data_1xej_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 1xej _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' ' ' LYS . . . . . 0.479 ' O ' ' OG1' ' A' ' 40' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.856 0 CA-C-O 121.288 0.566 . . . . 38.799999999999997 111.143 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 64.7 t -116.73 138.58 46.86 Favored 'Isoleucine or valine' 0 C--O 1.25 1.128 1 N-CA-C 99.435 -4.283 . . . . 41.789999999999999 99.435 176.746 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PHE . . . . . 0.836 ' CE1' ' O ' ' A' ' 522' ' ' HOH . 9.8 m-85 -98.03 175.44 6.12 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 127.433 2.958 . . . . 40.039999999999999 112.538 -178.568 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLY . . . . . 0.492 ' O ' ' N ' ' A' ' 7' ' ' GLU . . . -127.08 118.21 2.93 Favored Glycine 0 N--CA 1.476 1.347 0 N-CA-C 105.772 -2.931 . . . . 41.420000000000002 105.772 178.806 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ARG . . . . . 0.489 ' C ' ' O ' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -14.42 -61.3 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 125.15 1.38 . . . . 36.829999999999998 111.875 -176.46 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . 0.403 ' N ' ' O ' ' A' ' 4' ' ' GLY . 72.1 m -62.55 -53.47 54.27 Favored 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 125.507 1.523 . . . . 43.189999999999998 114.222 -179.891 -62.802 -49.971 -51.499 98.779 2.034 105.211 -57.443 -58.785 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . 0.492 ' N ' ' O ' ' A' ' 4' ' ' GLY . 25.6 tt0 -50.18 -32.91 17.52 Favored 'General case' 0 C--O 1.244 0.799 0 O-C-N 126.662 2.476 . . . . 52.780000000000001 116.193 -179.972 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . 0.523 ' CD2' ' O ' ' A' ' 458' ' ' HOH . 19.8 tp -89.25 -23.34 22.36 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 129.099 2.96 . . . . 41.0 110.694 -179.304 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.86 -64.89 0.79 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.463 -1.244 . . . . 32.600000000000001 109.474 179.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . 0.614 ' CB ' ' O ' ' A' ' 480' ' ' HOH . . . -62.23 -21.65 65.32 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 111.191 -2.731 . . . . 30.710000000000001 113.55 -176.775 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.11 -51.06 13.0 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 106.345 -1.724 . . . . 25.640000000000001 106.345 178.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' MET . . . . . 0.73 ' CE ' ' O ' ' A' ' 519' ' ' HOH . 9.3 mtt -56.31 -43.62 79.11 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.898 0.856 . . . . 29.760000000000002 108.913 177.168 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . 0.588 ' NZ ' ' O ' ' A' ' 493' ' ' HOH . 24.8 tttt -58.7 -34.32 71.17 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 128.497 2.719 . . . . 32.799999999999997 114.943 179.247 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ARG . . . . . 0.619 ' NH1' ' O ' ' A' ' 495' ' ' HOH . 13.4 mtt85 -79.69 -19.38 49.11 Favored 'General case' 0 C--O 1.246 0.909 0 O-C-N 125.673 1.858 . . . . 30.609999999999999 107.74 176.795 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -99.51 19.14 16.24 Favored 'General case' 0 C--O 1.252 1.201 0 CA-C-O 124.278 1.99 . . . . 31.550000000000001 116.086 -179.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.18 31.4 69.12 Favored Glycine 0 C--O 1.252 1.275 0 N-CA-C 117.969 1.947 . . . . 36.109999999999999 117.969 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . 0.496 ' CD1' ' CG1' ' A' ' 92' ' ' VAL 0.287 20.3 mt -87.35 -17.4 32.48 Favored 'General case' 0 C--O 1.269 2.125 0 CA-C-O 117.83 -1.081 . . . . 38.689999999999998 111.556 179.264 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . 0.591 ' O ' ' CB ' ' A' ' 19' ' ' ASN . 22.4 t0 -67.2 97.87 0.56 Allowed 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 121.002 1.728 . . . . 37.210000000000001 112.724 179.395 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASN . . . . . 0.591 ' CB ' ' O ' ' A' ' 18' ' ' ASP . 2.5 m120 96.63 -27.23 0.02 OUTLIER 'General case' 0 C--O 1.261 1.679 0 CA-C-O 114.925 -2.464 . . . . 31.629999999999999 117.085 176.323 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -30.3 122.01 0.19 Allowed 'General case' 0 C--N 1.305 -1.356 0 C-N-CA 126.342 1.857 . . . . 25.07 111.134 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.8 mmt180 53.13 43.18 31.94 Favored 'General case' 0 C--N 1.295 -1.801 0 C-N-CA 128.186 2.595 . . . . 33.649999999999999 109.477 -179.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 49.95 50.95 31.24 Favored Glycine 0 N--CA 1.444 -0.826 0 C-N-CA 124.869 1.224 . . . . 28.190000000000001 114.741 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -127.23 112.39 15.05 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 112.795 -3.479 . . . . 31.239999999999998 104.119 177.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . 0.584 ' OG ' ' NE2' ' A' ' 121' ' ' GLN . 99.1 p -83.93 157.87 21.77 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 113.119 -3.432 . . . . 24.66 109.492 -175.073 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . 0.447 ' C ' ' O ' ' A' ' 24' ' ' SER . 10.4 tp -26.68 -60.64 0.09 Allowed 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 111.924 -2.398 . . . . 22.989999999999998 108.355 -178.469 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -33.69 -51.8 0.61 Allowed Glycine 0 C--N 1.297 -1.615 0 C-N-CA 130.369 3.842 . . . . 23.510000000000002 110.812 178.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASN . . . . . 0.408 ' N ' ' O ' ' A' ' 24' ' ' SER . 73.9 m-20 -52.89 -51.4 61.3 Favored 'General case' 0 C--N 1.311 -1.067 0 C-N-CA 124.174 0.99 . . . . 31.75 108.882 179.398 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 90.9 m95 -54.56 -62.76 1.45 Allowed 'General case' 0 C--N 1.312 -1.048 0 O-C-N 126.908 2.63 . . . . 19.75 112.502 -178.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.8 t -48.31 -40.87 10.42 Favored 'Isoleucine or valine' 0 C--O 1.244 0.792 0 CA-C-N 122.706 2.503 . . . . 23.920000000000002 114.187 178.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 49.2 t -66.96 -43.18 83.78 Favored 'General case' 0 C--O 1.246 0.921 0 CA-C-N 114.813 -1.085 . . . . 33.579999999999998 111.484 179.683 -173.972 -100.572 -93.476 106.002 2.038 103.556 -107.79 -30.175 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.37 -26.73 68.89 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 118.477 -2.639 . . . . 23.48 108.693 -178.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.0 -70.04 0.19 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 114.446 -2.692 . . . . 30.190000000000001 109.126 -179.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . 0.585 ' NZ ' ' O ' ' A' ' 499' ' ' HOH . 0.0 OUTLIER -46.73 -43.75 18.26 Favored 'General case' 0 C--N 1.297 -1.689 0 CA-C-O 115.018 -2.42 . . . . 43.280000000000001 115.896 179.507 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . 0.474 ' CE1' ' NE ' ' A' ' 114' ' ' ARG . 73.7 m-85 -87.35 15.33 6.57 Favored 'General case' 0 C--O 1.252 1.211 0 CA-C-N 122.668 2.486 . . . . 32.140000000000001 115.335 -179.01 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -111.33 -45.36 3.41 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 102.984 -2.969 . . . . 33.68 102.984 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 12.9 p -157.2 36.31 0.29 Allowed 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 116.005 1.854 . . . . 27.600000000000001 116.005 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASN . . . . . 0.541 ' O ' ' CB ' ' A' ' 38' ' ' PHE . 16.4 t-20 49.98 6.27 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 120.341 1.428 . . . . 38.590000000000003 113.659 -179.909 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . 0.541 ' CB ' ' O ' ' A' ' 37' ' ' ASN . 17.0 m-85 90.54 41.08 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 120.994 1.725 . . . . 39.950000000000003 108.787 178.602 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -111.11 109.22 19.2 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 128.141 2.576 . . . . 36.969999999999999 111.331 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . 0.479 ' OG1' ' O ' ' A' ' 1' ' ' LYS . 0.2 OUTLIER -66.67 -43.88 83.32 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 120.213 3.412 . . . . 35.890000000000001 120.213 -177.183 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -72.45 -12.03 60.93 Favored 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 125.524 1.529 . . . . 46.020000000000003 112.018 -178.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.61 117.97 5.54 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 127.326 2.251 . . . . 33.009999999999998 115.929 -177.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.1 p -122.09 160.25 25.43 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 112.264 -2.244 . . . . 38.240000000000002 105.679 179.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . 0.545 ' CB ' ' O ' ' A' ' 500' ' ' HOH . 0.4 OUTLIER -152.04 127.96 10.31 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 116.724 -1.991 . . . . 41.960000000000001 107.819 179.716 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -96.0 116.88 29.61 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 124.269 1.985 . . . . 43.539999999999999 113.409 -178.749 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.6 m-20 -78.2 -159.09 0.15 Allowed 'General case' 0 C--O 1.248 1.022 0 CA-C-N 110.145 -3.207 . . . . 49.759999999999998 106.007 178.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 21.4 m -85.06 -46.45 11.15 Favored 'General case' 0 C--O 1.26 1.639 0 N-CA-C 121.031 3.715 . . . . 44.07 121.031 -177.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . 0.408 ' O ' ' OD1' ' A' ' 48' ' ' ASP . 19.5 t0 -98.31 73.37 2.15 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 121.085 1.766 . . . . 46.329999999999998 115.01 -177.948 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 37.43 51.36 1.79 Allowed Glycine 0 CA--C 1.537 1.434 0 N-CA-C 107.81 -2.116 . . . . 47.560000000000002 107.81 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.6 t -116.06 144.45 44.1 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 112.143 -2.029 . . . . 38.590000000000003 106.842 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.9 m -150.12 144.05 25.46 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 123.159 1.457 . . . . 28.010000000000002 109.979 -178.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . 0.484 ' OD1' ' CB ' ' A' ' 59' ' ' ASN . 56.3 m-20 -115.26 126.0 53.99 Favored 'General case' 0 C--N 1.313 -1.006 1 CA-C-O 111.671 -4.014 . . . . 34.710000000000001 105.008 -178.424 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -118.12 153.5 33.69 Favored 'General case' 0 C--N 1.312 -1.024 1 O-C-N 129.729 4.393 . . . . 36.390000000000001 114.527 -179.209 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLY . . . . . 0.571 ' O ' ' N ' ' A' ' 56' ' ' LEU . . . 44.96 -173.92 0.01 OUTLIER Glycine 0 C--N 1.307 -1.048 1 CA-C-O 128.423 4.346 . . . . 28.039999999999999 121.605 178.589 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 4.2 tp -18.92 -31.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.427 -1.601 1 C-N-CA 135.425 5.49 . . . . 