data_1fzp_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 1fzp _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 ' W' W ' 3' ' ' ' DA' . . . . . 1.267 ' N1 ' ' N6 ' ' K' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.502 -2.563 3 OP1-P-OP2 102.893 -11.138 . . . . 61.26 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' W' W ' 4' ' ' ' DT' . . . . . 0.829 ' C4 ' ' N3 ' ' W' ' 3' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.541 3.796 0 C4'-C3'-O3' 117.692 3.36 . . . . 39.44 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 5' ' ' ' DA' . . . . . 1.107 ' N6 ' ' N6 ' ' K' ' 5' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.541 3.692 1 O4'-C1'-C2' 110.501 4.001 . . . . 42.95 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' W' W ' 6' ' ' ' DT' . . . . . 0.402 " C5'" " C2'" ' W' ' 5' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.545 4.234 2 C5'-C4'-C3' 124.111 6.274 . . . . 40.0 . . . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' W' W ' 7' ' ' ' DA' . . . . . 0.76 " C2'" ' OP2' ' W' ' 8' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.541 3.763 4 P-O3'-C3' 129.524 8.187 . . . . 35.51 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' W' W ' 8' ' ' ' DT' . . . . . 0.76 ' OP2' " C2'" ' W' ' 7' ' ' ' DA' . . . . . . . . 2 C5'--C4' 1.595 10.472 3 O4'-C4'-C3' 94.93 -10.67 . . . . 32.37 . . . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' W' W ' 9' ' ' ' DA' . . . . . 1.107 ' OP2' ' C8 ' ' W' ' 9' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.487 3.7 4 P-O5'-C5' 113.65 -4.532 . . . . 59.77 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' K' K ' 3' ' ' ' DA' . . . . . 0.549 ' C8 ' ' C7 ' ' K' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.473 2.464 3 OP1-P-OP2 143.715 16.077 . . . . 36.69 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' K' K ' 4' ' ' ' DT' . . . . . 0.549 ' C7 ' ' C8 ' ' K' ' 3' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.396 0 C4'-C3'-O3' 117.602 3.319 . . . . 39.44 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 5' ' ' ' DA' . . . . . 1.107 ' N6 ' ' N6 ' ' W' ' 5' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.549 4.691 1 P-O3'-C3' 125.101 4.501 . . . . 42.95 . . . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' K' K ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 3 C5'--C4' 1.563 6.479 1 O4'-C4'-C3' 99.823 -5.777 . . . . 40.0 . . . . . . . . . . 2 1 . 1 . 001 ecloud orig full ' K' K ' 7' ' ' ' DA' . . . . . 1.267 ' N6 ' ' N1 ' ' W' ' 3' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.542 3.922 4 O4'-C4'-C3' 99.265 -6.335 . . . . 35.51 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' K' K ' 8' ' ' ' DT' . . . . . 0.778 ' OP2' " C2'" ' K' ' 7' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.621 1 O4'-C4'-C3' 98.805 -6.795 . . . . 32.37 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' K' K ' 9' ' ' ' DA' . . . . . 0.644 ' OP2' " C2'" ' K' ' 8' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.569 7.285 1 O4'-C1'-C2' 110.857 4.325 . . . . 39.42 . . . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.815 0 CA-C-O 121.925 0.869 . . . . 29.94 112.652 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' ILE . . . . . 0.803 ' CG2' ' N ' ' D' ' 4' ' ' THR . 5.3 mp -45.65 -178.06 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 117.399 2.37 . . . . 60.47 117.399 -177.537 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' THR . . . . . 0.803 ' N ' ' CG2' ' D' ' 3' ' ' ILE . 0.2 OUTLIER -130.16 -114.92 0.24 Allowed 'General case' 0 N--CA 1.473 0.714 1 O-C-N 129.378 4.174 . . . . 78.24 108.949 -179.089 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' LYS . . . . . 0.84 ' NZ ' ' CG ' ' D' ' 102' ' ' LYS . 13.9 ttmt -93.22 73.97 4.61 Favored 'General case' 0 C--N 1.32 -0.704 0 O-C-N 125.688 1.868 . . . . 81.0 106.013 177.128 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' ILE . . . . . 0.437 ' CD1' ' CG1' ' D' ' 3' ' ' ILE . 3.3 pt -101.26 -1.23 9.92 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 119.127 -1.029 . . . . 54.01 113.417 -177.281 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -64.38 139.22 58.74 Favored 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 106.116 -1.809 . . . . 100.0 106.116 177.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' ASP . . . . . 1.182 ' CB ' ' CD2' ' D' ' 13' ' ' LEU . 4.4 m-20 -44.68 163.78 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 114.794 1.405 . . . . 46.17 114.794 -173.27 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' CYS . . . . . 0.459 ' N ' ' OE2' ' B' ' 77' ' ' GLU . 0.1 OUTLIER -20.07 136.33 0.01 OUTLIER 'General case' 0 CA--C 1.497 -1.074 0 C-N-CA 126.997 2.119 . . . . 49.86 110.444 -178.102 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' PHE . . . . . 0.657 ' CD1' ' N ' ' D' ' 10' ' ' PHE . 0.1 OUTLIER -86.25 -59.62 2.23 Favored 'General case' 0 CA--C 1.576 1.973 0 C-N-CA 117.863 -1.535 . . . . 55.06 113.781 -172.733 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' GLU . . . . . 0.825 ' OE2' 'CA ' ' D' ' 200' ' ' ' CA' . 0.9 OUTLIER -54.47 -7.44 0.15 Allowed 'General case' 1 N--CA 1.547 4.402 1 O-C-N 116.275 -4.016 . . . . 100.0 110.893 -179.594 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' LEU . . . . . 0.466 ' CD2' ' CE1' ' B' ' 34' ' ' PHE . 2.7 tt -105.61 -63.2 1.27 Allowed 'General case' 0 C--O 1.234 0.288 0 N-CA-C 113.155 0.798 . . . . 35.34 113.155 -179.043 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' LEU . . . . . 1.182 ' CD2' ' CB ' ' D' ' 8' ' ' ASP . 0.0 OUTLIER -56.99 -26.44 60.16 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.012 -0.995 . . . . 25.07 111.192 -179.412 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' SER . . . . . . . . . . . . . 2.1 t -58.37 -58.22 9.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.871 -0.604 . . . . 42.74 110.883 179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' MET . . . . . 0.458 ' N ' ' CE ' ' D' ' 15' ' ' MET . 0.0 OUTLIER -71.84 -29.72 64.7 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.636 -0.256 . . . . 33.91 111.661 179.603 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' VAL . . . . . . . . . . . . 0.569 70.6 t -73.88 8.26 0.5 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.551 0 CA-C-O 121.811 0.815 . . . . 28.57 110.296 179.132 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' THR . . . . . 0.495 ' OG1' ' O ' ' D' ' 13' ' ' LEU . 98.2 m -112.3 -64.49 1.29 Allowed 'General case' 0 C--O 1.236 0.394 0 CA-C-O 122.996 1.379 . . . . 44.58 107.93 178.907 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' TYR . . . . . 0.44 ' CD2' ' CD1' ' D' ' 22' ' ' LEU 0.312 1.0 OUTLIER -51.42 -46.35 62.89 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-N 112.849 -1.978 . . . . 57.14 107.778 178.093 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' ALA . . . . . . . . . . . . . . . -52.04 -48.75 64.42 Favored 'General case' 0 C--O 1.226 -0.138 0 O-C-N 123.143 0.277 . . . . 35.21 110.299 178.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' ASP . . . . . . . . . . . . 0.363 0.9 OUTLIER -49.36 -54.76 15.64 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 122.214 1.006 . . . . 65.36 110.202 178.786 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' LYS . . . . . 0.542 ' O ' ' N ' ' D' ' 24' ' ' SER . 0.1 OUTLIER -48.89 -84.39 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 113.897 -1.501 . . . . 100.0 111.118 -179.695 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' LEU . . . . . 0.44 ' CD1' ' CD2' ' D' ' 18' ' ' TYR . 2.7 mp -31.12 -30.42 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 126.285 1.834 . . . . 31.07 113.225 -178.701 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' LYS . . . . . 0.428 ' N ' ' O ' ' D' ' 21' ' ' LYS . 0.0 OUTLIER -72.86 -41.64 64.55 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.436 0.636 . . . . 40.89 109.936 179.288 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' SER . . . . . 0.542 ' N ' ' O ' ' D' ' 21' ' ' LYS . 0.4 OUTLIER -70.53 -37.54 74.09 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.598 -0.841 . . . . 20.06 111.288 -179.369 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tp -49.47 -45.79 47.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.637 -0.711 . . . . 33.28 111.124 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' ILE . . . . . . . . . . . . . 10.1 mt -74.92 -26.77 19.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 122.166 0.984 . . . . 43.15 109.092 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' LYS . . . . . 0.51 ' O ' ' O ' ' D' ' 30' ' ' PHE . 1.9 mtpp -63.5 -61.59 2.23 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.64 -0.709 . . . . 72.37 110.641 179.208 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.38 -50.77 35.3 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.493 0.923 . . . . 87.85 113.493 -179.121 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' GLU . . . . . . . . . . . . 0.577 3.9 tp10 -55.11 -23.11 19.15 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 119.158 -1.017 . . . . 92.42 113.015 -179.436 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' PHE . . . . . 0.51 ' O ' ' O ' ' D' ' 27' ' ' LYS 0.355 0.0 OUTLIER -173.96 -119.25 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.729 0 C-N-CA 123.777 0.831 . . . . 28.94 112.67 178.903 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' D' D ' 31' ' ' SER . . . . . 0.494 ' O ' ' O ' ' D' ' 30' ' ' PHE . 1.4 p -30.73 177.89 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 116.355 1.983 . . . . 47.4 116.355 -177.713 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 32' ' ' ILE . . . . . 0.619 ' O ' ' N ' ' D' ' 35' ' ' GLU . 0.2 OUTLIER -153.41 -43.84 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 113.564 -1.653 . . . . 25.91 108.917 179.371 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 33' ' ' SER . . . . . 0.482 ' O ' ' N ' ' D' ' 37' ' ' PHE . 2.9 p -53.85 -7.15 0.11 Allowed 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 121.344 0.592 . . . . 59.75 112.375 179.418 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 34' ' ' PHE . . . . . 0.455 ' CE1' ' CD1' ' B' ' 12' ' ' LEU . 1.2 t80 -84.79 -22.96 29.37 Favored 'General case' 0 C--O 1.246 0.87 0 N-CA-C 105.703 -1.962 . . . . 99.54 105.703 176.883 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 35' ' ' GLU . . . . . 0.619 ' N ' ' O ' ' D' ' 32' ' ' ILE . 20.0 tp10 -76.52 -19.43 57.96 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 106.126 -1.805 . . . . 86.84 106.126 178.145 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' GLU . . . . . 0.607 ' O ' ' N ' ' D' ' 40' ' ' LEU . 0.2 OUTLIER -108.43 -31.82 7.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.007 -0.997 . . . . 100.0 111.458 179.006 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 37' ' ' PHE . . . . . 0.482 ' N ' ' O ' ' D' ' 33' ' ' SER . 0.1 OUTLIER -50.32 -28.35 7.73 Favored 'General case' 0 C--N 1.332 -0.176 0 O-C-N 123.636 0.585 . . . . 88.82 109.968 179.494 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 38' ' ' ALA . . . . . 0.432 ' O ' ' OG1' ' D' ' 41' ' ' THR . . . -85.57 -55.88 3.78 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.093 -0.503 . . . . 88.83 110.393 179.211 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' VAL . . . . . . . . . . . . . 2.7 p -61.54 -23.85 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 108.027 -1.101 . . . . 84.94 108.027 179.