--CA 1.425 -1.691 0 N-CA-C 108.41 -0.959 . . . . 23.120000000000001 108.41 167.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -106.84 119.27 38.88 Favored 'General case' 0 N--CA 1.438 -1.031 0 O-C-N 124.282 0.989 . . . . 20.050000000000001 108.413 173.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -110.06 150.59 28.34 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 124.122 0.889 . . . . 25.98 110.347 170.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . 0.25 88.0 m-85 -129.47 133.66 47.41 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 106.404 -1.702 . . . . 23.690000000000001 106.404 -172.416 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -129.61 146.91 51.37 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-N 112.487 -2.142 . . . . 29.059999999999999 114.21 -179.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.474 ' HG3' HG21 ' A' ' 86' ' ' VAL . 41.7 mtmt -142.78 129.3 20.18 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 106.413 -1.699 . . . . 32.409999999999997 106.413 169.604 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 14.6 mttt 55.73 48.26 18.73 Favored 'General case' 0 N--CA 1.512 2.633 0 CA-C-O 122.845 1.307 . . . . 64.590000000000003 112.989 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 70.38 -3.61 10.89 Favored Glycine 0 C--O 1.224 -0.478 0 N-CA-C 118.573 2.189 . . . . 42.159999999999997 118.573 -178.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 27.8 mm100 -103.42 139.92 38.15 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 117.922 0.861 . . . . 52.32 109.123 -176.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -76.42 119.62 20.53 Favored 'General case' 0 C--O 1.25 1.126 0 O-C-N 124.638 1.211 . . . . 43.810000000000002 111.868 173.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.474 HG21 ' HG3' ' A' ' 81' ' ' LYS . 33.9 m -114.31 0.69 8.71 Favored 'Isoleucine or valine' 0 C--O 1.251 1.175 0 CA-C-N 114.669 -1.151 . . . . 37.549999999999997 113.038 -179.109 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -169.64 160.31 33.39 Favored Glycine 0 CA--C 1.495 -1.197 0 C-N-CA 119.489 -1.339 . . . . 29.25 113.552 172.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -163.33 141.79 8.06 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 113.472 0.915 . . . . 40.049999999999997 113.472 172.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -156.15 168.13 28.24 Favored 'General case' 0 C--O 1.262 1.739 0 CA-C-O 121.538 0.685 . . . . 23.460000000000001 109.935 164.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . 0.517 ' HB3' ' HB3' ' A' ' 73' ' ' SER . 71.4 p -120.63 158.1 28.12 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 116.18 -0.464 . . . . 25.890000000000001 111.281 174.488 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 104.59 147.02 16.12 Favored Glycine 0 C--O 1.264 1.993 0 O-C-N 125.407 1.692 . . . . 22.57 110.051 176.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.13 59.8 4.6 Favored 'General case' 0 N--CA 1.528 3.45 0 CA-C-N 113.24 -1.48 . . . . 32.630000000000003 112.783 -177.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -102.51 104.51 14.94 Favored 'General case' 0 C--O 1.272 2.25 0 N-CA-C 106.209 -1.774 . . . . 31.969999999999999 106.209 -176.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.03 -47.18 85.88 Favored 'General case' 0 N--CA 1.495 1.822 0 CA-C-O 122.69 1.233 . . . . 32.719999999999999 113.998 -176.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -62.13 -44.12 97.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.094 -0.957 . . . . 65.629999999999995 111.535 -178.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -65.65 -39.69 91.69 Favored 'General case' 0 C--O 1.282 2.772 0 CA-C-N 115.114 -0.948 . . . . 35.630000000000003 111.841 178.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 24.8 tp -56.87 -50.05 73.64 Favored 'General case' 0 C--O 1.282 2.768 0 CA-C-O 122.225 1.012 . . . . 23.390000000000001 109.637 178.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 64.4 tt0 -69.58 -39.83 77.08 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 118.063 -1.455 . . . . 26.890000000000001 110.238 -175.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.48 -44.79 95.54 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 106.624 -1.621 . . . . 34.57 106.624 -177.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 62.4 m -59.82 -43.88 94.3 Favored 'General case' 0 C--O 1.288 3.101 0 C-N-CA 119.519 -0.872 . . . . 27.300000000000001 111.49 -179.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 79.7 mt -57.33 -48.3 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.316 0 O-C-N 120.967 -1.083 . . . . 29.43 108.525 177.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 -66.16 -31.97 73.13 Favored 'General case' 0 CA--C 1.569 1.68 0 C-N-CA 117.284 -1.766 . . . . 39.799999999999997 109.797 -175.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -62.98 -32.8 74.21 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.869 1.433 . . . . 33.939999999999998 114.869 174.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 79.8 mt -103.28 -29.72 11.08 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 115.749 1.759 . . . . 35.159999999999997 115.749 -171.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 C--O 1.277 2.514 0 CA-C-O 123.519 1.628 . . . . 42.759999999999998 107.288 -175.136 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . 0.434 ' O ' ' OD2' ' A' ' 16' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 257' ' ' HOH . . . . . 0.79 ' O ' ' HD3' ' A' ' 3' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 261' ' ' HOH . . . . . 0.687 ' O ' ' CD2' ' A' ' 43' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 278' ' ' HOH . . . . . 1.161 ' O ' ' HG3' ' A' ' 56' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 279' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 283' ' ' HOH . . . . . 0.708 ' O ' ' NE2' ' A' ' 63' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 287' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 288' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 289' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 290' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 291' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 292' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 293' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 294' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 295' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 296' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 297' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 298' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 299' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_