31.16 114.42 -177.707 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . 0.655 ' CD1' ' O ' ' A' ' 475' ' ' HOH . 39.2 mt -136.53 4.33 2.85 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 125.527 1.767 . . . . 27.07 112.529 -177.621 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLN . . . . . 0.53 ' N ' ' O ' ' A' ' 54' ' ' GLY . 22.9 mm-40 52.72 56.3 7.82 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 119.099 3.0 . . . . 22.969999999999999 119.099 179.275 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.2 mp -71.61 116.22 13.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.5 0 N-CA-C 103.979 -2.6 . . . . 25.0 103.979 175.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . 0.484 ' CB ' ' OD1' ' A' ' 52' ' ' ASP . 0.1 OUTLIER -83.88 134.06 34.7 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 114.49 1.293 . . . . 33.130000000000003 114.49 -178.344 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.0 p -56.86 -29.69 63.13 Favored 'General case' 0 C--N 1.299 -1.596 1 C-N-CA 132.404 4.282 . . . . 25.309999999999999 119.639 -177.632 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ARG . . . . . 0.597 ' NH1' ' O ' ' A' ' 487' ' ' HOH . 9.1 ttt180 -70.73 -18.86 62.79 Favored 'General case' 0 C--O 1.261 1.709 0 CA-C-N 121.028 1.74 . . . . 32.920000000000002 110.35 179.708 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 40.6 m95 -118.64 -40.81 2.85 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 121.343 3.831 . . . . 39.32 121.343 -177.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TRP . . . . . . . . . . . . . 39.7 m95 -101.74 -39.65 7.33 Favored 'General case' 0 C--N 1.284 -2.247 0 CA-C-O 113.998 -2.906 . . . . 23.190000000000001 116.607 -174.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 24.4 p -130.28 175.96 8.51 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 121.07 1.759 . . . . 26.32 111.392 -179.666 67.596 83.184 97.099 111.756 2.002 112.348 -47.575 -62.53 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASN . . . . . 0.638 ' OD1' ' N ' ' A' ' 67' ' ' GLY . 29.5 t-20 -121.45 137.41 54.73 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 116.937 -1.506 . . . . 35.100000000000001 111.671 -179.293 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 48.7 p-10 -132.87 27.65 4.25 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 107.242 -1.392 . . . . 26.739999999999998 107.242 -179.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . 0.656 ' O ' ' CB ' ' A' ' 68' ' ' ARG . . . 42.59 99.46 0.01 OUTLIER Glycine 0 C--N 1.313 -0.745 0 CA-C-N 109.384 -3.553 . . . . 28.34 109.246 -179.224 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . 0.656 ' CB ' ' O ' ' A' ' 67' ' ' GLY . 0.0 OUTLIER 166.95 -33.14 0.0 OUTLIER 'General case' 0 C--O 1.252 1.194 0 C-N-CA 117.166 -1.814 . . . . 45.240000000000002 114.911 178.526 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . 0.587 ' CG2' ' O ' ' A' ' 523' ' ' HOH . 0.0 OUTLIER -90.74 118.23 68.51 Favored Pre-proline 0 CA--C 1.503 -0.842 1 N-CA-C 127.112 5.967 . . . . 46.950000000000003 127.112 -174.675 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_exo -36.17 -21.14 0.04 OUTLIER 'Trans proline' 0 C--O 1.247 0.927 1 C-N-CA 125.951 4.434 . . . . 43.32 118.461 177.193 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 69' ' ' THR . . . -96.26 -65.97 0.95 Allowed Glycine 0 CA--C 1.522 0.48 0 C-N-CA 125.234 1.397 . . . . 43.899999999999999 111.851 -179.415 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 14.78 92.11 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.788 2 C-N-CA 138.782 6.833 . . . . 44.969999999999999 121.828 179.529 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 38.2 mtp85 -92.33 -25.99 18.29 Favored 'General case' 0 C--O 1.261 1.695 1 N-CA-C 122.527 4.269 . . . . 48.0 122.527 -177.047 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASN . . . . . 0.416 ' OD1' ' O ' ' A' ' 78' ' ' ILE . 1.7 t-20 53.24 61.52 3.11 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 118.124 -1.431 . . . . 38.259999999999998 109.764 -179.43 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -72.17 -34.84 68.76 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 118.685 -1.206 . . . . 26.789999999999999 107.876 179.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 1.2 m -77.92 -8.25 57.85 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 127.203 2.815 . . . . 24.760000000000002 108.152 -179.168 -96.473 -173.27 102.539 106.612 2.023 109.584 41.812 -174.257 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASN . . . . . 0.558 ' CG ' ' O ' ' A' ' 77' ' ' ASN . 43.3 t30 47.72 55.68 8.14 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 128.182 2.593 . . . . 34.740000000000002 114.672 -178.997 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ILE . . . . . 0.549 ' CB ' ' CD ' ' A' ' 79' ' ' PRO . 12.1 pt -145.66 169.33 9.93 Favored Pre-proline 0 C--N 1.312 -1.042 0 O-C-N 126.935 2.647 . . . . 24.879999999999999 111.519 178.473 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PRO . . . . . 0.549 ' CD ' ' CB ' ' A' ' 78' ' ' ILE . 2.6 Cg_exo -88.24 123.07 1.58 Allowed 'Trans proline' 0 C--N 1.308 -1.556 1 C-N-CA 127.393 5.396 . . . . 25.390000000000001 111.895 178.512 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' CYS . . . . . 0.413 ' C ' ' O ' ' A' ' 79' ' ' PRO . 70.8 m -45.28 -37.65 4.92 Favored 'General case' 0 C--O 1.26 1.639 0 CA-C-O 114.146 -2.835 . . . . 24.719999999999999 111.872 -177.501 -62.53 -47.575 97.099 112.348 2.002 111.756 83.184 67.596 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.1 p -62.54 -14.95 47.83 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 123.807 3.003 . . . . 24.57 110.2 -179.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . 0.512 ' N ' ' O ' ' A' ' 79' ' ' PRO . . . -61.47 -30.44 70.6 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 115.112 -2.635 . . . . 23.93 105.997 178.772 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . 0.406 ' CB ' ' O ' ' A' ' 80' ' ' CYS . 0.0 OUTLIER -75.24 -14.15 60.5 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 129.407 3.083 . . . . 29.149999999999999 118.328 -175.924 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.3 mt -106.8 16.27 24.59 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 116.753 -1.594 . . . . 34.979999999999997 114.467 -179.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . 0.457 ' O ' ' N ' ' A' ' 87' ' ' ASP . 2.4 m -110.88 137.45 48.51 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 105.947 -1.872 . . . . 43.350000000000001 105.947 177.544 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' SER . . . . . 0.536 ' CB ' ' O ' ' A' ' 527' ' ' HOH . 48.7 m -45.02 -11.37 0.01 OUTLIER 'General case' 0 C--O 1.248 1.009 0 C-N-CA 126.615 1.966 . . . . 40.759999999999998 111.319 178.803 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . 0.457 ' N ' ' O ' ' A' ' 85' ' ' SER . 1.5 p30 -85.04 102.45 13.22 Favored 'General case' 0 N--CA 1.49 1.528 1 N-CA-C 99.424 -4.287 . . . . 45.439999999999998 99.424 177.086 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -71.51 -13.12 16.63 Favored 'Isoleucine or valine' 0 C--O 1.241 0.638 0 C-N-CA 128.185 2.594 . . . . 38.159999999999997 115.852 -176.557 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' THR . . . . . 0.681 ' CG2' ' O ' ' A' ' 89' ' ' THR . 77.6 m -60.12 -4.13 0.73 Allowed 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 114.888 -2.482 . . . . 31.23 116.761 -178.511 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -104.16 -22.59 13.38 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 120.549 1.522 . . . . 24.27 107.394 176.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 53.2 m -79.75 -47.26 15.55 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 123.404 0.682 . . . . 25.149999999999999 110.699 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . 0.496 ' CG1' ' CD1' ' A' ' 17' ' ' LEU . 38.2 t -64.58 -46.43 92.56 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.064 0 N-CA-C 108.857 -0.794 . . . . 28.010000000000002 108.857 179.119 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -55.07 -37.9 67.35 Favored 'General case' 0 C--N 1.315 -0.934 0 O-C-N 125.834 1.958 . . . . 36.990000000000002 114.668 179.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 48.8 t -81.33 -42.1 21.06 Favored 'General case' 0 C--N 1.294 -1.818 0 C-N-CA 129.21 3.004 . . . . 28.010000000000002 111.043 178.543 -174.257 41.812 102.539 109.584 2.023 106.612 -173.27 -96.473 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -48.73 -47.62 41.27 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 126.414 1.885 . . . . 26.18 112.089 178.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 82.5 mttt -64.33 -19.11 65.23 Favored 'General case' 0 C--O 1.253 1.258 0 CA-C-N 112.767 -2.015 . . . . 25.350000000000001 112.089 179.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.3 tttp -91.57 -21.01 21.07 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 127.487 3.518 . . . . 30.870000000000001 107.979 178.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 59.2 mt -75.48 -65.15 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 102.325 -3.213 . . . . 27.219999999999999 102.325 179.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.2 t -44.02 -45.2 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 O-C-N 127.593 3.058 . . . . 35.579999999999998 112.403 179.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.3 m -60.44 -2.14 0.45 Allowed 'General case' 0 C--O 1.257 1.49 0 CA-C-O 113.005 -3.379 . . . . 37.469999999999999 119.2 179.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -126.79 110.94 13.63 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 123.523 2.874 . . . . 45.969999999999999 109.447 -179.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLY . . . . . 0.563 ' O ' ' N ' ' A' ' 104' ' ' GLY . . . 59.94 -123.42 33.09 Favored Glycine 0 C--N 1.319 -0.408 0 O-C-N 125.886 1.991 . . . . 40.210000000000001 112.634 179.274 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -29.68 3.92 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 131.025 3.73 . . . . 38.960000000000001 118.67 -178.333 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 102' ' ' GLY . . . 44.31 -143.21 2.55 Favored Glycine 0 N--CA 1.482 1.76 0 CA-C-N 124.823 3.465 . . . . 28.100000000000001 109.096 -179.358 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.8 -1.46 16.73 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 127.082 2.153 . . . . 27.079999999999998 115.375 179.963 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASN . . . . . 0.878 ' ND2' ' CZ3' ' A' ' 111' ' ' TRP . 1.0 OUTLIER -75.87 3.03 10.86 Favored 'General case' 0 C--N 1.311 -1.085 0 C-N-CA 130.413 3.485 . . . . 34.530000000000001 110.254 178.651 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.89 -6.42 32.4 Favored 'General case' 0 C--N 1.304 -1.379 1 C-N-CA 135.221 5.408 . . . . 36.75 113.8 -179.924 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' TRP . . . . . 0.762 ' CZ2' ' O ' ' A' ' 474' ' ' HOH . 5.2 m-90 -112.99 67.88 0.67 Allowed 'General case' 0 C--N 1.302 -1.495 1 C-N-CA 132.66 4.384 . . . . 39.68 104.645 175.248 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 1.5 p -23.51 -30.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 111.893 -3.908 . . . . 35.899999999999999 114.64 -178.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . 0.601 ' N ' ' O ' ' A' ' 108' ' ' TRP . . . -89.67 -5.28 57.23 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 123.021 2.646 . . . . 25.41 112.232 -178.96 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' TRP . . . . . 0.878 ' CZ3' ' ND2' ' A' ' 106' ' ' ASN . 9.8 t90 -91.09 -36.35 14.06 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 103.434 -2.802 . . . . 37.759999999999998 103.434 179.111 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ARG . . . . . 0.638 ' NH2' ' O ' ' A' ' 482' ' ' HOH . 12.1 ttt-85 -96.29 82.52 3.44 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 103.151 -2.907 . . . . 51.909999999999997 103.151 176.658 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASN . . . . . 0.446 ' CB ' ' O ' ' A' ' 112' ' ' ARG . 1.3 m120 155.65 -19.1 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 120.195 1.361 . . . . 36.869999999999997 109.249 -176.998 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ARG . . . . . 0.474 ' NE ' ' CE1' ' A' ' 34' ' ' PHE . 12.5 mtp85 -139.2 -18.23 1.01 Allowed 'General case' 0 C--O 1.25 1.111 0 CA-C-O 115.174 -2.346 . . . . 46.579999999999998 117.213 -179.375 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 1.7 m -134.98 -16.84 1.91 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 123.421 2.828 . . . . 31.18 110.845 -179.775 -30.175 -107.79 -93.476 103.556 2.038 106.002 -100.572 -173.972 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . 0.647 ' NZ ' ' O ' ' A' ' 482' ' ' HOH . 20.1 tttt -69.07 132.93 47.39 Favored 'General case' 0 C--N 1.312 -1.028 0 O-C-N 127.683 3.115 . . . . 33.0 102.694 178.003 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 88.07 -16.66 50.84 Favored Glycine 0 C--O 1.256 1.481 0 CA-C-O 115.635 -2.759 . . . . 45.270000000000003 112.153 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 47.8 p -97.06 -177.57 3.9 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 121.695 2.748 . . . . 53.359999999999999 108.927 179.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -90.29 68.86 7.01 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 127.905 2.482 . . . . 41.630000000000003 108.669 -179.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' VAL . . . . . 0.517 ' O ' ' N ' ' A' ' 122' ' ' ALA . 1.7 m -49.43 -53.62 8.6 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 O-C-N 128.533 3.646 . . . . 40.189999999999998 115.421 -179.625 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLN . . . . . 0.584 ' NE2' ' OG ' ' A' ' 24' ' ' SER . 8.7 tp-100 -61.48 35.41 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 113.882 -1.508 . . . . 41.780000000000001 113.666 -177.533 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ALA . . . . . 0.517 ' N ' ' O ' ' A' ' 120' ' ' VAL . . . -124.04 -26.08 4.09 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 123.375 1.56 . . . . 39.670000000000002 107.62 -178.621 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' TRP . . . . . 0.461 ' O ' ' NH1' ' A' ' 5' ' ' ARG . 54.5 m95 -58.65 -35.4 72.47 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 109.212 -3.631 . . . . 36.090000000000003 107.949 178.922 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 4.1 mt -83.11 -23.72 8.34 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.208 0 N-CA-C 120.425 3.491 . . . . 42.060000000000002 120.425 179.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 64.2 mmt-85 -76.42 123.28 25.76 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 131.02 3.728 . . . . 39.020000000000003 118.722 -177.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 107.58 -14.81 38.63 Favored Glycine 0 N--CA 1.469 0.85 0 O-C-N 124.299 0.999 . . . . 35.380000000000003 112.484 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 74.9 m -80.78 18.27 1.01 Allowed 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 126.823 2.049 . . . . 35.380000000000003 113.213 -179.328 -58.785 -57.443 -51.499 105.211 2.034 98.779 -49.971 -62.802 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 2.1 mmt-85 68.98 79.66 0.2 Allowed 'General case' 0 C--N 1.31 -1.143 1 CA-C-O 129.706 4.574 . . . . 49.060000000000002 104.152 -178.521 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LEU . . . . . 0.659 ' O ' ' CG ' ' A' ' 129' ' ' LEU . 3.5 tp . . . . . 0 C--N 1.314 -0.977 3 C-N-CA 132.589 4.356 . . . . 42.670000000000002 103.019 -177.404 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 451' ' ' HOH . . . . . 0.405 ' O ' ' ND2' ' A' ' 106' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 458' ' ' HOH . . . . . 0.523 ' O ' ' CD2' ' A' ' 8' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 461' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 464' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 470' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 471' ' ' HOH . . . . . 0.456 ' O ' ' NH2' ' A' ' 112' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 473' ' ' HOH . . . . . 0.634 ' O ' ' ND2' ' A' ' 65' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 474' ' ' HOH . . . . . 0.762 ' O ' ' CZ2' ' A' ' 108' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 475' ' ' HOH . . . . . 0.655 ' O ' ' CD1' ' A' ' 56' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 480' ' ' HOH . . . . . 0.614 ' O ' ' CB ' ' A' ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 482' ' ' HOH . . . . . 0.647 ' O ' ' NZ ' ' A' ' 116' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 486' ' ' HOH . . . . . 0.423 ' O ' ' NH2' ' A' ' 61' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 487' ' ' HOH . . . . . 0.597 ' O ' ' NH1' ' A' ' 61' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 489' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 493' ' ' HOH . . . . . 0.588 ' O ' ' NZ ' ' A' ' 13' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 495' ' ' HOH . . . . . 0.619 ' O ' ' NH1' ' A' ' 14' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 497' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 499' ' ' HOH . . . . . 0.585 ' O ' ' NZ ' ' A' ' 33' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 500' ' ' HOH . . . . . 0.545 ' O ' ' CB ' ' A' ' 44' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 504' ' ' HOH . . . . . 0.543 ' O ' ' N ' ' A' ' 56' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 508' ' ' HOH . . . . . 0.455 ' O ' ' CB ' ' A' ' 85' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 519' ' ' HOH . . . . . 0.73 ' O ' ' CE ' ' A' ' 12' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' HOH . . . . . 0.836 ' O ' ' CE1' ' A' ' 3' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 523' ' ' HOH . . . . . 0.587 ' O ' ' CG2' ' A' ' 69' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 527' ' ' HOH . . . . . 0.536 ' O ' ' CB ' ' A' ' 86' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' LYS . . . . . 0.417 ' HG3' ' O ' ' A' ' 2' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.856 0 CA-C-O 121.288 0.566 . . . . 38.799999999999997 111.143 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . 0.417 ' O ' ' HG3' ' A' ' 1' ' ' LYS . 64.7 t -116.73 138.58 46.86 Favored 'Isoleucine or valine' 0 C--O 1.25 1.128 1 N-CA-C 99.435 -4.283 . . . . 41.789999999999999 99.435 176.746 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PHE . . . . . 0.836 ' CE1' ' O ' ' A' ' 522' ' ' HOH . 9.8 m-85 -98.03 175.44 6.12 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 127.433 2.958 . . . . 40.039999999999999 112.538 -178.568 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLY . . . . . 0.492 ' O ' ' N ' ' A' ' 7' ' ' GLU . . . -127.08 118.21 2.93 Favored Glycine 0 N--CA 1.476 1.347 0 N-CA-C 105.772 -2.931 . . . . 41.420000000000002 105.772 178.806 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ARG . . . . . 0.688 ' HD2' ' O ' ' A' ' 123' ' ' TRP . 0.1 OUTLIER -14.42 -61.3 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 125.15 1.38 . . . . 36.829999999999998 111.875 -176.46 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . 0.428 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 72.1 m -62.55 -53.47 54.27 Favored 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 125.507 1.523 . . . . 43.189999999999998 114.222 -179.891 -62.802 -49.971 -51.499 98.779 2.034 105.211 -57.443 -58.785 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . 0.492 ' N ' ' O ' ' A' ' 4' ' ' GLY . 25.6 tt0 -50.18 -32.91 17.52 Favored 'General case' 0 C--O 1.244 0.799 0 O-C-N 126.662 2.476 . . . . 52.780000000000001 116.193 -179.972 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . 0.749 HD21 ' O ' ' A' ' 458' ' ' HOH . 19.8 tp -89.25 -23.34 22.36 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 129.099 2.96 . . . . 41.0 110.694 -179.304 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 6' ' ' CYS . . . -59.86 -64.89 0.79 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.463 -1.244 . . . . 32.600000000000001 109.474 179.405 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . 0.614 ' CB ' ' O ' ' A' ' 480' ' ' HOH . . . -62.23 -21.65 65.32 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 111.191 -2.731 . . . . 30.710000000000001 113.55 -176.775 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.11 -51.06 13.0 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 106.345 -1.724 . . . . 25.640000000000001 106.345 178.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' MET . . . . . 0.803 ' HE1' ' O ' ' A' ' 519' ' ' HOH . 9.3 mtt -56.31 -43.62 79.11 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.898 0.856 . . . . 29.760000000000002 108.913 177.168 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . 0.588 ' NZ ' ' O ' ' A' ' 493' ' ' HOH . 24.8 tttt -58.7 -34.32 71.17 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 128.497 2.719 . . . . 32.799999999999997 114.943 179.247 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ARG . . . . . 0.58 ' NH1' ' O ' ' A' ' 495' ' ' HOH . 13.4 mtt85 -79.69 -19.38 49.11 Favored 'General case' 0 C--O 1.246 0.909 0 O-C-N 125.673 1.858 . . . . 30.609999999999999 107.74 176.795 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HIS . . . . . 0.555 ' HD2' ' O ' ' A' ' 454' ' ' HOH . 74.9 m80 -99.51 19.14 16.24 Favored 'General case' 0 C--O 1.252 1.201 0 CA-C-O 124.278 1.99 . . . . 31.550000000000001 116.086 -179.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.18 31.4 69.12 Favored Glycine 0 C--O 1.252 1.275 0 N-CA-C 117.969 1.947 . . . . 36.109999999999999 117.969 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . 1.035 HD11 HG13 ' A' ' 92' ' ' VAL 0.287 20.3 mt -87.35 -17.4 32.48 Favored 'General case' 0 C--O 1.269 2.125 0 CA-C-O 117.83 -1.081 . . . . 38.689999999999998 111.556 179.264 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . 0.854 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 22.4 t0 -67.2 97.87 0.56 Allowed 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 121.002 1.728 . . . . 37.210000000000001 112.724 179.395 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASN . . . . . 0.854 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 33.1 m-20 96.63 -27.23 0.02 OUTLIER 'General case' 0 C--O 1.261 1.679 0 CA-C-O 114.925 -2.464 . . . . 31.629999999999999 117.085 176.323 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -30.3 122.01 0.19 Allowed 'General case' 0 C--N 1.305 -1.356 0 C-N-CA 126.342 1.857 . . . . 25.07 111.134 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.8 mmt180 53.13 43.18 31.94 Favored 'General case' 0 C--N 1.295 -1.801 0 C-N-CA 128.186 2.595 . . . . 