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 40' ' ' LEU . . . . . 0.607 ' N ' ' O ' ' D' ' 36' ' ' GLU . 0.3 OUTLIER -59.87 -31.4 69.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.339 -0.846 . . . . 100.0 109.799 179.189 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 41' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' D' ' 38' ' ' ALA . 40.3 p -54.92 -34.33 63.05 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.283 -0.636 . . . . 100.0 109.283 179.538 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 42' ' ' TYR . . . . . . . . . . . . 0.445 63.5 t80 -95.37 -8.19 36.39 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 112.788 0.662 . . . . 85.8 112.788 179.073 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 43' ' ' ILE . . . . . 0.487 ' O ' ' O ' ' D' ' 40' ' ' LEU 1.327 1.4 tp -141.89 168.46 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 N-CA-C 115.349 1.611 . . . . 76.61 115.349 179.994 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 44' ' ' SER . . . . . 0.481 ' O ' ' N ' ' D' ' 47' ' ' LYS . 96.2 p -110.99 -32.79 6.69 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 122.97 0.508 . . . . 100.0 111.247 179.804 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 45' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.74 -27.04 10.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.749 -0.66 . . . . 100.0 111.028 -179.055 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 46' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -75.55 0.29 17.85 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.427 -0.806 . . . . 99.73 110.051 179.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 47' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' D' ' 44' ' ' SER . 0.0 OUTLIER -84.88 -26.15 27.52 Favored 'General case' 0 CA--C 1.486 -1.488 0 CA-C-O 122.336 1.065 . . . . 60.36 113.432 179.9 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 48' ' ' GLU . . . . . 0.5 ' C ' ' N ' ' D' ' 50' ' ' GLU . 0.4 OUTLIER -93.48 -45.41 7.78 Favored 'General case' 0 C--N 1.296 -1.722 2 O-C-N 113.375 -5.828 . . . . 96.93 112.762 179.371 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' D' D ' 49' ' ' LYS . . . . . 0.427 ' C ' ' O ' ' D' ' 48' ' ' GLU . 0.0 OUTLIER -44.95 -23.6 0.15 Allowed 'General case' 0 N--CA 1.538 3.94 0 O-C-N 118.171 -2.831 . . . . 100.0 107.407 176.693 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 50' ' ' GLU . . . . . 0.5 ' N ' ' C ' ' D' ' 48' ' ' GLU . 0.0 OUTLIER -66.64 -62.5 1.42 Allowed 'General case' 0 C--O 1.21 -0.999 0 O-C-N 124.282 0.989 . . . . 63.54 111.788 -179.462 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 51' ' ' TYR . . . . . . . . . . . . 0.613 3.2 m-85 -82.48 -30.64 29.81 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 114.715 1.376 . . . . 67.8 114.715 -178.656 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 52' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -59.68 -13.02 8.09 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.393 -0.923 . . . . 66.43 109.69 179.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 53' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -126.48 -39.85 1.99 Allowed 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 113.389 0.885 . . . . 51.21 113.389 -179.397 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 54' ' ' LYS . . . . . . . . . . . . 0.527 43.2 tttt -52.4 -6.88 0.05 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.629 0.974 . . . . 39.38 113.629 -177.643 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 55' ' ' ASP . . . . . 0.45 ' OD1' ' O ' ' D' ' 55' ' ' ASP . 42.7 t0 -139.97 19.68 2.47 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 122.168 0.985 . . . . 80.55 111.223 179.208 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 56' ' ' ILE . . . . . . . . . . . . . 2.0 mp . . . . . 0 CA--C 1.541 0.625 0 O-C-N 121.138 -0.976 . . . . 75.97 112.212 -178.501 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 67' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 CA--C 1.604 3.033 0 N-CA-C 117.56 2.43 . . . . 54.64 117.56 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 68' ' ' VAL . . . . . . . . . . . . . 2.5 t -78.39 -39.13 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.004 0 O-C-N 118.28 -2.763 . . . . 86.27 111.63 -177.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 69' ' ' LYS . . . . . 0.464 ' NZ ' ' CD1' ' D' ' 73' ' ' ILE . 0.0 OUTLIER -69.33 0.05 5.57 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 121.489 0.662 . . . . 98.36 109.343 178.156 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 70' ' ' ALA . . . . . . . . . . . . . . . -95.7 -52.9 3.91 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.588 -1.187 . . . . 83.65 109.722 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 71' ' ' VAL . . . . . 0.432 ' CG1' ' N ' ' D' ' 72' ' ' LYS . 0.3 OUTLIER -67.26 -37.59 79.39 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 N-CA-C 107.433 -1.321 . . . . 52.98 107.433 178.297 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 72' ' ' LYS . . . . . 0.432 ' N ' ' CG1' ' D' ' 71' ' ' VAL . 12.2 tptm -56.15 -43.03 77.89 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.079 -0.964 . . . . 59.51 109.227 179.156 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 73' ' ' ILE . . . . . 0.464 ' CD1' ' NZ ' ' D' ' 69' ' ' LYS . 0.1 OUTLIER -72.66 -48.13 47.55 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.409 0 CA-C-N 116.118 -0.492 . . . . 57.72 110.441 179.48 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.49 -44.74 89.5 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 119.796 -0.762 . . . . 73.01 111.001 -179.693 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 75' ' ' SER . . . . . . . . . . . . . 10.9 t -62.1 -50.32 72.4 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 120.297 -0.561 . . . . 67.15 110.698 179.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -7.79 43.72 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 120.115 -0.634 . . . . 55.73 110.771 -179.935 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 77' ' ' GLU . . . . . 0.465 ' CG ' ' CZ ' ' D' ' 80' ' ' PHE . 0.1 OUTLIER -92.57 -14.25 28.54 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.687 -1.227 . . . . 100.0 107.687 179.117 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 78' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -90.89 -32.97 15.81 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 107.558 -1.275 . . . . 100.0 107.558 177.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 79' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -53.9 -36.89 63.2 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.185 -0.916 . . . . 100.0 109.024 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 80' ' ' PHE . . . . . 0.465 ' CZ ' ' CG ' ' D' ' 77' ' ' GLU 0.462 0.3 OUTLIER -89.52 -27.87 20.0 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 113.004 0.742 . . . . 100.0 113.004 179.188 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' D' D ' 81' ' ' ASP . . . . . . . . . . . . 0.558 3.4 m-20 -66.94 -19.43 65.72 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 114.789 1.403 . . . . 46.4 114.789 -179.061 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 82' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -93.51 -39.5 10.84 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 121.664 0.745 . . . . 100.0 110.605 179.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 83' ' ' LYS . . . . . . . . . . . . . 37.4 tttp -59.81 -25.75 65.22 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 114.671 -1.149 . . . . 57.65 112.683 179.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.442 0.9 OUTLIER -95.63 -37.58 10.76 Favored 'General case' 0 C--N 1.352 0.682 0 N-CA-C 112.672 0.619 . . . . 59.76 112.672 179.398 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 85' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -64.15 -34.04 77.16 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 104.649 -2.352 . . . . 41.11 104.649 177.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 86' ' ' GLU . . . . . 0.447 ' CG ' ' NH1' ' D' ' 90' ' ' ARG . 15.5 pt-20 -70.88 -48.16 55.31 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.375 -0.83 . . . . 100.0 110.649 179.307 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 87' ' ' HIS . . . . . . . . . . . . 0.422 0.0 OUTLIER -65.09 -12.76 54.32 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 113.222 0.823 . . . . 100.0 113.222 -179.185 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 88' ' ' ASP . . . . . . . . . . . . 0.642 10.9 m-20 -63.67 -1.34 1.26 Allowed 'General case' 0 C--O 1.238 0.47 0 CA-C-O 121.939 0.876 . . . . 99.05 111.856 179.738 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 89' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -111.26 -22.69 11.25 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.326 -1.306 . . . . 100.0 108.287 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 90' ' ' ARG . . . . . 0.447 ' NH1' ' CG ' ' D' ' 86' ' ' GLU 0.342 0.0 OUTLIER -88.78 -66.06 0.96 Allowed 'General case' 0 CA--C 1.509 -0.632 0 C-N-CA 119.752 -0.779 . . . . 100.0 109.834 178.44 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' D' D ' 91' ' ' THR . . . . . . . . . . . . 0.295 90.4 m -56.81 -14.26 3.27 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 119.79 -0.764 . . . . 88.98 109.571 178.073 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 92' ' ' VAL . . . . . 0.419 ' CG2' ' CD2' ' D' ' 95' ' ' LEU 0.677 1.0 OUTLIER -56.35 5.99 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 123.404 0.682 . . . . 81.89 112.498 178.302 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' D' D ' 93' ' ' LEU . . . . . 0.616 ' O ' ' N ' ' D' ' 97' ' ' ASN . 0.6 OUTLIER -78.56 -38.19 40.86 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 104.751 -2.314 . . . . 59.0 104.751 176.631 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 94' ' ' ILE . . . . . 0.521 ' O ' ' N ' ' D' ' 98' ' ' ALA . 10.9 tt -63.46 -45.33 98.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-N 113.473 -1.694 . . . . 75.81 110.679 178.612 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 95' ' ' LEU . . . . . 0.55 ' O ' ' NE2' ' D' ' 99' ' ' GLN . 0.1 OUTLIER -52.68 -53.57 45.58 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 108.256 -1.016 . . . . 66.41 108.256 179.89 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 96' ' ' VAL . . . . . 0.634 ' O ' ' N ' ' D' ' 100' ' ' GLN . 82.3 t -73.16 -37.51 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.3 0 N-CA-C 107.334 -1.358 . . . . 79.13 107.334 177.883 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 97' ' ' ASN . . . . . 0.616 ' N ' ' O ' ' D' ' 93' ' ' LEU 0.49 2.5 m120 -56.02 -41.95 75.73 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.11 0.411 . . . . 100.0 112.11 -179.865 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 98' ' ' ALA . . . . . 0.521 ' N ' ' O ' ' D' ' 94' ' ' ILE . . . -65.55 -63.75 1.02 Allowed 'General case' 0 C--O 1.234 0.252 0 N-CA-C 107.801 -1.185 . . . . 95.57 107.801 178.349 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 99' ' ' GLN . . . . . 0.55 ' NE2' ' O ' ' D' ' 95' ' ' LEU 0.463 1.5 tt0 -56.87 -25.88 57.55 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.183 1.393 . . . . 76.08 111.289 179.298 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 100' ' ' GLN . . . . . 0.634 ' N ' ' O ' ' D' ' 96' ' ' VAL . 24.6 mt-30 -51.2 -127.42 0.0 OUTLIER 'General case' 0 C--O 1.234 0.268 0 N-CA-C 113.693 0.997 . . . . 100.0 113.693 -178.817 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' ARG . . . . . 0.652 ' O ' ' N ' ' D' ' 105' ' ' GLU . 0.5 OUTLIER -44.99 -17.82 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 114.56 -1.2 . . . . 100.0 113.079 -179.036 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' LYS . . . . . 0.84 ' CG ' ' NZ ' ' D' ' 5' ' ' LYS 0.644 0.3 OUTLIER -68.7 -55.8 10.22 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 119.825 -0.75 . . . . 37.05 109.917 179.474 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' D' D ' 103' ' ' LYS . . . . . 0.425 ' O ' ' N ' ' D' ' 106' ' ' SER . 4.8 tttt -67.45 -35.31 78.95 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 103.723 -2.695 . . . . 61.54 103.723 176.983 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 104' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -22.03 26.39 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 N-CA-C 107.519 -1.289 . . . . 37.57 107.519 177.206 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 105' ' ' GLU . . . . . 0.652 ' N ' ' O ' ' D' ' 101' ' ' ARG . 3.2 tp10 -74.26 -36.39 63.85 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 105.701 -1.962 . . . . 75.76 105.701 177.146 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 106' ' ' SER . . . . . 0.564 ' O ' ' N ' ' D' ' 109' ' ' SER . 0.3 OUTLIER -70.77 -45.9 63.92 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.012 -0.994 . . . . 41.8 110.363 178.475 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -23.17 20.33 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.733 -0.84 . . . . 35.79 108.733 178.706 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 108' ' ' LEU . . . . . . . . . . . . . 1.2 tp -58.1 -32.32 67.98 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 104.99 -2.226 . . . . 31.0 104.99 178.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 109' ' ' SER . . . . . 0.564 ' N ' ' O ' ' D' ' 106' ' ' SER . 0.7 OUTLIER -73.67 -30.9 63.17 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 113.32 -1.764 . . . . 96.1 108.708 178.049 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 110' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -56.43 -53.48 56.88 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.377 -1.342 . . . . 60.43 107.377 178.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 111' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.235 0.323 0 N-CA-C 107.204 -1.406 . . . . 64.68 107.204 176.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' ALA . . . . . 0.445 ' O ' ' O ' ' B' ' 3' ' ' ILE . . . . . . . . 0 C--O 1.238 0.463 0 N-CA-C 112.379 0.511 . . . . 25.77 112.379 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ILE . . . . . 0.445 ' O ' ' O ' ' B' ' 2' ' ' ALA . 0.6 OUTLIER -38.43 178.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 115.241 1.571 . . . . 58.42 115.241 -178.959 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' THR . . . . . 0.442 ' N ' ' CD1' ' B' ' 3' ' ' ILE . 0.2 OUTLIER -159.76 -66.17 0.07 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.6 -1.63 . . . . 91.74 106.6 179.182 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LYS . . . . . 0.631 ' O ' ' N ' ' B' ' 7' ' ' ASN . 16.4 mmtp -116.76 6.84 13.29 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 114.986 -1.007 . . . . 81.67 112.394 178.93 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . 0.305 1.3 pp -62.67 78.82 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.489 0 C-N-CA 118.333 -1.347 . . . . 41.23 108.003 179.155 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ASN . . . . . 0.631 ' N ' ' O ' ' B' ' 5' ' ' LYS . 0.8 OUTLIER -164.26 54.57 0.15 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.878 -1.055 . . . . 54.77 108.973 -178.34 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ASP . . . . . 0.45 ' N ' ' OD1' ' B' ' 8' ' ' ASP 0.416 1.1 p-10 -55.14 130.38 41.77 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 114.485 -1.234 . . . . 100.0 109.601 179.322 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' CYS . . . . . . . . . . . . . 9.7 p -134.38 -169.1 2.26 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.939 1.296 . . . . 94.2 107.81 -0.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' PHE . . . . . 0.486 ' CD1' ' N ' ' B' ' 10' ' ' PHE 0.351 0.0 OUTLIER -80.37 -89.38 0.06 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.872 1.064 . . . . 80.18 113.872 -177.923 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' GLU . . . . . 0.556 ' CG ' ' OP1' ' K' ' 9' ' ' ' DA' . 0.0 OUTLIER -42.42 -58.48 2.21 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.385 0.883 . . . . 91.67 113.385 -178.757 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' LEU . . . . . 0.455 ' CD1' ' CE1' ' D' ' 34' ' ' PHE . 0.0 OUTLIER -57.85 -39.28 77.35 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 121.265 -0.897 . . . . 41.37 110.495 179.565 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . 1.163 4.0 mt -49.61 -89.43 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 116.646 2.091 . . . . 76.13 116.646 -179.713 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' SER . . . . . 0.47 ' O ' ' N ' ' B' ' 18' ' ' TYR 0.265 1.8 t -47.49 -31.28 4.1 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.964 1.098 . . . . 62.47 113.964 -178.532 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' MET . . . . . . . . . . . . . 13.4 tpp -55.18 -61.31 2.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.355 0.598 . . . . 46.47 110.092 -179.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' VAL . . . . . 0.538 ' O ' ' N ' ' B' ' 20' ' ' ASP . 21.1 t -52.56 -49.71 43.41 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.899 0 CA-C-N 115.243 -0.89 . . . . 64.79 110.658 179.377 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' THR . . . . . . . . . . . . . 1.2 m -62.24 -53.83 49.6 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.71 0.766 . . . . 36.12 111.335 179.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' TYR . . . . . 0.47 ' N ' ' O ' ' B' ' 14' ' ' SER . 0.1 OUTLIER -57.54 -29.36 64.31 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.231 -1.026 . . . . 36.96 108.231 178.087 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.49 -50.17 9.73 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.757 -0.59 . . . . 58.56 109.842 179.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ASP . . . . . 0.538 ' N ' ' O ' ' B' ' 16' ' ' VAL . 2.5 m-20 -57.39 -10.11 1.27 Allowed 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.719 -0.673 . . . . 85.92 110.436 179.522 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' LYS . . . . . 0.436 ' O ' ' OG ' ' B' ' 24' ' ' SER . 1.9 tptm -84.38 -61.82 1.71 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.111 0.964 . . . . 92.23 113.44 -179.941 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' LEU . . . . . 0.455 ' CD2' ' NE2' ' B' ' 87' ' ' HIS 0.971 0.3 OUTLIER -72.45 -13.32 61.41 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.302 0.853 . . . . 48.28 113.302 179.767 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' LYS . . . . . 0.587 ' NZ ' ' OE1' ' B' ' 35' ' ' GLU 0.312 1.7 mtpp -66.43 -49.89 65.22 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.081 -1.081 . . . . 56.68 108.081 177.854 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' SER . . . . . 0.436 ' OG ' ' O ' ' B' ' 21' ' ' LYS 0.268 33.1 p -74.96 -41.46 59.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 114.142 -1.39 . . . . 45.21 111.429 179.588 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' LEU . . . . . 0.458 ' CD1' ' CE1' ' B' ' 87' ' ' HIS . 0.6 OUTLIER -51.65 -45.14 63.24 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 120.919 0.39 . . . . 45.63 111.212 -179.256 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mp -75.6 -24.38 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-O 122.059 0.933 . . . . 31.84 108.971 179.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LYS . . . . . 0.448 ' NZ ' ' CB ' ' B' ' 35' ' ' GLU . 2.4 tttp -62.61 -56.55 16.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.848 -0.614 . . . . 100.0 112.561 -179.505 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -52.48 43.22 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.14 0.422 . . . . 49.33 112.14 -179.966 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLU . . . . . 0.624 ' OE1' ' NZ ' ' B' ' 83' ' ' LYS . 4.1 tp10 -57.33 -20.32 28.12 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.608 0.966 . . . . 93.7 113.608 -179.007 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' PHE . . . . . 0.524 ' O ' ' O ' ' B' ' 31' ' ' SER 0.69 0.0 OUTLIER -157.46 -130.28 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.619 1.341 . . . . 66.7 114.619 179.372 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' SER . . . . . 0.524 ' O ' ' O ' ' B' ' 30' ' ' PHE . 12.4 p -49.49 -143.94 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 113.555 0.946 . . . . 67.72 113.555 -178.281 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -173.16 -17.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.819 0 CA-C-N 114.962 -1.017 . . . . 41.92 110.8 179.739 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' SER . . . . . 0.652 ' O ' ' N ' ' B' ' 37' ' ' PHE 0.26 93.1 p -54.34 -15.25 1.51 Allowed 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.197 -0.601 . . . . 65.86 111.46 179.243 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' PHE . . . . . 0.466 ' CE1' ' CD2' ' D' ' 12' ' ' LEU . 1.0 OUTLIER -64.83 -46.01 83.72 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 112.848 0.684 . . . . 100.0 112.848 179.727 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' GLU . . . . . 0.587 ' OE1' ' NZ ' ' B' ' 23' ' ' LYS . 32.8 tp10 -65.86 -21.29 66.45 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.238 -1.393 . . . . 92.39 107.238 178.824 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -88.34 -60.12 2.05 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 114.501 -1.227 . . . . 61.85 111.61 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' PHE . . . . . 0.652 ' N ' ' O ' ' B' ' 33' ' ' SER . 0.7 OUTLIER -49.54 -46.96 49.3 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.722 0.638 . . . . 64.45 111.375 -179.737 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.16 -49.58 63.51 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.346 -0.388 . . . . 73.66 111.589 -179.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 2.5 p -77.13 -32.11 19.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.229 -0.588 . . . . 69.55 110.237 179.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' LEU . . . . . 0.495 ' CA ' ' ND2' ' B' ' 46' ' ' ASN . 1.5 tm? -36.62 -34.99 0.08 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.293 1.437 . . . . 63.28 113.713 -179.412 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' THR . . . . . 0.502 ' O ' ' OG1' ' B' ' 41' ' ' THR . 0.1 OUTLIER -67.61 11.05 0.15 Allowed 'General case' 0 C--N 1.329 -0.31 0 O-C-N 122.067 -0.395 . . . . 83.79 111.114 179.955 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' TYR . . . . . . . . . . . . . 7.0 t80 -139.82 -23.37 0.86 Allowed 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.257 0.466 . . . . 74.47 112.257 -179.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . 0.698 9.6 mt -132.52 143.25 40.35 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 113.474 0.916 . . . . 66.49 113.474 179.431 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 9.2 p -96.85 -2.44 43.98 Favored 'General case' 0 CA--C 1.484 -1.561 0 N-CA-C 115.165 1.543 . . . . 50.11 115.165 -178.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLU . . . . . 0.601 ' O ' ' OE1' ' B' ' 45' ' ' GLU . 0.8 OUTLIER -100.12 -13.34 19.02 Favored 'General case' 0 C--N 1.301 -1.506 2 O-C-N 113.913 -5.492 . . . . 100.0 113.213 -179.839 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ASN . . . . . 0.495 ' ND2' ' CA ' ' B' ' 40' ' ' LEU . 28.0 p30 -57.32 -21.31 34.28 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 107.047 -1.464 . . . . 48.82 107.047 177.22 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' LYS . . . . . 0.42 ' N ' ' C ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -67.94 -17.89 64.59 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 112.68 -2.055 . . . . 66.39 110.985 179.91 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' GLU . . . . . 0.611 ' OE2' ' CA ' ' B' ' 48' ' ' GLU . 0.0 OUTLIER -67.08 -74.82 0.1 Allowed 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 115.461 -2.495 . . . . 100.0 112.459 -176.216 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -12.22 21.46 Favored 'General case' 0 N--CA 1.5 2.073 1 O-C-N 116.136 -4.102 . . . . 60.8 107.98 -178.685 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' GLU . . . . . 0.409 ' N ' ' C ' ' B' ' 48' ' ' GLU . 0.0 OUTLIER -49.15 -63.31 1.14 Allowed 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 114.252 -1.34 . . . . 99.43 108.689 178.438 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' TYR . . . . . 0.403 ' OH ' ' NZ ' ' B' ' 69' ' ' LYS 0.685 0.2 OUTLIER -79.0 -24.92 43.42 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 119.592 -0.843 . . . . 58.78 112.017 178.692 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -64.23 -21.33 66.54 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.557 0.694 . . . . 94.43 109.514 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -106.38 -43.43 4.77 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.312 -0.858 . . . . 77.74 112.086 -179.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . 0.333 0.1 OUTLIER -57.89 6.84 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 114.223 1.194 . . . . 89.1 114.223 -179.081 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -138.52 -48.58 0.52 Allowed 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.558 -0.457 . . . . 91.09 110.616 178.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.234 0.253 0 CA-C-N 116.221 -0.445 . . . . 100.0 110.532 179.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 115.466 1.654 . . . . 66.72 115.466 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 48.2 t -76.29 -57.32 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 119.117 -2.239 . . . . 100.0 109.116 -179.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' LYS . . . . . 0.403 ' NZ ' ' OH ' ' B' ' 51' ' ' TYR . 0.0 OUTLIER -64.99 -17.27 64.28 Favored 'General case' 0 C--O 1.253 1.262 0 C-N-CA 119.956 -0.698 . . . . 81.79 110.121 179.781 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.67 -76.77 0.05 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.397 -0.594 . . . . 58.37 109.397 179.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 43.2 t -55.1 -22.42 10.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.92 -0.582 . . . . 49.4 111.873 179.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 4.4 tptm -71.0 -45.55 63.78 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 107.803 -1.184 . . . . 100.0 107.803 178.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ILE . . . . . 0.426 ' CG2' ' N ' ' B' ' 74' ' ' LEU . 1.1 mp -70.12 -44.92 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 115.103 -0.953 . . . . 42.17 110.292 179.211 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' LEU . . . . . 0.426 ' N ' ' CG2' ' B' ' 73' ' ' ILE . 1.2 tm? -55.08 -47.08 75.37 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 113.621 0.971 . . . . 44.9 113.621 -178.632 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' SER . . . . . . . . . . . . 0.507 26.3 t -62.14 -34.41 76.32 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 113.747 1.017 . . . . 48.68 113.747 -179.219 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.2 -33.04 38.52 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.431 -0.951 . . . . 83.09 108.431 178.372 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' GLU . . . . . 0.459 ' OE2' ' N ' ' D' ' 9' ' ' CYS . 0.1 OUTLIER -60.33 -23.86 64.57 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 107.137 -1.431 . . . . 100.0 107.137 178.559 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -81.82 -35.23 29.69 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 113.896 -1.502 . . . . 100.0 108.164 177.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.94 -54.62 32.26 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 114.957 -1.019 . . . . 78.89 111.069 -179.929 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -81.97 -15.03 55.12 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 121.699 0.761 . . . . 49.76 110.215 -179.918 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.38 -26.55 65.63 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.981 -1.009 . . . . 74.3 111.477 -178.769 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -85.07 -40.78 16.42 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.08 -0.964 . . . . 100.0 110.589 179.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' LYS . . . . . 0.624 ' NZ ' ' OE1' ' B' ' 29' ' ' GLU . 10.8 mttt -71.76 6.46 1.97 Allowed 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.393 0.886 . . . . 38.91 113.393 -179.477 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -104.89 -49.07 3.58 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 108.167 -1.049 . . . . 90.06 108.167 179.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -69.26 -28.48 66.35 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 107.917 -1.142 . . . . 100.0 107.917 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -77.56 -49.72 14.07 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 113.972 -1.467 . . . . 77.36 109.765 179.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' HIS . . . . . 0.458 ' CE1' ' CD1' ' B' ' 25' ' ' LEU 0.744 0.0 OUTLIER -70.17 -14.11 62.49 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.283 -0.871 . . . . 47.85 113.177 -179.007 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.44 -7.81 53.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.1 -0.955 . . . . 61.73 112.143 179.597 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -82.45 -11.73 58.32 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.124 0.488 . . . . 100.0 110.728 179.688 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' ARG . . . . . 0.45 ' NH1' ' CB ' ' B' ' 90' ' ' ARG . 0.1 OUTLIER -140.3 24.51 2.3 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 112.954 0.724 . . . . 62.29 112.954 -178.075 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' THR . . . . . . . . . . . . 0.347 2.9 t -99.56 5.42 46.02 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 122.598 1.19 . . . . 52.4 107.905 177.434 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 2.6 p -69.82 3.04 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 113.574 -1.648 . . . . 64.43 111.907 179.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.09 -51.0 46.33 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.268 0.556 . . . . 56.65 111.026 179.945 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' ILE . . . . . 0.556 ' O ' ' N ' ' B' ' 98' ' ' ALA . 0.6 OUTLIER -49.57 -88.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 114.868 1.433 . . . . 61.0 114.868 -178.92 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' LEU . . . . . 0.659 ' O ' ' N ' ' B' ' 99' ' ' GLN . 0.0 OUTLIER -41.24 -40.57 1.65 Allowed 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 124.68 1.192 . . . . 72.26 111.839 -178.355 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' VAL . . . . . 0.552 ' O ' ' N ' ' B' ' 100' ' ' GLN 0.268 2.6 t -68.38 -61.56 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 O-C-N 125.202 1.564 . . . . 65.51 110.197 179.674 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ASN . . . . . 0.447 ' N ' ' CG1' ' B' ' 96' ' ' VAL . 1.6 t-20 -56.71 -26.67 57.45 Favored 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 106.378 -1.712 . . . . 72.48 106.378 177.306 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ALA . . . . . 0.556 ' N ' ' O ' ' B' ' 94' ' ' ILE . . . -79.6 -34.66 40.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.435 -1.257 . . . . 75.86 108.035 178.534 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' GLN . . . . . 0.659 ' N ' ' O ' ' B' ' 95' ' ' LEU . 0.1 OUTLIER -67.78 -52.66 34.61 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 105.238 -2.134 . . . . 59.7 105.238 178.23 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' GLN . . . . . 0.552 ' N ' ' O ' ' B' ' 96' ' ' VAL . 1.4 mp0 -66.73 -19.0 65.66 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 105.852 -1.907 . . . . 90.63 105.852 178.117 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.51 -53.77 37.71 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 124.811 2.244 . . . . 77.9 108.421 178.208 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' LYS . . . . . 0.649 ' O ' ' N ' ' B' ' 106' ' ' SER . 4.1 tppp? -61.8 -41.95 98.4 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 119.046 -2.284 . . . . 78.58 107.802 177.105 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -19.97 19.01 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.175 -1.046 . . . . 85.73 108.175 178.791 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.97 -38.27 42.85 Favored 'Isoleucine or valine' 0 C--N 1.357 0.92 0 C-N-CA 115.674 -2.41 . . . . 32.57 109.964 179.646 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' GLU . . . . . 0.464 ' O ' ' N ' ' B' ' 109' ' ' SER . 1.0 OUTLIER -104.51 -33.05 8.69 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 119.939 -0.705 . . . . 67.66 111.061 -179.432 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' SER . . . . . 0.649 ' N ' ' O ' ' B' ' 102' ' ' LYS . 13.7 t -51.2 -74.5 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.146 0.795 . . . . 68.61 113.146 -179.047 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' LEU . . . . . 0.616 ' O ' ' N ' ' B' ' 110' ' ' ARG . 0.7 OUTLIER -59.35 -52.84 63.92 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 107.713 -1.217 . . . . 37.56 107.713 179.27 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' LEU . . . . . 0.41 ' CA ' ' CG2' ' B' ' 111' ' ' VAL . 0.2 OUTLIER -48.78 -28.85 3.95 Favored 'General case' 0 CA--C 1.462 -2.409 0 O-C-N 124.868 1.355 . . . . 78.93 110.116 178.133 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' SER . . . . . 0.468 ' O ' ' CB ' ' B' ' 113' ' ' LYS . 0.2 OUTLIER -80.35 -12.9 59.54 Favored 'General case' 0 N--CA 1.419 -2.017 1 C-N-CA 110.974 -4.29 . . . . 36.75 108.543 -179.439 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' ARG . . . . . 0.619 ' O ' ' N ' ' B' ' 114' ' ' ARG . 0.0 OUTLIER -84.62 -21.9 30.16 Favored 'General case' 0 N--CA 1.495 1.803 1 N-CA-C 99.695 -4.187 . . . . 57.01 99.695 169.476 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' VAL . . . . . 