33.649999999999999 109.477 -179.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 49.95 50.95 31.24 Favored Glycine 0 N--CA 1.444 -0.826 0 C-N-CA 124.869 1.224 . . . . 28.190000000000001 114.741 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' TYR . . . . . 0.472 ' HD1' ' ND2' ' A' ' 27' ' ' ASN . 34.8 m-85 -127.23 112.39 15.05 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 112.795 -3.479 . . . . 31.239999999999998 104.119 177.451 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . 0.447 ' O ' ' C ' ' A' ' 25' ' ' LEU . 99.1 p -83.93 157.87 21.77 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 113.119 -3.432 . . . . 24.66 109.492 -175.073 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' A' ' 28' ' ' TRP . 10.4 tp -26.68 -60.64 0.09 Allowed 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 111.924 -2.398 . . . . 22.989999999999998 108.355 -178.469 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -33.69 -51.8 0.61 Allowed Glycine 0 C--N 1.297 -1.615 0 C-N-CA 130.369 3.842 . . . . 23.510000000000002 110.812 178.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASN . . . . . 0.472 ' ND2' ' HD1' ' A' ' 23' ' ' TYR . 73.9 m-20 -52.89 -51.4 61.3 Favored 'General case' 0 C--N 1.311 -1.067 0 C-N-CA 124.174 0.99 . . . . 31.75 108.882 179.398 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TRP . . . . . 0.594 ' HZ3' ' O ' ' A' ' 474' ' ' HOH . 90.9 m95 -54.56 -62.76 1.45 Allowed 'General case' 0 C--N 1.312 -1.048 0 O-C-N 126.908 2.63 . . . . 19.75 112.502 -178.593 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . 0.446 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 3.8 t -48.31 -40.87 10.42 Favored 'Isoleucine or valine' 0 C--O 1.244 0.792 0 CA-C-N 122.706 2.503 . . . . 23.920000000000002 114.187 178.034 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' CYS . . . . . 0.443 ' HB2' ' CD1' ' A' ' 123' ' ' TRP . 49.2 t -66.96 -43.18 83.78 Favored 'General case' 0 C--O 1.246 0.921 0 CA-C-N 114.813 -1.085 . . . . 33.579999999999998 111.484 179.683 -173.972 -100.572 -93.476 106.002 2.038 103.556 -107.79 -30.175 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.37 -26.73 68.89 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 118.477 -2.639 . . . . 23.48 108.693 -178.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 29' ' ' VAL . . . -60.0 -70.04 0.19 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 114.446 -2.692 . . . . 30.190000000000001 109.126 -179.279 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . 0.515 ' HD3' ' O ' ' A' ' 499' ' ' HOH . 0.0 OUTLIER -46.73 -43.75 18.26 Favored 'General case' 0 C--N 1.297 -1.689 0 CA-C-O 115.018 -2.42 . . . . 43.280000000000001 115.896 179.507 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . 0.474 ' CE1' ' NE ' ' A' ' 114' ' ' ARG . 73.7 m-85 -87.35 15.33 6.57 Favored 'General case' 0 C--O 1.252 1.211 0 CA-C-N 122.668 2.486 . . . . 32.140000000000001 115.335 -179.01 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -111.33 -45.36 3.41 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 102.984 -2.969 . . . . 33.68 102.984 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 12.9 p -157.2 36.31 0.29 Allowed 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 116.005 1.854 . . . . 27.600000000000001 116.005 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASN . . . . . 0.541 ' O ' ' CB ' ' A' ' 38' ' ' PHE . 16.4 t-20 49.98 6.27 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 120.341 1.428 . . . . 38.590000000000003 113.659 -179.909 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . 0.541 ' CB ' ' O ' ' A' ' 37' ' ' ASN . 17.0 m-85 90.54 41.08 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 120.994 1.725 . . . . 39.950000000000003 108.787 178.602 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -111.11 109.22 19.2 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 128.141 2.576 . . . . 36.969999999999999 111.331 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . 0.436 HG22 ' O ' ' A' ' 517' ' ' HOH . 0.2 OUTLIER -66.67 -43.88 83.32 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 120.213 3.412 . . . . 35.890000000000001 120.213 -177.183 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -72.45 -12.03 60.93 Favored 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 125.524 1.529 . . . . 46.020000000000003 112.018 -178.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.61 117.97 5.54 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 127.326 2.251 . . . . 33.009999999999998 115.929 -177.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' THR . . . . . 0.845 HG22 HD21 ' A' ' 84' ' ' LEU . 1.1 p -122.09 160.25 25.43 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 112.264 -2.244 . . . . 38.240000000000002 105.679 179.662 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . 1.042 ' HB2' ' O ' ' A' ' 500' ' ' HOH . 0.5 OUTLIER -152.04 127.96 10.31 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 116.724 -1.991 . . . . 41.960000000000001 107.819 179.716 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . 0.432 ' HB2' ' O ' ' A' ' 489' ' ' HOH . 0.1 OUTLIER -96.0 116.88 29.61 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 124.269 1.985 . . . . 43.539999999999999 113.409 -178.749 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.6 m-20 -78.2 -159.09 0.15 Allowed 'General case' 0 C--O 1.248 1.022 0 CA-C-N 110.145 -3.207 . . . . 49.759999999999998 106.007 178.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 21.4 m -85.06 -46.45 11.15 Favored 'General case' 0 C--O 1.26 1.639 0 N-CA-C 121.031 3.715 . . . . 44.07 121.031 -177.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . 0.408 ' O ' ' OD1' ' A' ' 48' ' ' ASP . 19.5 t0 -98.31 73.37 2.15 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 121.085 1.766 . . . . 46.329999999999998 115.01 -177.948 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 37.43 51.36 1.79 Allowed Glycine 0 CA--C 1.537 1.434 0 N-CA-C 107.81 -2.116 . . . . 47.560000000000002 107.81 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.6 t -116.06 144.45 44.1 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 112.143 -2.029 . . . . 38.590000000000003 106.842 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.9 m -150.12 144.05 25.46 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 123.159 1.457 . . . . 28.010000000000002 109.979 -178.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . 0.955 ' OD1' ' HB2' ' A' ' 59' ' ' ASN . 56.3 m-20 -115.26 126.0 53.99 Favored 'General case' 0 C--N 1.313 -1.006 1 CA-C-O 111.671 -4.014 . . . . 34.710000000000001 105.008 -178.424 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 53' ' ' TYR . . . . . 0.533 ' CD2' HD11 ' A' ' 84' ' ' LEU . 44.6 m-85 -118.12 153.5 33.69 Favored 'General case' 0 C--N 1.312 -1.024 1 O-C-N 129.729 4.393 . . . . 36.390000000000001 114.527 -179.209 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLY . . . . . 0.571 ' O ' ' N ' ' A' ' 56' ' ' LEU . . . 44.96 -173.92 0.01 OUTLIER Glycine 0 C--N 1.307 -1.048 1 CA-C-O 128.423 4.346 . . . . 28.039999999999999 121.605 178.589 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 4.2 tp -18.92 -31.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.427 -1.601 1 C-N-CA 135.425 5.49 . . . . 31.16 114.42 -177.707 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . 1.072 HD11 ' O ' ' A' ' 475' ' ' HOH . 39.2 mt -136.53 4.33 2.85 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 125.527 1.767 . . . . 27.07 112.529 -177.621 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLN . . . . . 0.581 ' HB3' ' HB3' ' A' ' 52' ' ' ASP . 22.9 mm-40 52.72 56.3 7.82 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 119.099 3.0 . . . . 22.969999999999999 119.099 179.275 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ILE . . . . . 0.444 HG23 ' HB2' ' A' ' 63' ' ' TRP . 1.2 mp -71.61 116.22 13.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.5 0 N-CA-C 103.979 -2.6 . . . . 25.0 103.979 175.012 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . 0.955 ' HB2' ' OD1' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -83.88 134.06 34.7 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 114.49 1.293 . . . . 33.130000000000003 114.49 -178.344 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.0 p -56.86 -29.69 63.13 Favored 'General case' 0 C--N 1.299 -1.596 1 C-N-CA 132.404 4.282 . . . . 25.309999999999999 119.639 -177.632 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ARG . . . . . 0.717 ' HD2' ' O ' ' A' ' 523' ' ' HOH . 9.1 ttt180 -70.73 -18.86 62.79 Favored 'General case' 0 C--O 1.261 1.709 0 CA-C-N 121.028 1.74 . . . . 32.920000000000002 110.35 179.708 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TRP . . . . . 0.693 ' O ' HD23 ' A' ' 75' ' ' LEU . 40.6 m95 -118.64 -40.81 2.85 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 121.343 3.831 . . . . 39.32 121.343 -177.984 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TRP . . . . . 0.513 ' O ' ' HB2' ' A' ' 76' ' ' CYS . 39.7 m95 -101.74 -39.65 7.33 Favored 'General case' 0 C--N 1.284 -2.247 0 CA-C-O 113.998 -2.906 . . . . 23.190000000000001 116.607 -174.182 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 24.4 p -130.28 175.96 8.51 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 121.07 1.759 . . . . 26.32 111.392 -179.666 67.596 83.184 97.099 111.756 2.002 112.348 -47.575 -62.53 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASN . . . . . 0.634 ' ND2' ' O ' ' A' ' 473' ' ' HOH . 29.5 t-20 -121.45 137.41 54.73 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 116.937 -1.506 . . . . 35.100000000000001 111.671 -179.293 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 48.7 p-10 -132.87 27.65 4.25 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 107.242 -1.392 . . . . 26.739999999999998 107.242 -179.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . 0.656 ' O ' ' CB ' ' A' ' 68' ' ' ARG . . . 42.59 99.46 0.01 OUTLIER Glycine 0 C--N 1.313 -0.745 0 CA-C-N 109.384 -3.553 . . . . 28.34 109.246 -179.224 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . 0.656 ' CB ' ' O ' ' A' ' 67' ' ' GLY . 0.0 OUTLIER 166.95 -33.14 0.0 OUTLIER 'General case' 0 C--O 1.252 1.194 0 C-N-CA 117.166 -1.814 . . . . 45.240000000000002 114.911 178.526 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . 1.016 HG21 ' O ' ' A' ' 523' ' ' HOH . 0.0 OUTLIER -90.74 118.23 68.51 Favored Pre-proline 0 CA--C 1.503 -0.842 1 N-CA-C 127.112 5.967 . . . . 46.950000000000003 127.112 -174.675 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_exo -36.17 -21.14 0.04 OUTLIER 'Trans proline' 0 C--O 1.247 0.927 1 C-N-CA 125.951 4.434 . . . . 43.32 118.461 177.193 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 69' ' ' THR . . . -96.26 -65.97 0.95 Allowed Glycine 0 CA--C 1.522 0.48 0 C-N-CA 125.234 1.397 . . . . 43.899999999999999 111.851 -179.415 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . 0.482 ' HB3' ' O ' ' A' ' 69' ' ' THR . 0.2 OUTLIER 14.78 92.11 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.788 2 C-N-CA 138.782 6.833 . . . . 44.969999999999999 121.828 179.529 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . 0.627 ' HE ' HD21 ' A' ' 75' ' ' LEU . 38.2 mtp85 -92.33 -25.99 18.29 Favored 'General case' 0 C--O 1.261 1.695 1 N-CA-C 122.527 4.269 . . . . 48.0 122.527 -177.047 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASN . . . . . 0.416 ' OD1' ' O ' ' A' ' 78' ' ' ILE . 