0.41 ' CG2' ' CA ' ' B' ' 108' ' ' LEU 0.453 4.1 m -60.61 -68.64 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 N-CA-C 108.672 -0.862 . . . . 43.37 108.672 179.68 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -66.4 -6.94 16.18 Favored 'General case' 0 C--O 1.224 -0.255 0 N-CA-C 108.313 -0.995 . . . . 78.8 108.313 177.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -81.97 -66.46 0.89 Allowed 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 115.736 -0.665 . . . . 100.0 110.171 178.525 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' ARG . . . . . 0.619 ' N ' ' O ' ' B' ' 110' ' ' ARG . 0.6 OUTLIER -44.38 -37.37 3.33 Favored 'General case' 0 C--O 1.243 0.751 0 O-C-N 124.281 0.988 . . . . 59.93 108.44 -179.885 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -62.24 -16.5 16.3 Favored 'Isoleucine or valine' 0 C--N 1.374 1.655 0 C-N-CA 117.375 -1.73 . . . . 63.51 109.342 -176.578 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' THR . . . . . 0.509 ' N ' ' O ' ' B' ' 113' ' ' LYS . 0.7 OUTLIER . . . . . 0 C--N 1.327 -0.41 0 CA-C-N 115.073 -0.967 . . . . 87.66 110.679 179.126 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 200' ' ' ' CA' . . . . . 0.825 'CA ' ' OE2' ' D' ' 11' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' W' W ' 3' ' ' ' DA' . . . . . 1.267 ' N1 ' ' N6 ' ' K' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.502 -2.563 3 OP1-P-OP2 102.893 -11.138 . . . . 61.26 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' W' W ' 4' ' ' ' DT' . . . . . 0.835 H2'' ' N7 ' ' W' ' 5' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.541 3.796 0 C4'-C3'-O3' 117.692 3.36 . . . . 39.44 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' W' W ' 5' ' ' ' DA' . . . . . 1.406 ' H61' ' N6 ' ' K' ' 5' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.541 3.692 1 O4'-C1'-C2' 110.501 4.001 . . . . 42.95 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' W' W ' 6' ' ' ' DT' . . . . . 0.976 " H5'" H2'' ' W' ' 5' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.545 4.234 2 C5'-C4'-C3' 124.111 6.274 . . . . 40.0 . . . . . . . . . . 3 2 . 1 . 001 ecloud build full ' W' W ' 7' ' ' ' DA' . . . . . 1.071 H2'' ' OP2' ' W' ' 8' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.541 3.763 4 P-O3'-C3' 129.524 8.187 . . . . 35.51 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' W' W ' 8' ' ' ' DT' . . . . . 1.071 ' OP2' H2'' ' W' ' 7' ' ' ' DA' . . . . . . . . 2 C5'--C4' 1.595 10.472 3 O4'-C4'-C3' 94.93 -10.67 . . . . 32.37 . . . . . . . . . . 3 2 . 1 . 001 ecloud build full ' W' W ' 9' ' ' ' DA' . . . . . 1.107 ' OP2' ' C8 ' ' W' ' 9' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.487 3.7 4 P-O5'-C5' 113.65 -4.532 . . . . 59.77 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' K' K ' 3' ' ' ' DA' . . . . . 0.75 H2'' ' OP2' ' K' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.473 2.464 3 OP1-P-OP2 143.715 16.077 . . . . 36.69 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' K' K ' 4' ' ' ' DT' . . . . . 0.848 H2'' ' N7 ' ' K' ' 5' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.396 0 C4'-C3'-O3' 117.602 3.319 . . . . 39.44 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' K' K ' 5' ' ' ' DA' . . . . . 1.406 ' N6 ' ' H61' ' W' ' 5' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.549 4.691 1 P-O3'-C3' 125.101 4.501 . . . . 42.95 . . . . . . . . . . 3 2 . 1 . 001 ecloud build full ' K' K ' 6' ' ' ' DT' . . . . . 0.745 " C5'" H2'' ' K' ' 5' ' ' ' DA' . . . . . . . . 3 C5'--C4' 1.563 6.479 1 O4'-C4'-C3' 99.823 -5.777 . . . . 40.0 . . . . . . . . . . 3 2 . 1 . 001 ecloud build full ' K' K ' 7' ' ' ' DA' . . . . . 1.267 ' N6 ' ' N1 ' ' W' ' 3' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.542 3.922 4 O4'-C4'-C3' 99.265 -6.335 . . . . 35.51 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' K' K ' 8' ' ' ' DT' . . . . . 1.124 ' OP2' H2'' ' K' ' 7' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.621 1 O4'-C4'-C3' 98.805 -6.795 . . . . 32.37 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' K' K ' 9' ' ' ' DA' . . . . . 0.957 ' OP2' H2'' ' K' ' 8' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.569 7.285 1 O4'-C1'-C2' 110.857 4.325 . . . . 39.42 . . . . . . . . . . 3 2 . 1 . 001 ecloud build full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.815 0 CA-C-O 121.925 0.869 . . . . 29.94 112.652 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 3' ' ' ILE . . . . . 1.061 HG12 HD13 ' D' ' 6' ' ' ILE . 5.3 mp -45.65 -178.06 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 117.399 2.37 . . . . 60.47 117.399 -177.537 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 4' ' ' THR . . . . . 0.922 ' N ' HG22 ' D' ' 3' ' ' ILE . 0.2 OUTLIER -130.16 -114.92 0.24 Allowed 'General case' 0 N--CA 1.473 0.714 1 O-C-N 129.378 4.174 . . . . 78.24 108.949 -179.089 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' D' D ' 5' ' ' LYS . . . . . 1.171 ' NZ ' ' HG3' ' D' ' 102' ' ' LYS . 13.9 ttmt -93.22 73.97 4.61 Favored 'General case' 0 C--N 1.32 -0.704 0 O-C-N 125.688 1.868 . . . . 81.0 106.013 177.128 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 6' ' ' ILE . . . . . 1.061 HD13 HG12 ' D' ' 3' ' ' ILE . 3.3 pt -101.26 -1.23 9.92 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 119.127 -1.029 . . . . 54.01 113.417 -177.281 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 7' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -64.38 139.22 58.74 Favored 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 106.116 -1.809 . . . . 100.0 106.116 177.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' ASP . . . . . 1.594 ' HB2' ' CD2' ' D' ' 13' ' ' LEU . 4.4 m-20 -44.68 163.78 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 114.794 1.405 . . . . 46.17 114.794 -173.27 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 9' ' ' CYS . . . . . 0.817 ' O ' ' HB2' ' D' ' 13' ' ' LEU . 0.1 OUTLIER -20.07 136.33 0.01 OUTLIER 'General case' 0 CA--C 1.497 -1.074 0 C-N-CA 126.997 2.119 . . . . 49.86 110.444 -178.102 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 10' ' ' PHE . . . . . 0.657 ' CD1' ' N ' ' D' ' 10' ' ' PHE . 0.1 OUTLIER -86.25 -59.62 2.23 Favored 'General case' 0 CA--C 1.576 1.973 0 C-N-CA 117.863 -1.535 . . . . 55.06 113.781 -172.733 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 11' ' ' GLU . . . . . 0.825 ' OE2' 'CA ' ' D' ' 200' ' ' ' CA' . 0.9 OUTLIER -54.47 -7.44 0.15 Allowed 'General case' 1 N--CA 1.547 4.402 1 O-C-N 116.275 -4.016 . . . . 100.0 110.893 -179.594 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' D' D ' 12' ' ' LEU . . . . . 0.568 HD21 ' HE1' ' B' ' 34' ' ' PHE . 2.7 tt -105.61 -63.2 1.27 Allowed 'General case' 0 C--O 1.234 0.288 0 N-CA-C 113.155 0.798 . . . . 35.34 113.155 -179.043 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 13' ' ' LEU . . . . . 1.594 ' CD2' ' HB2' ' D' ' 8' ' ' ASP . 0.0 OUTLIER -56.99 -26.44 60.16 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.012 -0.995 . . . . 25.07 111.192 -179.412 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 14' ' ' SER . . . . . 0.413 ' O ' ' HB ' ' D' ' 17' ' ' THR . 2.1 t -58.37 -58.22 9.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.871 -0.604 . . . . 42.74 110.883 179.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 15' ' ' MET . . . . . 0.574 ' SD ' " H3'" ' W' ' 7' ' ' ' DA' . 0.0 OUTLIER -71.84 -29.72 64.7 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.636 -0.256 . . . . 33.91 111.661 179.603 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 16' ' ' VAL . . . . . 1.073 HG22 ' HB1' ' B' ' 19' ' ' ALA 0.569 70.6 t -73.88 8.26 0.5 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.551 0 CA-C-O 121.811 0.815 . . . . 28.57 110.296 179.132 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 17' ' ' THR . . . . . 0.75 ' O ' ' HB2' ' D' ' 20' ' ' ASP . 98.2 m -112.3 -64.49 1.29 Allowed 'General case' 0 C--O 1.236 0.394 0 CA-C-O 122.996 1.379 . . . . 44.58 107.93 178.907 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 18' ' ' TYR . . . . . 0.614 ' HE2' HD21 ' D' ' 22' ' ' LEU 0.312 1.0 OUTLIER -51.42 -46.35 62.89 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-N 112.849 -1.978 . . . . 57.14 107.778 178.093 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' D' D ' 19' ' ' ALA . . . . . . . . . . . . . . . -52.04 -48.75 64.42 Favored 'General case' 0 C--O 1.226 -0.138 0 O-C-N 123.143 0.277 . . . . 35.21 110.299 178.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' ASP . . . . . 0.75 ' HB2' ' O ' ' D' ' 17' ' ' THR 0.363 0.9 OUTLIER -49.36 -54.76 15.64 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 122.214 1.006 . . . . 65.36 110.202 178.786 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' D' D ' 21' ' ' LYS . . . . . 0.541 ' O ' ' N ' ' D' ' 24' ' ' SER . 0.1 OUTLIER -48.89 -84.39 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 113.897 -1.501 . . . . 100.0 111.118 -179.695 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 22' ' ' LEU . . . . . 0.614 HD21 ' HE2' ' D' ' 18' ' ' TYR . 2.7 mp -31.12 -30.42 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 126.285 1.834 . . . . 31.07 113.225 -178.701 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 23' ' ' LYS . . . . . 0.759 ' O ' ' HG3' ' D' ' 27' ' ' LYS . 0.0 OUTLIER -72.86 -41.64 64.55 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.436 0.636 . . . . 40.89 109.936 179.288 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 24' ' ' SER . . . . . 0.669 ' O ' ' HB2' ' D' ' 27' ' ' LYS . 0.4 OUTLIER -70.53 -37.54 74.09 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.598 -0.841 . . . . 20.06 111.288 -179.369 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tp -49.47 -45.79 47.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.637 -0.711 . . . . 33.28 111.124 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' ILE . . . . . 0.556 HD13 ' CE1' ' D' ' 34' ' ' PHE . 10.1 mt -74.92 -26.77 19.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 122.166 0.984 . . . . 43.15 109.092 178.817 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 27' ' ' LYS . . . . . 0.759 ' HG3' ' O ' ' D' ' 23' ' ' LYS . 1.9 mtpp -63.5 -61.59 2.23 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.64 -0.709 . . . . 72.37 110.641 179.208 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 28' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.38 -50.77 35.3 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.493 0.923 . . . . 87.85 113.493 -179.121 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 29' ' ' GLU . . . . . 0.912 ' HG2' ' HE2' ' D' ' 83' ' ' LYS 0.577 3.9 tp10 -55.11 -23.11 19.15 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 119.158 -1.017 . . . . 92.42 113.015 -179.436 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 30' ' ' PHE . . . . . 0.955 ' HZ ' ' HB3' ' D' ' 80' ' ' PHE 0.355 0.0 OUTLIER -173.96 -119.25 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.729 0 C-N-CA 123.777 0.831 . . . . 28.94 112.67 178.903 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' D' D ' 31' ' ' SER . . . . . 0.494 ' O ' ' O ' ' D' ' 30' ' ' PHE . 1.4 p -30.73 177.89 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 116.355 1.983 . . . . 47.4 116.355 -177.713 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 32' ' ' ILE . . . . . 0.536 HG23 ' N ' ' D' ' 33' ' ' SER . 0.2 OUTLIER -153.41 -43.84 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 113.564 -1.653 . . . . 