1.7 t-20 53.24 61.52 3.11 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 118.124 -1.431 . . . . 38.259999999999998 109.764 -179.43 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . 0.693 HD23 ' O ' ' A' ' 62' ' ' TRP . 2.7 mm? -72.17 -34.84 68.76 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 118.685 -1.206 . . . . 26.789999999999999 107.876 179.105 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' CYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 63' ' ' TRP . 1.2 m -77.92 -8.25 57.85 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 127.203 2.815 . . . . 24.760000000000002 108.152 -179.168 -96.473 -173.27 102.539 106.612 2.023 109.584 41.812 -174.257 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASN . . . . . 0.558 ' CG ' ' O ' ' A' ' 77' ' ' ASN . 43.3 t30 47.72 55.68 8.14 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 128.182 2.593 . . . . 34.740000000000002 114.672 -178.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ILE . . . . . 0.699 ' HB ' ' CD ' ' A' ' 79' ' ' PRO . 12.1 pt -145.66 169.33 9.93 Favored Pre-proline 0 C--N 1.312 -1.042 0 O-C-N 126.935 2.647 . . . . 24.879999999999999 111.519 178.473 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PRO . . . . . 0.699 ' CD ' ' HB ' ' A' ' 78' ' ' ILE . 2.6 Cg_exo -88.24 123.07 1.58 Allowed 'Trans proline' 0 C--N 1.308 -1.556 1 C-N-CA 127.393 5.396 . . . . 25.390000000000001 111.895 178.512 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 80' ' ' CYS . . . . . 0.809 ' O ' ' HB2' ' A' ' 83' ' ' LEU . 70.8 m -45.28 -37.65 4.92 Favored 'General case' 0 C--O 1.26 1.639 0 CA-C-O 114.146 -2.835 . . . . 24.719999999999999 111.872 -177.501 -62.53 -47.575 97.099 112.348 2.002 111.756 83.184 67.596 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.1 p -62.54 -14.95 47.83 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 123.807 3.003 . . . . 24.57 110.2 -179.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.47 -30.44 70.6 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 115.112 -2.635 . . . . 23.93 105.997 178.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . 0.809 ' HB2' ' O ' ' A' ' 80' ' ' CYS . 0.0 OUTLIER -75.24 -14.15 60.5 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 129.407 3.083 . . . . 29.149999999999999 118.328 -175.924 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . 0.845 HD21 HG22 ' A' ' 43' ' ' THR . 9.3 mt -106.8 16.27 24.59 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 116.753 -1.594 . . . . 34.979999999999997 114.467 -179.637 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . 0.716 ' HB2' ' O ' ' A' ' 508' ' ' HOH . 2.4 m -110.88 137.45 48.51 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 105.947 -1.872 . . . . 43.350000000000001 105.947 177.544 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' SER . . . . . 0.929 ' HB3' ' O ' ' A' ' 527' ' ' HOH . 48.7 m -45.02 -11.37 0.01 OUTLIER 'General case' 0 C--O 1.248 1.009 0 C-N-CA 126.615 1.966 . . . . 40.759999999999998 111.319 178.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . 0.457 ' N ' ' O ' ' A' ' 85' ' ' SER . 1.5 p30 -85.04 102.45 13.22 Favored 'General case' 0 N--CA 1.49 1.528 1 N-CA-C 99.424 -4.287 . . . . 45.439999999999998 99.424 177.086 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ILE . . . . . 0.619 HG13 HG23 ' A' ' 92' ' ' VAL . 0.1 OUTLIER -71.51 -13.12 16.63 Favored 'Isoleucine or valine' 0 C--O 1.241 0.638 0 C-N-CA 128.185 2.594 . . . . 38.159999999999997 115.852 -176.557 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 89' ' ' THR . . . . . 0.718 ' O ' HG22 ' A' ' 89' ' ' THR . 77.6 m -60.12 -4.13 0.73 Allowed 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 114.888 -2.482 . . . . 31.23 116.761 -178.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -104.16 -22.59 13.38 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 120.549 1.522 . . . . 24.27 107.394 176.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 53.2 m -79.75 -47.26 15.55 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 123.404 0.682 . . . . 25.149999999999999 110.699 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . 1.035 HG13 HD11 ' A' ' 17' ' ' LEU . 38.2 t -64.58 -46.43 92.56 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.064 0 N-CA-C 108.857 -0.794 . . . . 28.010000000000002 108.857 179.119 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -55.07 -37.9 67.35 Favored 'General case' 0 C--N 1.315 -0.934 0 O-C-N 125.834 1.958 . . . . 36.990000000000002 114.668 179.536 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 48.8 t -81.33 -42.1 21.06 Favored 'General case' 0 C--N 1.294 -1.818 0 C-N-CA 129.21 3.004 . . . . 28.010000000000002 111.043 178.543 -174.257 41.812 102.539 109.584 2.023 106.612 -173.27 -96.473 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ALA . . . . . 0.465 ' HA ' HD12 ' A' ' 98' ' ' ILE . . . -48.73 -47.62 41.27 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 126.414 1.885 . . . . 26.18 112.089 178.934 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . 0.48 ' HE3' HG12 ' A' ' 92' ' ' VAL . 82.5 mttt -64.33 -19.11 65.23 Favored 'General case' 0 C--O 1.253 1.258 0 CA-C-N 112.767 -2.015 . . . . 25.350000000000001 112.089 179.822 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . 0.491 ' HE2' ' HB3' ' A' ' 75' ' ' LEU . 15.3 tttp -91.57 -21.01 21.07 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 127.487 3.518 . . . . 30.870000000000001 107.979 178.377 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ILE . . . . . 0.465 HD12 ' HA ' ' A' ' 95' ' ' ALA . 59.2 mt -75.48 -65.15 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 102.325 -3.213 . . . . 27.219999999999999 102.325 179.666 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . 0.547 HG21 ' HH2' ' A' ' 28' ' ' TRP . 2.2 t -44.02 -45.2 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 O-C-N 127.593 3.058 . . . . 35.579999999999998 112.403 179.667 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.3 m -60.44 -2.14 0.45 Allowed 'General case' 0 C--O 1.257 1.49 0 CA-C-O 113.005 -3.379 . . . . 37.469999999999999 119.2 179.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -126.79 110.94 13.63 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 123.523 2.874 . . . . 45.969999999999999 109.447 -179.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLY . . . . . 0.563 ' O ' ' N ' ' A' ' 104' ' ' GLY . . . 59.94 -123.42 33.09 Favored Glycine 0 C--N 1.319 -0.408 0 O-C-N 125.886 1.991 . . . . 40.210000000000001 112.634 179.274 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -29.68 3.92 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 131.025 3.73 . . . . 38.960000000000001 118.67 -178.333 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 102' ' ' GLY . . . 44.31 -143.21 2.55 Favored Glycine 0 N--CA 1.482 1.76 0 CA-C-N 124.823 3.465 . . . . 28.100000000000001 109.096 -179.358 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' MET . . . . . 0.418 ' HG2' ' CE3' ' A' ' 108' ' ' TRP . 0.0 OUTLIER -72.8 -1.46 16.73 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 127.082 2.153 . . . . 27.079999999999998 115.375 179.963 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASN . . . . . 0.871 ' ND2' ' CZ3' ' A' ' 111' ' ' TRP . 1.0 OUTLIER -75.87 3.03 10.86 Favored 'General case' 0 C--N 1.311 -1.085 0 C-N-CA 130.413 3.485 . . . . 34.530000000000001 110.254 178.651 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.89 -6.42 32.4 Favored 'General case' 0 C--N 1.304 -1.379 1 C-N-CA 135.221 5.408 . . . . 36.75 113.8 -179.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' TRP . . . . . 0.762 ' CZ2' ' O ' ' A' ' 474' ' ' HOH . 5.2 m-90 -112.99 67.88 0.67 Allowed 'General case' 0 C--N 1.302 -1.495 1 C-N-CA 132.66 4.384 . . . . 39.68 104.645 175.248 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 1.5 p -23.51 -30.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 111.893 -3.908 . . . . 35.899999999999999 114.64 -178.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . 0.601 ' N ' ' O ' ' A' ' 108' ' ' TRP . . . -89.67 -5.28 57.23 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 123.021 2.646 . . . . 25.41 112.232 -178.96 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' TRP . . . . . 0.871 ' CZ3' ' ND2' ' A' ' 106' ' ' ASN . 9.8 t90 -91.09 -36.35 14.06 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 103.434 -2.802 . . . . 37.759999999999998 103.434 179.111 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ARG . . . . . 0.739 ' HE ' ' HB3' ' A' ' 106' ' ' ASN . 12.1 ttt-85 -96.29 82.52 3.44 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 103.151 -2.907 . . . . 51.909999999999997 103.151 176.658 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASN . . . . . 0.446 ' CB ' ' O ' ' A' ' 112' ' ' ARG . 12.7 m-20 155.65 -19.1 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 120.195 1.361 . . . . 36.869999999999997 109.249 -176.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ARG . . . . . 0.474 ' NE ' ' CE1' ' A' ' 34' ' ' PHE . 12.5 mtp85 -139.2 -18.23 1.01 Allowed 'General case' 0 C--O 1.25 1.111 0 CA-C-O 115.174 -2.346 . . . . 46.579999999999998 117.213 -179.375 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 1.7 m -134.98 -16.84 1.91 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 123.421 2.828 . . . . 31.18 110.845 -179.775 -30.175 -107.79 -93.476 103.556 2.038 106.002 -100.572 -173.972 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . 0.578 ' NZ ' ' O ' ' A' ' 482' ' ' HOH . 20.1 tttt -69.07 132.93 47.39 Favored 'General case' 0 C--N 1.312 -1.028 0 O-C-N 127.683 3.115 . . . . 33.0 102.694 178.003 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 88.07 -16.66 50.84 Favored Glycine 0 C--O 1.256 1.481 0 CA-C-O 115.635 -2.759 . . . . 45.270000000000003 112.153 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 47.8 p -97.06 -177.57 3.9 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 121.695 2.748 . . . . 53.359999999999999 108.927 179.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -90.29 68.86 7.01 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 127.905 2.482 . . . . 41.630000000000003 108.669 -179.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' VAL . . . . . 0.638 HG23 ' H ' ' A' ' 121' ' ' GLN . 1.7 m -49.43 -53.62 8.6 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 O-C-N 128.533 3.646 . . . . 40.189999999999998 115.421 -179.625 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLN . . . . . 0.638 ' H ' HG23 ' A' ' 120' ' ' VAL . 52.8 tp60 -61.48 35.41 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 113.882 -1.508 . . . . 41.780000000000001 113.666 -177.533 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' A' ' 120' ' ' VAL . . . -124.04 -26.08 4.09 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 123.375 1.56 . . . . 39.670000000000002 107.62 -178.621 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' TRP . . . . . 0.688 ' O ' ' HD2' ' A' ' 5' ' ' ARG . 54.5 m95 -58.65 -35.4 72.47 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 109.212 -3.631 . . . . 36.090000000000003 107.949 178.922 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 4.1 mt -83.11 -23.72 8.34 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.208 0 N-CA-C 120.425 3.491 . . . . 42.060000000000002 120.425 179.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 64.2 mmt-85 -76.42 123.28 25.76 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 131.02 3.728 . . . . 39.020000000000003 118.722 -177.