25.91 108.917 179.371 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 33' ' ' SER . . . . . 0.536 ' N ' HG23 ' D' ' 32' ' ' ILE . 2.9 p -53.85 -7.15 0.11 Allowed 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 121.344 0.592 . . . . 59.75 112.375 179.418 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 34' ' ' PHE . . . . . 0.556 ' CE1' HD13 ' D' ' 26' ' ' ILE . 1.2 t80 -84.79 -22.96 29.37 Favored 'General case' 0 C--O 1.246 0.87 0 N-CA-C 105.703 -1.962 . . . . 99.54 105.703 176.883 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 35' ' ' GLU . . . . . 0.555 ' CD ' ' HD2' ' D' ' 27' ' ' LYS . 20.0 tp10 -76.52 -19.43 57.96 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 106.126 -1.805 . . . . 86.84 106.126 178.145 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 36' ' ' GLU . . . . . 0.815 ' HA ' HG12 ' D' ' 39' ' ' VAL . 0.2 OUTLIER -108.43 -31.82 7.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.007 -0.997 . . . . 100.0 111.458 179.006 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 37' ' ' PHE . . . . . 1.153 ' HA ' HD23 ' D' ' 40' ' ' LEU . 0.1 OUTLIER -50.32 -28.35 7.73 Favored 'General case' 0 C--N 1.332 -0.176 0 O-C-N 123.636 0.585 . . . . 88.82 109.968 179.494 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 38' ' ' ALA . . . . . 0.442 ' HB1' ' CG1' ' B' ' 16' ' ' VAL . . . -85.57 -55.88 3.78 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.093 -0.503 . . . . 88.83 110.393 179.211 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 39' ' ' VAL . . . . . 0.815 HG12 ' HA ' ' D' ' 36' ' ' GLU . 2.7 p -61.54 -23.85 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 108.027 -1.101 . . . . 84.94 108.027 179.03 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 40' ' ' LEU . . . . . 1.153 HD23 ' HA ' ' D' ' 37' ' ' PHE . 0.3 OUTLIER -59.87 -31.4 69.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.339 -0.846 . . . . 100.0 109.799 179.189 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 41' ' ' THR . . . . . 0.505 HG21 ' OG1' ' B' ' 17' ' ' THR . 40.3 p -54.92 -34.33 63.05 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.283 -0.636 . . . . 100.0 109.283 179.538 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 42' ' ' TYR . . . . . . . . . . . . 0.445 63.5 t80 -95.37 -8.19 36.39 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 112.788 0.662 . . . . 85.8 112.788 179.073 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 43' ' ' ILE . . . . . 0.91 HD12 ' H ' ' D' ' 44' ' ' SER 1.327 1.4 tp -141.89 168.46 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 N-CA-C 115.349 1.611 . . . . 76.61 115.349 179.994 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 44' ' ' SER . . . . . 0.91 ' H ' HD12 ' D' ' 43' ' ' ILE . 96.2 p -110.99 -32.79 6.69 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 122.97 0.508 . . . . 100.0 111.247 179.804 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 45' ' ' GLU . . . . . 0.58 ' OE1' ' HA ' ' D' ' 45' ' ' GLU . 0.0 OUTLIER -51.74 -27.04 10.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.749 -0.66 . . . . 100.0 111.028 -179.055 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 46' ' ' ASN . . . . . 0.553 ' HB3' ' HG2' ' D' ' 36' ' ' GLU . 2.7 m120 -75.55 0.29 17.85 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.427 -0.806 . . . . 99.73 110.051 179.373 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 47' ' ' LYS . . . . . 0.67 ' HB2' ' O ' ' D' ' 44' ' ' SER . 0.0 OUTLIER -84.88 -26.15 27.52 Favored 'General case' 0 CA--C 1.486 -1.488 0 CA-C-O 122.336 1.065 . . . . 60.36 113.432 179.9 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 48' ' ' GLU . . . . . 0.678 ' CD ' ' HB2' ' D' ' 52' ' ' TYR . 0.4 OUTLIER -93.48 -45.41 7.78 Favored 'General case' 0 C--N 1.296 -1.722 2 O-C-N 113.375 -5.828 . . . . 96.93 112.762 179.371 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' D' D ' 49' ' ' LYS . . . . . 0.427 ' C ' ' O ' ' D' ' 48' ' ' GLU . 0.0 OUTLIER -44.95 -23.6 0.15 Allowed 'General case' 0 N--CA 1.538 3.94 0 O-C-N 118.171 -2.831 . . . . 100.0 107.407 176.693 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 50' ' ' GLU . . . . . 0.616 ' OE2' ' HD3' ' D' ' 54' ' ' LYS . 0.0 OUTLIER -66.64 -62.5 1.42 Allowed 'General case' 0 C--O 1.21 -0.999 0 O-C-N 124.282 0.989 . . . . 63.54 111.788 -179.462 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 51' ' ' TYR . . . . . . . . . . . . 0.613 3.2 m-85 -82.48 -30.64 29.81 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 114.715 1.376 . . . . 67.8 114.715 -178.656 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 52' ' ' TYR . . . . . 0.678 ' HB2' ' CD ' ' D' ' 48' ' ' GLU . 1.7 t80 -59.68 -13.02 8.09 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.393 -0.923 . . . . 66.43 109.69 179.107 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 53' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -126.48 -39.85 1.99 Allowed 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 113.389 0.885 . . . . 51.21 113.389 -179.397 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 54' ' ' LYS . . . . . 0.616 ' HD3' ' OE2' ' D' ' 50' ' ' GLU 0.527 43.2 tttt -52.4 -6.88 0.05 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.629 0.974 . . . . 39.38 113.629 -177.643 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 55' ' ' ASP . . . . . 0.638 ' O ' HG13 ' D' ' 56' ' ' ILE . 42.7 t0 -139.97 19.68 2.47 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 122.168 0.985 . . . . 80.55 111.223 179.208 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 56' ' ' ILE . . . . . 0.638 HG13 ' O ' ' D' ' 55' ' ' ASP . 2.0 mp . . . . . 0 CA--C 1.541 0.625 0 O-C-N 121.138 -0.976 . . . . 75.97 112.212 -178.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 67' ' ' VAL . . . . . 0.522 HG13 ' H ' ' D' ' 68' ' ' VAL . 7.3 p . . . . . 0 CA--C 1.604 3.033 0 N-CA-C 117.56 2.43 . . . . 54.64 117.56 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 68' ' ' VAL . . . . . 0.522 ' H ' HG13 ' D' ' 67' ' ' VAL . 2.5 t -78.39 -39.13 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.004 0 O-C-N 118.28 -2.763 . . . . 86.27 111.63 -177.451 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 69' ' ' LYS . . . . . 0.769 ' HD3' ' O ' ' D' ' 69' ' ' LYS . 0.0 OUTLIER -69.33 0.05 5.57 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 121.489 0.662 . . . . 98.36 109.343 178.156 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 70' ' ' ALA . . . . . 0.407 ' H ' ' C ' ' D' ' 68' ' ' VAL . . . -95.7 -52.9 3.91 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.588 -1.187 . . . . 83.65 109.722 178.756 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 71' ' ' VAL . . . . . 0.432 ' CG1' ' N ' ' D' ' 72' ' ' LYS . 0.3 OUTLIER -67.26 -37.59 79.39 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 N-CA-C 107.433 -1.321 . . . . 52.98 107.433 178.297 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 72' ' ' LYS . . . . . 0.432 ' N ' ' CG1' ' D' ' 71' ' ' VAL . 12.2 tptm -56.15 -43.03 77.89 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.079 -0.964 . . . . 59.51 109.227 179.156 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 73' ' ' ILE . . . . . 0.592 HG22 ' N ' ' D' ' 74' ' ' LEU . 0.1 OUTLIER -72.66 -48.13 47.55 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.409 0 CA-C-N 116.118 -0.492 . . . . 57.72 110.441 179.48 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 74' ' ' LEU . . . . . 0.694 HD22 ' O ' ' D' ' 74' ' ' LEU . 0.3 OUTLIER -58.49 -44.74 89.5 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 119.796 -0.762 . . . . 73.01 111.001 -179.693 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 75' ' ' SER . . . . . . . . . . . . . 10.9 t -62.1 -50.32 72.4 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 120.297 -0.561 . . . . 67.15 110.698 179.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -7.79 43.72 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 120.115 -0.634 . . . . 55.73 110.771 -179.935 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 77' ' ' GLU . . . . . 0.93 ' HG2' ' CZ ' ' D' ' 80' ' ' PHE . 0.1 OUTLIER -92.57 -14.25 28.54 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.687 -1.227 . . . . 100.0 107.687 179.117 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 78' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -90.89 -32.97 15.81 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 107.558 -1.275 . . . . 100.0 107.558 177.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 79' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -53.9 -36.89 63.2 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.185 -0.916 . . . . 100.0 109.024 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 80' ' ' PHE . . . . . 0.955 ' HB3' ' HZ ' ' D' ' 30' ' ' PHE 0.462 0.3 OUTLIER -89.52 -27.87 20.0 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 113.004 0.742 . . . . 100.0 113.004 179.188 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' D' D ' 81' ' ' ASP . . . . . . . . . . . . 0.558 3.4 m-20 -66.94 -19.43 65.72 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 114.789 1.403 . . . . 46.4 114.789 -179.061 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 82' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -93.51 -39.5 10.84 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 121.664 0.745 . . . . 100.0 110.605 179.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 83' ' ' LYS . . . . . 0.912 ' HE2' ' HG2' ' D' ' 29' ' ' GLU . 37.4 tttp -59.81 -25.75 65.22 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 114.671 -1.149 . . . . 57.65 112.683 179.15 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 84' ' ' ARG . . . . . 0.514 ' HG2' ' CD2' ' D' ' 87' ' ' HIS 0.442 0.9 OUTLIER -95.63 -37.58 10.76 Favored 'General case' 0 C--N 1.352 0.682 0 N-CA-C 112.672 0.619 . . . . 59.76 112.672 179.398 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' D' D ' 85' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -64.15 -34.04 77.16 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 104.649 -2.352 . . . . 41.11 104.649 177.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 86' ' ' GLU . . . . . 1.065 ' HG3' HH12 ' D' ' 90' ' ' ARG . 15.5 pt-20 -70.88 -48.16 55.31 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.375 -0.83 . . . . 100.0 110.649 179.307 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 87' ' ' HIS . . . . . 1.124 ' HA ' ' HD3' ' D' ' 90' ' ' ARG 0.422 0.0 OUTLIER -65.09 -12.76 54.32 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 113.222 0.823 . . . . 100.0 113.222 -179.185 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' D' D ' 88' ' ' ASP . . . . . 0.512 ' O ' ' HB ' ' D' ' 92' ' ' VAL 0.642 10.9 m-20 -63.67 -1.34 1.26 Allowed 'General case' 0 C--O 1.238 0.47 0 CA-C-O 121.939 0.876 . . . . 99.05 111.856 179.738 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 89' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -111.26 -22.69 11.25 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.326 -1.306 . . . . 100.0 108.287 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 90' ' ' ARG . . . . . 1.124 ' HD3' ' HA ' ' D' ' 87' ' ' HIS 0.342 0.0 OUTLIER -88.78 -66.06 0.96 Allowed 'General case' 0 CA--C 1.509 -0.632 0 C-N-CA 119.752 -0.779 . . . . 100.0 109.834 178.44 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' D' D ' 91' ' ' THR . . . . . 0.602 ' O ' HG22 ' D' ' 94' ' ' ILE 0.295 90.4 m -56.81 -14.26 3.27 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 119.79 -0.764 . . . . 88.98 109.571 178.073 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 92' ' ' VAL . . . . . 0.984 HG13 HD23 ' D' ' 95' ' ' LEU 0.677 1.0 OUTLIER -56.35 5.99 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 123.404 0.682 . . . . 81.89 112.498 178.302 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' D' D ' 93' ' ' LEU . . . . . 0.602 ' O ' ' N ' ' D' ' 97' ' ' ASN . 0.6 OUTLIER -78.56 -38.19 40.86 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 104.751 -2.314 . . . . 59.0 104.751 176.631 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 94' ' ' ILE . . . . . 0.602 HG22 ' O ' ' D' ' 91' ' ' THR . 10.9 tt -63.46 -45.33 98.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-N 113.473 -1.694 . . . . 75.81 110.679 178.612 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 95' ' ' LEU . . . . . 0.984 HD23 HG13 ' D' ' 92' ' ' VAL . 0.1 OUTLIER -52.68 -53.57 45.58 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 108.256 -1.016 . . . . 66.41 108.256 179.89 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 96' ' ' VAL . . . . . 0.876 HG12 ' HG3' ' D' ' 100' ' ' GLN . 82.3 t -73.16 -37.51 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.3 0 N-CA-C 107.334 -1.358 . . . . 79.13 107.334 177.883 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 97' ' ' ASN . . . . . 0.64 ' OD1' ' NE2' ' D' ' 100' ' ' GLN 0.49 2.5 m120 -56.02 -41.95 75.73 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.11 0.411 . . . . 100.0 112.11 -179.865 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 98' ' ' ALA . . . . . 0.624 ' O ' ' HG2' ' D' ' 102' ' ' LYS . . . -65.55 -63.75 1.02 Allowed 'General case' 0 C--O 1.234 0.252 0 N-CA-C 107.801 -1.185 . . . . 95.57 107.801 178.349 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 99' ' ' GLN . . . . . 0.562 ' OE1' HD12 ' D' ' 95' ' ' LEU 0.463 10.1 tt0 -56.87 -25.88 57.55 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.183 1.393 . . . . 76.08 111.289 179.298 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 100' ' ' GLN . . . . . 0.876 ' HG3' HG12 ' D' ' 96' ' ' VAL . 7.9 mt-30 -51.2 -127.42 0.0 OUTLIER 'General case' 0 C--O 1.234 0.268 0 N-CA-C 113.693 0.997 . . . . 100.0 113.693 -178.817 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 101' ' ' ARG . . . . . 0.973 ' HA ' ' HB ' ' D' ' 104' ' ' ILE . 0.5 OUTLIER -44.99 -17.82 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 114.56 -1.2 . . . . 100.0 113.079 -179.036 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 102' ' ' LYS . . . . . 1.171 ' HG3' ' NZ ' ' D' ' 5' ' ' LYS 0.644 0.3 OUTLIER -68.7 -55.8 10.22 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 119.825 -0.75 . . . . 37.05 109.917 179.474 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' D' D ' 103' ' ' LYS . . . . . 0.501 ' HA ' ' OG ' ' D' ' 106' ' ' SER . 4.8 tttt -67.45 -35.31 78.95 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 103.723 -2.695 . . . . 61.54 103.723 176.983 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 104' ' ' ILE . . . . . 0.973 ' HB ' ' HA ' ' D' ' 101' ' ' ARG . 0.0 OUTLIER -61.26 -22.03 26.39 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 N-CA-C 107.519 -1.289 . . . . 37.57 107.519 177.206 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 105' ' ' GLU . . . . . 0.866 ' CG ' HG22 ' D' ' 4' ' ' THR . 3.2 tp10 -74.26 -36.39 63.85 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 105.701 -1.962 . . . . 75.76 105.701 177.146 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 106' ' ' SER . . . . . 0.509 ' O ' ' N ' ' D' ' 109' ' ' SER . 0.3 OUTLIER -70.77 -45.9 63.92 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.012 -0.994 . . . . 41.8 110.363 178.475 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 107' ' ' LEU . . . . . 1.15 HD22 ' HB3' ' D' ' 110' ' ' ARG . 0.2 OUTLIER -55.18 -23.17 20.33 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.733 -0.84 . . . . 35.79 108.733 178.706 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 108' ' ' LEU . . . . . 0.776 ' HB3' ' O ' ' D' ' 105' ' ' GLU . 1.2 tp -58.1 -32.32 67.98 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 104.99 -2.226 . . . . 31.0 104.99 178.208 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 109' ' ' SER . . . . . 0.509 ' N ' ' O ' ' D' ' 106' ' ' SER . 0.7 OUTLIER -73.67 -30.9 63.17 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 113.32 -1.764 . . . . 96.1 108.708 178.049 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 110' ' ' ARG . . . . . 1.15 ' HB3' HD22 ' D' ' 107' ' ' LEU . 6.9 ttt85 -56.43 -53.48 56.88 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.377 -1.342 . . . . 60.43 107.377 178.397 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 111' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.235 0.323 0 N-CA-C 107.204 -1.406 . . . . 64.68 107.204 176.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' ALA . . . . . 0.445 ' O ' ' O ' ' B' ' 3' ' ' ILE . . . . . . . . 0 C--O 1.238 0.463 0 N-CA-C 112.379 0.511 . . . . 25.77 112.379 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ILE . . . . . 0.705 HD12 ' N ' ' B' ' 4' ' ' THR . 0.6 OUTLIER -38.43 178.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 115.241 1.571 . . . . 58.42 115.241 -178.959 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 4' ' ' THR . . . . . 0.705 ' N ' HD12 ' B' ' 3' ' ' ILE . 0.2 OUTLIER -159.76 -66.17 0.07 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.6 -1.63 . . . . 91.74 106.6 179.182 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LYS . . . . . 0.631 ' O ' ' N ' ' B' ' 7' ' ' ASN . 16.4 mmtp -116.76 6.84 13.29 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 114.986 -1.007 . . . . 81.67 112.394 178.93 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ILE . . . . . 0.511 ' CG1' ' HB ' ' B' ' 3' ' ' ILE 0.305 1.3 pp -62.67 78.82 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.489 0 C-N-CA 118.333 -1.347 . . . . 41.23 108.003 179.155 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ASN . . . . . 0.631 ' N ' ' O ' ' B' ' 5' ' ' LYS . 0.3 OUTLIER -164.26 54.57 0.15 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.878 -1.055 . . . . 54.77 108.973 -178.34 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ASP . . . . . 0.597 ' HB3' ' HG3' ' D' ' 77' ' ' GLU 0.416 1.1 p-10 -55.14 130.38 41.77 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 114.485 -1.234 . . . . 100.0 109.601 179.322 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 9' ' ' CYS . . . . . 0.689 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 9.7 p -134.38 -169.1 2.26 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.939 1.296 . . . . 94.2 107.81 -0.117 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 10' ' ' PHE . . . . . 0.486 ' N ' ' CD1' ' B' ' 10' ' ' PHE 0.351 0.0 OUTLIER -80.37 -89.38 0.06 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.872 1.064 . . . . 80.18 113.872 -177.923 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 11' ' ' GLU . . . . . 0.774 ' HG2' ' OP1' ' K' ' 9' ' ' ' DA' . 0.0 OUTLIER -42.42 -58.48 2.21 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.385 0.883 . . . . 91.67 113.385 -178.757 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 12' ' ' LEU . . . . . 0.691 ' O ' HG23 ' B' ' 16' ' ' VAL . 0.0 OUTLIER -57.85 -39.28 77.35 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 121.265 -0.897 . . . . 41.37 110.495 179.565 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 13' ' ' LEU . . . . . 0.689 ' HB2' ' O ' ' B' ' 9' ' ' CYS 1.163 4.0 mt -49.61 -89.43 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 116.646 2.091 . . . . 76.13 116.646 -179.713 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 14' ' ' SER . . . . . 0.443 ' O ' ' HB3' ' B' ' 18' ' ' TYR 0.265 1.8 t -47.49 -31.28 4.1 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.964 1.098 . . . . 62.47 113.964 -178.532 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 15' ' ' MET . . . . . 0.465 ' SD ' ' HG2' ' D' ' 15' ' ' MET . 13.4 tpp -55.18 -61.31 2.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.355 0.598 . . . . 46.47 110.092 -179.983 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 16' ' ' VAL . . . . . 0.691 HG23 ' O ' ' B' ' 12' ' ' LEU . 21.1 t -52.56 -49.71 43.41 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.899 0 CA-C-N 115.243 -0.89 . . . . 64.79 110.658 179.377 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' THR . . . . . 0.656 HG22 ' N ' ' B' ' 18' ' ' TYR . 1.2 m -62.24 -53.83 49.6 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.71 0.766 . . . . 36.12 111.335 179.732 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' TYR . . . . . 0.656 ' N ' HG22 ' B' ' 17' ' ' THR . 0.1 OUTLIER -57.54 -29.36 64.31 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.231 -1.026 . . . . 36.96 108.231 178.087 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ALA . . . . . 1.073 ' HB1' HG22 ' D' ' 16' ' ' VAL . . . -81.49 -50.17 9.73 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.757 -0.59 . . . . 58.56 109.842 179.037 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ASP . . . . . 0.526 ' OD2' HG12 ' B' ' 16' ' ' VAL . 2.5 m-20 -57.39 -10.11 1.27 Allowed 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.719 -0.673 . . . . 85.92 110.436 179.522 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 21' ' ' LYS . . . . . 0.586 ' HD2' ' O ' ' B' ' 21' ' ' LYS . 1.9 tptm -84.38 -61.82 1.71 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.111 0.964 . . . . 92.23 113.44 -179.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' LEU . . . . . 0.817 HD22 ' NE2' ' B' ' 87' ' ' HIS 0.971 0.3 OUTLIER -72.45 -13.32 61.41 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.302 0.853 . . . . 48.28 113.302 179.767 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 23' ' ' LYS . . . . . 0.867 ' HZ3' ' HA ' ' B' ' 35' ' ' GLU 0.312 1.7 mtpp -66.43 -49.89 65.22 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.081 -1.081 . . . . 56.68 108.081 177.854 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 24' ' ' SER . . . . . 0.428 ' OG ' ' O ' ' B' ' 21' ' ' LYS 0.268 33.1 p -74.96 -41.46 59.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 114.142 -1.39 . . . . 45.21 111.429 179.588 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 25' ' ' LEU . . . . . 0.789 HD13 ' HE1' ' B' ' 87' ' ' HIS . 0.6 OUTLIER -51.65 -45.14 63.24 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 120.919 0.39 . . . . 45.63 111.212 -179.256 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ILE . . . . . 0.517 ' HA ' ' HE1' ' B' ' 30' ' ' PHE . 1.2 mp -75.6 -24.38 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-O 122.059 0.933 . . . . 31.84 108.971 179.483 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LYS . . . . . 0.708 ' HD2' ' HB2' ' B' ' 35' ' ' GLU . 2.4 tttp -62.61 -56.55 16.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.848 -0.614 . . . . 100.0 112.561 -179.505 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -52.48 43.22 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.14 0.422 . . . . 49.33 112.14 -179.966 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLU . . . . . 0.602 ' HG2' ' NZ ' ' B' ' 83' ' ' LYS . 4.1 tp10 -57.33 -20.32 28.12 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.608 0.966 . . . . 93.7 113.608 -179.007 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' PHE . . . . . 0.524 ' O ' ' O ' ' B' ' 31' ' ' SER 0.69 0.0 OUTLIER -157.46 -130.28 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.619 1.341 . . . . 