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 107.58 -14.81 38.63 Favored Glycine 0 N--CA 1.469 0.85 0 O-C-N 124.299 0.999 . . . . 35.380000000000003 112.484 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 74.9 m -80.78 18.27 1.01 Allowed 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 126.823 2.049 . . . . 35.380000000000003 113.213 -179.328 -58.785 -57.443 -51.499 105.211 2.034 98.779 -49.971 -62.802 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ARG . . . . . 0.4 ' HD2' ' HA ' ' A' ' 128' ' ' ARG . 2.1 mmt-85 68.98 79.66 0.2 Allowed 'General case' 0 C--N 1.31 -1.143 1 CA-C-O 129.706 4.574 . . . . 49.060000000000002 104.152 -178.521 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LEU . . . . . 0.698 HD21 ' O ' ' A' ' 516' ' ' HOH . 3.5 tp . . . . . 0 C--N 1.314 -0.977 3 C-N-CA 132.589 4.356 . . . . 42.670000000000002 103.019 -177.404 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 451' ' ' HOH . . . . . 0.405 ' O ' ' ND2' ' A' ' 106' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 454' ' ' HOH . . . . . 0.555 ' O ' ' HD2' ' A' ' 15' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 458' ' ' HOH . . . . . 0.749 ' O ' HD21 ' A' ' 8' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 461' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 464' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 465' ' ' HOH . . . . . 0.654 ' O ' HD23 ' A' ' 129' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 470' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 471' ' ' HOH . . . . . 0.456 ' O ' ' NH2' ' A' ' 112' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 473' ' ' HOH . . . . . 0.634 ' O ' ' ND2' ' A' ' 65' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 474' ' ' HOH . . . . . 0.762 ' O ' ' CZ2' ' A' ' 108' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 475' ' ' HOH . . . . . 1.072 ' O ' HD11 ' A' ' 56' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 480' ' ' HOH . . . . . 0.614 ' O ' ' CB ' ' A' ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 482' ' ' HOH . . . . . 0.638 ' O ' ' NH2' ' A' ' 112' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 487' ' ' HOH . . . . . 0.597 ' O ' ' NH1' ' A' ' 61' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 489' ' ' HOH . . . . . 0.432 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 493' ' ' HOH . . . . . 0.588 ' O ' ' NZ ' ' A' ' 13' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 495' ' ' HOH . . . . . 0.58 ' O ' ' NH1' ' A' ' 14' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 497' ' ' HOH . . . . . 0.433 ' O ' ' HD2' ' A' ' 73' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 499' ' ' HOH . . . . . 0.515 ' O ' ' HD3' ' A' ' 33' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 500' ' ' HOH . . . . . 1.042 ' O ' ' HB2' ' A' ' 44' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 505' ' ' HOH . . . . . 0.423 ' O ' ' HB ' ' A' ' 88' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 508' ' ' HOH . . . . . 0.716 ' O ' ' HB2' ' A' ' 85' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 516' ' ' HOH . . . . . 0.698 ' O ' HD21 ' A' ' 129' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 517' ' ' HOH . . . . . 0.436 ' O ' HG22 ' A' ' 40' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 519' ' ' HOH . . . . . 0.912 ' O ' HD21 ' A' ' 56' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 522' ' ' HOH . . . . . 0.836 ' O ' ' CE1' ' A' ' 3' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 523' ' ' HOH . . . . . 1.016 ' O ' HG21 ' A' ' 69' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 527' ' ' HOH . . . . . 0.929 ' O ' ' HB3' ' A' ' 86' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.417 ' HG3' ' O ' ' A' ' 2' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.856 0 CA-C-O 121.288 0.566 . . . . 38.799999999999997 111.143 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.417 ' O ' ' HG3' ' A' ' 1' ' ' LYS . 64.7 t -116.73 138.58 46.86 Favored 'Isoleucine or valine' 0 C--O 1.25 1.128 1 N-CA-C 99.435 -4.283 . . . . 41.789999999999999 99.435 176.746 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.836 ' CE1' ' O ' ' A' ' 522' ' ' HOH . 9.8 m-85 -98.03 175.44 6.12 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 127.433 2.958 . . . . 40.039999999999999 112.538 -178.568 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.492 ' O ' ' N ' ' A' ' 7' ' ' GLU . . . -127.08 118.21 2.93 Favored Glycine 0 N--CA 1.476 1.347 0 N-CA-C 105.772 -2.931 . . . . 41.420000000000002 105.772 178.806 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.688 ' HD2' ' O ' ' A' ' 123' ' ' TRP . 0.1 OUTLIER -14.42 -61.3 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 125.15 1.38 . . . . 36.829999999999998 111.875 -176.46 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.428 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 72.1 m -62.55 -53.47 54.27 Favored 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 125.507 1.523 . . . . 43.189999999999998 114.222 -179.891 -62.802 -49.971 -51.499 98.779 2.034 105.211 -57.443 -58.785 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.492 ' N ' ' O ' ' A' ' 4' ' ' GLY . 25.6 tt0 -50.18 -32.91 17.52 Favored 'General case' 0 C--O 1.244 0.799 0 O-C-N 126.662 2.476 . . . . 52.780000000000001 116.193 -179.972 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.749 HD21 ' O ' ' A' ' 458' ' ' HOH . 19.8 tp -89.25 -23.34 22.36 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 129.099 2.96 . . . . 41.0 110.694 -179.304 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 6' ' ' CYS . . . -59.86 -64.89 0.79 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.463 -1.244 . . . . 32.600000000000001 109.474 179.405 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.614 ' CB ' ' O ' ' A' ' 480' ' ' HOH . . . -62.23 -21.65 65.32 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 111.191 -2.731 . . . . 30.710000000000001 113.55 -176.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.11 -51.06 13.0 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 106.345 -1.724 . . . . 25.640000000000001 106.345 178.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' MET . . . . . 0.803 ' HE1' ' O ' ' A' ' 519' ' ' HOH . 9.3 mtt -56.31 -43.62 79.11 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 121.898 0.856 . . . . 29.760000000000002 108.913 177.168 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.588 ' NZ ' ' O ' ' A' ' 493' ' ' HOH . 24.8 tttt -58.7 -34.32 71.17 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 128.497 2.719 . . . . 32.799999999999997 114.943 179.247 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.58 ' NH1' ' O ' ' A' ' 495' ' ' HOH . 13.4 mtt85 -79.69 -19.38 49.11 Favored 'General case' 0 C--O 1.246 0.909 0 O-C-N 125.673 1.858 . . . . 30.609999999999999 107.74 176.795 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.555 ' HD2' ' O ' ' A' ' 454' ' ' HOH . 74.9 m80 -99.51 19.14 16.24 Favored 'General case' 0 C--O 1.252 1.201 0 CA-C-O 124.278 1.99 . . . . 31.550000000000001 116.086 -179.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.18 31.4 69.12 Favored Glycine 0 C--O 1.252 1.275 0 N-CA-C 117.969 1.947 . . . . 36.109999999999999 117.969 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.035 HD11 HG13 ' A' ' 92' ' ' VAL 0.287 20.3 mt -87.35 -17.4 32.48 Favored 'General case' 0 C--O 1.269 2.125 0 CA-C-O 117.83 -1.081 . . . . 38.689999999999998 111.556 179.264 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.854 ' O ' ' HB2' ' A' ' 19' ' ' ASN . 22.4 t0 -67.2 97.87 0.56 Allowed 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 121.002 1.728 . . . . 37.210000000000001 112.724 179.395 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.854 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 2.5 m120 96.63 -27.23 0.02 OUTLIER 'General case' 0 C--O 1.261 1.679 0 CA-C-O 114.925 -2.464 . . . . 31.629999999999999 117.085 176.323 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -30.3 122.01 0.19 Allowed 'General case' 0 C--N 1.305 -1.356 0 C-N-CA 126.342 1.857 . . . . 25.07 111.134 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.8 mmt180 53.13 43.18 31.94 Favored 'General case' 0 C--N 1.295 -1.801 0 C-N-CA 128.186 2.595 . . . . 33.649999999999999 109.477 -179.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 49.95 50.95 31.24 Favored Glycine 0 N--CA 1.444 -0.826 0 C-N-CA 124.869 1.224 . . . . 28.190000000000001 114.741 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.472 ' HD1' ' ND2' ' A' ' 27' ' ' ASN . 34.8 m-85 -127.23 112.39 15.05 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 112.795 -3.479 . . . . 31.239999999999998 104.119 177.451 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . 0.584 ' OG ' ' NE2' ' A' ' 121' ' ' GLN . 99.1 p -83.93 157.87 21.77 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 113.119 -3.432 . . . . 24.66 109.492 -175.073 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' A' ' 28' ' ' TRP . 10.4 tp -26.68 -60.64 0.09 Allowed 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 111.924 -2.398 . . . . 22.989999999999998 108.355 -178.469 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -33.69 -51.8 0.61 Allowed Glycine 0 C--N 1.297 -1.615 0 C-N-CA 130.369 3.842 . . . . 23.510000000000002 110.812 178.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.472 ' ND2' ' HD1' ' A' ' 23' ' ' TYR . 73.9 m-20 -52.89 -51.4 61.3 Favored 'General case' 0 C--N 1.311 -1.067 0 C-N-CA 124.174 0.99 . . . . 31.75 108.882 179.398 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.594 ' HZ3' ' O ' ' A' ' 474' ' ' HOH . 90.9 m95 -54.56 -62.76 1.45 Allowed 'General case' 0 C--N 1.312 -1.048 0 O-C-N 126.908 2.63 . . . . 19.75 112.502 -178.593 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.446 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 3.8 t -48.31 -40.87 10.42 Favored 'Isoleucine or valine' 0 C--O 1.244 0.792 0 CA-C-N 122.706 2.503 . . . . 23.920000000000002 114.187 178.034 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.443 ' HB2' ' CD1' ' A' ' 123' ' ' TRP . 49.2 t -66.96 -43.18 83.78 Favored 'General case' 0 C--O 1.246 0.921 0 CA-C-N 114.813 -1.085 . . . . 33.579999999999998 111.484 179.683 -173.972 -100.572 -93.476 106.002 2.038 103.556 -107.79 -30.175 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.37 -26.73 68.89 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 118.477 -2.639 . . . . 23.48 108.693 -178.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 29' ' ' VAL . . . -60.0 -70.04 0.19 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 114.446 -2.692 . . . . 30.190000000000001 109.126 -179.279 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.515 ' HD3' ' O ' ' A' ' 499' ' ' HOH . 0.0 OUTLIER -46.73 -43.75 18.26 Favored 'General case' 0 C--N 1.297 -1.689 0 CA-C-O 115.018 -2.42 . . . . 43.280000000000001 115.896 179.507 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.474 ' CE1' ' NE ' ' A' ' 114' ' ' ARG . 73.7 m-85 -87.35 15.33 6.57 Favored 'General case' 0 C--O 1.252 1.211 0 CA-C-N 122.668 2.486 . . . . 32.140000000000001 115.335 -179.01 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -111.33 -45.36 3.41 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 102.984 -2.969 . . . . 33.68 102.984 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 12.9 p -157.2 36.31 0.29 Allowed 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 116.005 1.854 . . . . 27.600000000000001 116.005 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.541 ' O ' ' CB ' ' A' ' 38' ' ' PHE . 16.4 t-20 49.98 6.27 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 120.341 1.428 . . . . 38.590000000000003 113.659 -179.909 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.541 ' CB ' ' O ' ' A' ' 37' ' ' ASN . 17.0 m-85 90.54 41.08 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 120.994 1.725 . . . . 39.950000000000003 108.787 178.602 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -111.11 109.22 19.2 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 128.141 2.576 . . . . 36.969999999999999 111.331 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . 0.436 HG22 ' O ' ' A' ' 517' ' ' HOH . 0.2 OUTLIER -66.67 -43.88 83.32 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 120.213 3.412 . . . . 35.890000000000001 120.213 -177.183 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -72.45 -12.03 60.93 Favored 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 125.524 1.529 . . . . 46.020000000000003 112.018 -178.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.61 117.97 5.54 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 127.326 2.251 . . . . 33.009999999999998 115.929 -177.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' THR . . . . . 0.845 HG22 HD21 ' A' ' 84' ' ' LEU . 1.1 p -122.09 160.25 25.43 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 112.264 -2.244 . . . . 38.240000000000002 105.679 179.662 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . 1.042 ' HB2' ' O ' ' A' ' 500' ' ' HOH . 0.4 OUTLIER -152.04 127.96 10.31 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 116.724 -1.991 . . . . 41.960000000000001 107.819 179.716 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.432 ' HB2' ' O ' ' A' ' 489' ' ' HOH . 0.1 OUTLIER -96.0 116.88 29.61 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 124.269 1.985 . . . . 43.539999999999999 113.409 -178.749 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.6 m-20 -78.2 -159.09 0.15 Allowed 'General case' 0 C--O 1.248 1.022 0 CA-C-N 110.145 -3.207 . . . . 49.759999999999998 106.007 178.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 21.4 m -85.06 -46.45 11.15 Favored 'General case' 0 C--O 1.26 1.639 0 N-CA-C 121.031 3.715 . . . . 44.07 121.031 -177.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.408 ' O ' ' OD1' ' A' ' 48' ' ' ASP . 19.5 t0 -98.31 73.37 2.15 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 121.085 1.766 . . . . 46.329999999999998 115.01 -177.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 37.43 51.36 1.79 Allowed Glycine 0 CA--C 1.537 1.434 0 N-CA-C 107.81 -2.116 . . . . 47.560000000000002 107.81 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.6 t -116.06 144.45 44.1 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 112.143 -2.029 . . . . 38.590000000000003 106.842 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.9 m -150.12 144.05 25.46 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 123.159 1.457 . . . . 28.010000000000002 109.979 -178.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.955 ' OD1' ' HB2' ' A' ' 59' ' ' ASN . 56.3 m-20 -115.26 126.0 53.99 Favored 'General case' 0 C--N 1.313 -1.006 1 CA-C-O 111.671 -4.014 . . . . 34.710000000000001 105.008 -178.424 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.533 ' CD2' HD11 ' A' ' 84' ' ' LEU . 44.6 m-85 -118.12 153.5 33.69 Favored 'General case' 0 C--N 1.312 -1.024 1 O-C-N 129.729 4.393 . . . . 36.390000000000001 114.527 -179.209 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.571 ' O ' ' N ' ' A' ' 56' ' ' LEU . . . 44.96 -173.92 0.01 OUTLIER Glycine 0 C--N 1.307 -1.048 1 CA-C-O 128.423 4.346 . . . . 28.039999999999999 121.605 178.589 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 4.2 tp -18.92 -31.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.427 -1.601 1 C-N-CA 135.425 5.49 . . . . 31.16 114.42 -177.707 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . 1.072 HD11 ' O ' ' A' ' 475' ' ' HOH . 39.2 mt -136.53 4.33 2.85 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 125.527 1.767 . . . . 27.07 112.529 -177.621 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.581 ' HB3' ' HB3' ' A' ' 52' ' ' ASP . 22.9 mm-40 52.72 56.3 7.82 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 119.099 3.0 . . . . 22.969999999999999 119.099 179.275 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.444 HG23 ' HB2' ' A' ' 63' ' ' TRP . 1.2 mp -71.61 116.22 13.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.5 0 N-CA-C 103.979 -2.6 . . . . 25.0 103.979 175.012 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.955 ' HB2' ' OD1' ' A' ' 52' ' ' ASP . 0.1 OUTLIER -83.88 134.06 34.7 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 114.49 1.293 . . . . 33.130000000000003 114.49 -178.344 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.0 p -56.86 -29.69 63.13 Favored 'General case' 0 C--N 1.299 -1.596 1 C-N-CA 132.404 4.282 . . . . 25.309999999999999 119.639 -177.632 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.717 ' HD2' ' O ' ' A' ' 523' ' ' HOH . 9.1 ttt180 -70.73 -18.86 62.79 Favored 'General case' 0 C--O 1.261 1.709 0 CA-C-N 121.028 1.74 . . . . 32.920000000000002 110.35 179.708 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.693 ' O ' HD23 ' A' ' 75' ' ' LEU . 40.6 m95 -118.64 -40.81 2.85 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 121.343 3.831 . . . . 39.32 121.343 -177.984 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TRP . . . . . 0.513 ' O ' ' HB2' ' A' ' 76' ' ' CYS . 39.7 m95 -101.74 -39.65 7.33 Favored 'General case' 0 C--N 1.284 -2.247 0 CA-C-O 113.998 -2.906 . . . . 23.190000000000001 116.607 -174.182 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 24.4 p -130.28 175.96 8.51 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 121.07 1.759 . . . . 26.32 111.392 -179.666 67.596 83.184 97.099 111.756 2.002 112.348 -47.575 -62.53 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.634 ' ND2' ' O ' ' A' ' 473' ' ' HOH . 29.5 t-20 -121.45 137.41 54.73 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 116.937 -1.506 . . . . 35.100000000000001 111.671 -179.293 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 48.7 p-10 -132.87 27.65 4.25 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 107.242 -1.392 . . . . 26.739999999999998 107.242 -179.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.656 ' O ' ' CB ' ' A' ' 68' ' ' ARG . . . 42.59 99.46 0.01 OUTLIER Glycine 0 C--N 1.313 -0.745 0 CA-C-N 109.384 -3.553 . . . . 28.34 109.246 -179.224 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.656 ' CB ' ' O ' ' A' ' 67' ' ' GLY . 0.0 OUTLIER 166.95 -33.14 0.0 OUTLIER 'General case' 0 C--O 1.252 1.194 0 C-N-CA 117.166 -1.814 . . . . 45.240000000000002 114.911 178.526 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . 1.016 HG21 ' O ' ' A' ' 523' ' ' HOH . 0.0 OUTLIER -90.74 118.23 68.51 Favored Pre-proline 0 CA--C 1.503 -0.842 1 N-CA-C 127.112 5.967 . . . . 46.950000000000003 127.112 -174.675 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_exo -36.17 -21.14 0.04 OUTLIER 'Trans proline' 0 C--O 1.247 0.927 1 C-N-CA 125.951 4.434 . . . . 43.32 118.461 177.193 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 69' ' ' THR . . . -96.26 -65.97 0.95 Allowed Glycine 0 CA--C 1.522 0.48 0 C-N-CA 125.234 1.397 . . . . 43.899999999999999 111.851 -179.415 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . 0.482 ' HB3' ' O ' ' A' ' 69' ' ' THR . 0.2 OUTLIER 14.78 92.11 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.788 2 C-N-CA 138.782 6.833 . . . . 44.969999999999999 121.828 179.529 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.627 ' HE ' HD21 ' A' ' 75' ' ' LEU . 38.2 mtp85 -92.33 -25.99 18.29 Favored 'General case' 0 C--O 1.261 1.695 1 N-CA-C 122.527 4.269 . . . . 48.0 122.527 -177.047 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.416 ' OD1' ' O ' ' A' ' 78' ' ' ILE . 1.7 t-20 53.24 61.52 3.11 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 118.124 -1.431 . . . . 38.259999999999998 109.764 -179.43 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.693 HD23 ' O ' ' A' ' 62' ' ' TRP . 2.7 mm? -72.17 -34.84 68.76 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 118.685 -1.206 . . . . 26.789999999999999 107.876 179.105 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 63' ' ' TRP . 1.2 m -77.92 -8.25 57.85 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 127.203 2.815 . . . . 24.760000000000002 108.152 -179.168 -96.473 -173.27 102.539 106.612 2.023 109.584 41.812 -174.257 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.558 ' CG ' ' O ' ' A' ' 77' ' ' ASN . 43.3 t30 47.72 55.68 8.14 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 128.182 2.593 . . . . 34.740000000000002 114.672 -178.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.699 ' HB ' ' CD ' ' A' ' 79' ' ' PRO . 12.1 pt -145.66 169.33 9.93 Favored Pre-proline 0 C--N 1.312 -1.042 0 O-C-N 126.935 2.647 . . . . 24.879999999999999 111.519 178.473 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.699 ' CD ' ' HB ' ' A' ' 78' ' ' ILE . 2.6 Cg_exo -88.24 123.07 1.58 Allowed 'Trans proline' 0 C--N 1.308 -1.556 1 C-N-CA 127.393 5.396 . . . . 25.390000000000001 111.895 178.512 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.809 ' O ' ' HB2' ' A' ' 83' ' ' LEU . 70.8 m -45.28 -37.65 4.92 Favored 'General case' 0 C--O 1.26 1.639 0 CA-C-O 114.146 -2.835 . . . . 24.719999999999999 111.872 -177.501 -62.53 -47.575 97.099 112.348 2.002 111.756 83.184 67.596 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.1 p -62.54 -14.95 47.83 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 123.807 3.003 . . . . 24.57 110.2 -179.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.47 -30.44 70.6 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 115.112 -2.635 . . . . 23.93 105.997 178.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.809 ' HB2' ' O ' ' A' ' 80' ' ' CYS . 0.0 OUTLIER -75.24 -14.15 60.5 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 129.407 3.083 . . . . 29.149999999999999 118.328 -175.924 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.845 HD21 HG22 ' A' ' 43' ' ' THR . 9.3 mt -106.8 16.27 24.59 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 116.753 -1.594 . . . . 34.979999999999997 114.467 -179.637 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . 0.716 ' HB2' ' O ' ' A' ' 508' ' ' HOH . 2.4 m -110.88 137.45 48.51 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 105.947 -1.872 . . . . 43.350000000000001 105.947 177.544 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' SER . . . . . 0.929 ' HB3' ' O ' ' A' ' 527' ' ' HOH . 48.7 m -45.02 -11.37 0.01 OUTLIER 'General case' 0 C--O 1.248 1.009 0 C-N-CA 126.615 1.966 . . . . 40.759999999999998 111.319 178.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.457 ' N ' ' O ' ' A' ' 85' ' ' SER . 1.5 p30 -85.04 102.45 13.22 Favored 'General case' 0 N--CA 1.49 1.528 1 N-CA-C 99.424 -4.287 . . . . 45.439999999999998 99.424 177.086 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.619 HG13 HG23 ' A' ' 92' ' ' VAL . 0.1 OUTLIER -71.51 -13.12 16.63 Favored 'Isoleucine or valine' 0 C--O 1.241 0.638 0 C-N-CA 128.185 2.594 . . . . 38.159999999999997 115.852 -176.557 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' THR . . . . . 0.718 ' O ' HG22 ' A' ' 89' ' ' THR . 77.6 m -60.12 -4.13 0.73 Allowed 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 114.888 -2.482 . . . . 31.23 116.761 -178.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -104.16 -22.59 13.38 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 120.549 1.522 . . . . 24.27 107.394 176.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 53.2 m -79.75 -47.26 15.55 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 123.404 0.682 . . . . 25.149999999999999 110.699 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . 1.035 HG13 HD11 ' A' ' 17' ' ' LEU . 38.2 t -64.58 -46.43 92.56 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.064 0 N-CA-C 108.857 -0.794 . . . . 28.010000000000002 108.857 179.119 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -55.07 -37.9 67.35 Favored 'General case' 0 C--N 1.315 -0.934 0 O-C-N 125.834 1.958 . . . . 36.990000000000002 114.668 179.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 48.8 t -81.33 -42.1 21.06 Favored 'General case' 0 C--N 1.294 -1.818 0 C-N-CA 129.21 3.004 . . . . 28.010000000000002 111.043 178.543 -174.257 41.812 102.539 109.584 2.023 106.612 -173.27 -96.473 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.465 ' HA ' HD12 ' A' ' 98' ' ' ILE . . . -48.73 -47.62 41.27 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 126.414 1.885 . . . . 26.18 112.089 178.934 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.48 ' HE3' HG12 ' A' ' 92' ' ' VAL . 82.5 mttt -64.33 -19.11 65.23 Favored 'General case' 0 C--O 1.253 1.258 0 CA-C-N 112.767 -2.015 . . . . 25.350000000000001 112.089 179.822 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.491 ' HE2' ' HB3' ' A' ' 75' ' ' LEU . 15.3 tttp -91.57 -21.01 21.07 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 127.487 3.518 . . . . 30.870000000000001 107.979 178.377 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.465 HD12 ' HA ' ' A' ' 95' ' ' ALA . 59.2 mt -75.48 -65.15 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 102.325 -3.213 . . . . 27.219999999999999 102.325 179.666 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.547 HG21 ' HH2' ' A' ' 28' ' ' TRP . 2.2 t -44.02 -45.2 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 O-C-N 127.593 3.058 . . . . 35.579999999999998 112.403 179.667 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.3 m -60.44 -2.14 0.45 Allowed 'General case' 0 C--O 1.257 1.49 0 CA-C-O 113.005 -3.379 . . . . 37.469999999999999 119.2 179.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -126.79 110.94 13.63 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 123.523 2.874 . . . . 45.969999999999999 109.447 -179.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.563 ' O ' ' N ' ' A' ' 104' ' ' GLY . . . 59.94 -123.42 33.09 Favored Glycine 0 C--N 1.319 -0.408 0 O-C-N 125.886 1.991 . . . . 40.210000000000001 112.634 179.274 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.678 HD22 ' HB2' ' A' ' 107' ' ' ALA . 0.1 OUTLIER -29.68 3.92 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 131.025 3.73 . . . . 38.960000000000001 118.67 -178.333 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 102' ' ' GLY . . . 44.31 -143.21 2.55 Favored Glycine 0 N--CA 1.482 1.76 0 CA-C-N 124.823 3.465 . . . . 28.100000000000001 109.096 -179.358 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' MET . . . . . 0.418 ' HG2' ' CE3' ' A' ' 108' ' ' TRP . 0.0 OUTLIER -72.8 -1.46 16.73 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 127.082 2.153 . . . . 27.079999999999998 115.375 179.963 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.871 ' ND2' ' CZ3' ' A' ' 111' ' ' TRP . 1.0 OUTLIER -75.87 3.03 10.86 Favored 'General case' 0 C--N 1.311 -1.085 0 C-N-CA 130.413 3.485 . . . . 34.530000000000001 110.254 178.651 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.678 ' HB2' HD22 ' A' ' 103' ' ' ASN . . . -97.89 -6.42 32.4 Favored 'General case' 0 C--N 1.304 -1.379 1 C-N-CA 135.221 5.408 . . . . 36.75 113.8 -179.924 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' TRP . . . . . 0.762 ' CZ2' ' O ' ' A' ' 474' ' ' HOH . 5.2 m-90 -112.99 67.88 0.67 Allowed 'General case' 0 C--N 1.302 -1.495 1 C-N-CA 132.66 4.384 . . . . 39.68 104.645 175.248 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 1.5 p -23.51 -30.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 111.893 -3.908 . . . . 35.899999999999999 114.64 -178.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.601 ' N ' ' O ' ' A' ' 108' ' ' TRP . . . -89.67 -5.28 57.23 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 123.021 2.646 . . . . 25.41 112.232 -178.96 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.871 ' CZ3' ' ND2' ' A' ' 106' ' ' ASN . 9.8 t90 -91.09 -36.35 14.06 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 103.434 -2.802 . . . . 37.759999999999998 103.434 179.111 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.739 ' HE ' ' HB3' ' A' ' 106' ' ' ASN . 12.1 ttt-85 -96.29 82.52 3.44 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 103.151 -2.907 . . . . 51.909999999999997 103.151 176.658 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.446 ' CB ' ' O ' ' A' ' 112' ' ' ARG . 1.3 m120 155.65 -19.1 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 120.195 1.361 . . . . 36.869999999999997 109.249 -176.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.474 ' NE ' ' CE1' ' A' ' 34' ' ' PHE . 12.5 mtp85 -139.2 -18.23 1.01 Allowed 'General case' 0 C--O 1.25 1.111 0 CA-C-O 115.174 -2.346 . . . . 46.579999999999998 117.213 -179.375 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 1.7 m -134.98 -16.84 1.91 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 123.421 2.828 . . . . 31.18 110.845 -179.775 -30.175 -107.79 -93.476 103.556 2.038 106.002 -100.572 -173.972 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.578 ' NZ ' ' O ' ' A' ' 482' ' ' HOH . 20.1 tttt -69.07 132.93 47.39 Favored 'General case' 0 C--N 1.312 -1.028 0 O-C-N 127.683 3.115 . . . . 33.0 102.694 178.003 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 88.07 -16.66 50.84 Favored Glycine 0 C--O 1.256 1.481 0 CA-C-O 115.635 -2.759 . . . . 45.270000000000003 112.153 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 47.8 p -97.06 -177.57 3.9 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 121.695 2.748 . . . . 53.359999999999999 108.927 179.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -90.29 68.86 7.01 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 127.905 2.482 . . . . 41.630000000000003 108.669 -179.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.638 HG23 ' H ' ' A' ' 121' ' ' GLN . 1.7 m -49.43 -53.62 8.6 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 O-C-N 128.533 3.646 . . . . 40.189999999999998 115.421 -179.625 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.638 ' H ' HG23 ' A' ' 120' ' ' VAL . 8.7 tp-100 -61.48 35.41 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 113.882 -1.508 . . . . 41.780000000000001 113.666 -177.533 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' A' ' 120' ' ' VAL . . . -124.04 -26.08 4.09 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 123.375 1.56 . . . . 39.670000000000002 107.62 -178.621 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' TRP . . . . . 0.688 ' O ' ' HD2' ' A' ' 5' ' ' ARG . 54.5 m95 -58.65 -35.4 72.47 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 109.212 -3.631 . . . . 36.090000000000003 107.949 178.922 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 4.1 mt -83.11 -23.72 8.34 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.208 0 N-CA-C 120.425 3.491 . . . . 42.060000000000002 120.425 179.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 64.2 mmt-85 -76.42 123.28 25.76 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 131.02 3.728 . . . . 39.020000000000003 118.722 -177.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 107.58 -14.81 38.63 Favored Glycine 0 N--CA 1.469 0.85 0 O-C-N 124.299 0.999 . . . . 35.380000000000003 112.484 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 74.9 m -80.78 18.27 1.01 Allowed 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 126.823 2.049 . . . . 35.380000000000003 113.213 -179.328 -58.785 -57.443 -51.499 105.211 2.034 98.779 -49.971 -62.802 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.4 ' HD2' ' HA ' ' A' ' 128' ' ' ARG . 2.1 mmt-85 68.98 79.66 0.2 Allowed 'General case' 0 C--N 1.31 -1.143 1 CA-C-O 129.706 4.574 . . . . 49.060000000000002 104.152 -178.521 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.698 HD21 ' O ' ' A' ' 516' ' ' HOH . 3.5 tp . . . . . 0 C--N 1.314 -0.977 3 C-N-CA 132.589 4.356 . . . . 42.670000000000002 103.019 -177.404 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 451' ' ' HOH . . . . . 0.405 ' O ' ' ND2' ' A' ' 106' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 454' ' ' HOH . . . . . 0.555 ' O ' ' HD2' ' A' ' 15' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 458' ' ' HOH . . . . . 0.749 ' O ' HD21 ' A' ' 8' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 461' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 464' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 465' ' ' HOH . . . . . 0.654 ' O ' HD23 ' A' ' 129' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 470' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 471' ' ' HOH . . . . . 0.456 ' O ' ' NH2' ' A' ' 112' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 473' ' ' HOH . . . . . 0.634 ' O ' ' ND2' ' A' ' 65' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 474' ' ' HOH . . . . . 0.762 ' O ' ' CZ2' ' A' ' 108' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 475' ' ' HOH . . . . . 1.072 ' O ' HD11 ' A' ' 56' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 480' ' ' HOH . . . . . 0.614 ' O ' ' CB ' ' A' ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 482' ' ' HOH . . . . . 0.638 ' O ' ' NH2' ' A' ' 112' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 487' ' ' HOH . . . . . 0.597 ' O ' ' NH1' ' A' ' 61' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 489' ' ' HOH . . . . . 0.432 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 493' ' ' HOH . . . . . 0.588 ' O ' ' NZ ' ' A' ' 13' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 495' ' ' HOH . . . . . 0.58 ' O ' ' NH1' ' A' ' 14' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 497' ' ' HOH . . . . . 0.433 ' O ' ' HD2' ' A' ' 73' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 499' ' ' HOH . . . . . 0.515 ' O ' ' HD3' ' A' ' 33' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 500' ' ' HOH . . . . . 1.042 ' O ' ' HB2' ' A' ' 44' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 505' ' ' HOH . . . . . 0.423 ' O ' ' HB ' ' A' ' 88' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 508' ' ' HOH . . . . . 0.716 ' O ' ' HB2' ' A' ' 85' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 516' ' ' HOH . . . . . 0.698 ' O ' HD21 ' A' ' 129' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' HOH . . . . . 0.436 ' O ' HG22 ' A' ' 40' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 519' ' ' HOH . . . . . 0.912 ' O ' HD21 ' A' ' 56' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' HOH . . . . . 0.836 ' O ' ' CE1' ' A' ' 3' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 523' ' ' HOH . . . . . 1.016 ' O ' HG21 ' A' ' 69' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 527' ' ' HOH . . . . . 0.929 ' O ' ' HB3' ' A' ' 86' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_