66.7 114.619 179.372 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 31' ' ' SER . . . . . 0.524 ' O ' ' O ' ' B' ' 30' ' ' PHE . 12.4 p -49.49 -143.94 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 113.555 0.946 . . . . 67.72 113.555 -178.281 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ILE . . . . . 0.616 HG22 ' HG3' ' B' ' 27' ' ' LYS . 0.0 OUTLIER -173.16 -17.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.819 0 CA-C-N 114.962 -1.017 . . . . 41.92 110.8 179.739 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.26 93.1 p -54.34 -15.25 1.51 Allowed 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.197 -0.601 . . . . 65.86 111.46 179.243 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 34' ' ' PHE . . . . . 0.612 ' CE2' HD22 ' D' ' 13' ' ' LEU . 1.0 OUTLIER -64.83 -46.01 83.72 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 112.848 0.684 . . . . 100.0 112.848 179.727 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 35' ' ' GLU . . . . . 0.867 ' HA ' ' HZ3' ' B' ' 23' ' ' LYS . 32.8 tp10 -65.86 -21.29 66.45 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.238 -1.393 . . . . 92.39 107.238 178.824 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 36' ' ' GLU . . . . . 0.74 ' OE1' ' HB3' ' B' ' 35' ' ' GLU . 6.1 mm-40 -88.34 -60.12 2.05 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 114.501 -1.227 . . . . 61.85 111.61 -179.421 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' PHE . . . . . 0.76 ' O ' ' HB3' ' B' ' 40' ' ' LEU . 0.7 OUTLIER -49.54 -46.96 49.3 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.722 0.638 . . . . 64.45 111.375 -179.737 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ALA . . . . . 0.876 ' HB1' HG12 ' D' ' 16' ' ' VAL . . . -52.16 -49.58 63.51 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.346 -0.388 . . . . 73.66 111.589 -179.524 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 2.5 p -77.13 -32.11 19.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.229 -0.588 . . . . 69.55 110.237 179.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' LEU . . . . . 0.955 ' HA ' HD21 ' B' ' 46' ' ' ASN . 1.5 tm? -36.62 -34.99 0.08 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.293 1.437 . . . . 63.28 113.713 -179.412 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 41' ' ' THR . . . . . 0.502 ' O ' ' OG1' ' B' ' 41' ' ' THR . 0.1 OUTLIER -67.61 11.05 0.15 Allowed 'General case' 0 C--N 1.329 -0.31 0 O-C-N 122.067 -0.395 . . . . 83.79 111.114 179.955 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 42' ' ' TYR . . . . . 0.616 ' O ' HG13 ' B' ' 43' ' ' ILE . 7.0 t80 -139.82 -23.37 0.86 Allowed 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.257 0.466 . . . . 74.47 112.257 -179.171 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ILE . . . . . 0.616 HG13 ' O ' ' B' ' 42' ' ' TYR 0.698 9.6 mt -132.52 143.25 40.35 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 113.474 0.916 . . . . 66.49 113.474 179.431 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 44' ' ' SER . . . . . 0.612 ' O ' ' HG3' ' B' ' 47' ' ' LYS . 9.2 p -96.85 -2.44 43.98 Favored 'General case' 0 CA--C 1.484 -1.561 0 N-CA-C 115.165 1.543 . . . . 50.11 115.165 -178.346 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLU . . . . . 0.71 ' OE1' ' HB2' ' B' ' 48' ' ' GLU . 0.8 OUTLIER -100.12 -13.34 19.02 Favored 'General case' 0 C--N 1.301 -1.506 2 O-C-N 113.913 -5.492 . . . . 100.0 113.213 -179.839 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ASN . . . . . 0.955 HD21 ' HA ' ' B' ' 40' ' ' LEU . 28.0 p30 -57.32 -21.31 34.28 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 107.047 -1.464 . . . . 48.82 107.047 177.22 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 47' ' ' LYS . . . . . 0.768 ' NZ ' HD21 ' B' ' 40' ' ' LEU . 0.0 OUTLIER -67.94 -17.89 64.59 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 112.68 -2.055 . . . . 66.39 110.985 179.91 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 48' ' ' GLU . . . . . 0.845 ' HA ' ' OE2' ' B' ' 48' ' ' GLU . 0.0 OUTLIER -67.08 -74.82 0.1 Allowed 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 115.461 -2.495 . . . . 100.0 112.459 -176.216 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 49' ' ' LYS . . . . . 0.764 ' HB2' HD23 ' B' ' 53' ' ' LEU . 0.0 OUTLIER -62.58 -12.22 21.46 Favored 'General case' 0 N--CA 1.5 2.073 1 O-C-N 116.136 -4.102 . . . . 60.8 107.98 -178.685 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 50' ' ' GLU . . . . . 0.616 ' CB ' ' HA ' ' B' ' 47' ' ' LYS . 0.0 OUTLIER -49.15 -63.31 1.14 Allowed 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 114.252 -1.34 . . . . 99.43 108.689 178.438 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 51' ' ' TYR . . . . . 0.447 ' CE2' ' HB3' ' B' ' 54' ' ' LYS 0.685 0.2 OUTLIER -79.0 -24.92 43.42 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 119.592 -0.843 . . . . 58.78 112.017 178.692 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 52' ' ' TYR . . . . . 0.619 ' HB3' ' HA ' ' B' ' 49' ' ' LYS . 2.3 t80 -64.23 -21.33 66.54 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.557 0.694 . . . . 94.43 109.514 178.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' LEU . . . . . 0.764 HD23 ' HB2' ' B' ' 49' ' ' LYS . 4.0 mm? -106.38 -43.43 4.77 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.312 -0.858 . . . . 77.74 112.086 -179.878 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' LYS . . . . . 0.447 ' HB3' ' CE2' ' B' ' 51' ' ' TYR 0.333 0.1 OUTLIER -57.89 6.84 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 114.223 1.194 . . . . 89.1 114.223 -179.081 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ASP . . . . . 0.454 ' H ' ' C ' ' B' ' 53' ' ' LEU . 25.1 t70 -138.52 -48.58 0.52 Allowed 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.558 -0.457 . . . . 91.09 110.616 178.402 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.234 0.253 0 CA-C-N 116.221 -0.445 . . . . 100.0 110.532 179.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 115.466 1.654 . . . . 66.72 115.466 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 48.2 t -76.29 -57.32 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 119.117 -2.239 . . . . 100.0 109.116 -179.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' B' ' 69' ' ' LYS . 0.0 OUTLIER -64.99 -17.27 64.28 Favored 'General case' 0 C--O 1.253 1.262 0 C-N-CA 119.956 -0.698 . . . . 81.79 110.121 179.781 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.67 -76.77 0.05 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.397 -0.594 . . . . 58.37 109.397 179.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 43.2 t -55.1 -22.42 10.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.92 -0.582 . . . . 49.4 111.873 179.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 4.4 tptm -71.0 -45.55 63.78 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 107.803 -1.184 . . . . 100.0 107.803 178.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ILE . . . . . 0.653 HG22 ' N ' ' B' ' 74' ' ' LEU . 1.1 mp -70.12 -44.92 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 115.103 -0.953 . . . . 42.17 110.292 179.211 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 74' ' ' LEU . . . . . 0.653 ' N ' HG22 ' B' ' 73' ' ' ILE . 1.2 tm? -55.08 -47.08 75.37 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 113.621 0.971 . . . . 44.9 113.621 -178.632 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 75' ' ' SER . . . . . 0.598 ' O ' ' HB3' ' B' ' 78' ' ' ASP 0.507 26.3 t -62.14 -34.41 76.32 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 113.747 1.017 . . . . 48.68 113.747 -179.219 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 76' ' ' GLN . . . . . 0.645 ' HA ' ' HB2' ' B' ' 79' ' ' TYR . 0.1 OUTLIER -80.2 -33.04 38.52 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.431 -0.951 . . . . 83.09 108.431 178.372 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 77' ' ' GLU . . . . . 0.705 ' O ' ' HB2' ' B' ' 81' ' ' ASP . 0.1 OUTLIER -60.33 -23.86 64.57 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 107.137 -1.431 . . . . 100.0 107.137 178.559 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ASP . . . . . 0.598 ' HB3' ' O ' ' B' ' 75' ' ' SER . 6.6 t0 -81.82 -35.23 29.69 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 113.896 -1.502 . . . . 100.0 108.164 177.384 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' TYR . . . . . 0.645 ' HB2' ' HA ' ' B' ' 76' ' ' GLN . 0.0 OUTLIER -52.94 -54.62 32.26 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 114.957 -1.019 . . . . 78.89 111.069 -179.929 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 80' ' ' PHE . . . . . 0.505 ' HB3' ' CZ ' ' B' ' 30' ' ' PHE . 0.0 OUTLIER -81.97 -15.03 55.12 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 121.699 0.761 . . . . 49.76 110.215 -179.918 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ASP . . . . . 0.705 ' HB2' ' O ' ' B' ' 77' ' ' GLU . 0.2 OUTLIER -68.38 -26.55 65.63 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.981 -1.009 . . . . 74.3 111.477 -178.769 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 82' ' ' LYS . . . . . 0.583 ' O ' ' HB2' ' B' ' 86' ' ' GLU . 12.2 ttmm -85.07 -40.78 16.42 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.08 -0.964 . . . . 100.0 110.589 179.631 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' LYS . . . . . 0.602 ' NZ ' ' HG2' ' B' ' 29' ' ' GLU . 10.8 mttt -71.76 6.46 1.97 Allowed 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.393 0.886 . . . . 38.91 113.393 -179.477 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ARG . . . . . 0.45 ' O ' ' HB2' ' B' ' 88' ' ' ASP . 1.7 tmt_? -104.89 -49.07 3.58 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 108.167 -1.049 . . . . 90.06 108.167 179.139 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 50.6 m-20 -69.26 -28.48 66.35 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 107.917 -1.142 . . . . 100.0 107.917 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' GLU . . . . . 0.583 ' HB2' ' O ' ' B' ' 82' ' ' LYS . 16.1 tt0 -77.56 -49.72 14.07 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 113.972 -1.467 . . . . 77.36 109.765 179.503 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' HIS . . . . . 0.817 ' NE2' HD22 ' B' ' 22' ' ' LEU 0.744 0.0 OUTLIER -70.17 -14.11 62.49 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.283 -0.871 . . . . 47.85 113.177 -179.007 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' B' ' 84' ' ' ARG . 0.4 OUTLIER -73.44 -7.81 53.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.1 -0.955 . . . . 61.73 112.143 179.597 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 89' ' ' GLU . . . . . 0.558 ' C ' ' HG3' ' B' ' 90' ' ' ARG . 0.2 OUTLIER -82.45 -11.73 58.32 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.124 0.488 . . . . 100.0 110.728 179.688 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 90' ' ' ARG . . . . . 0.645 ' HB2' HH11 ' B' ' 90' ' ' ARG . 0.1 OUTLIER -140.3 24.51 2.3 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 112.954 0.724 . . . . 62.29 112.954 -178.075 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 91' ' ' THR . . . . . . . . . . . . 0.347 2.9 t -99.56 5.42 46.02 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 122.598 1.19 . . . . 52.4 107.905 177.434 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 92' ' ' VAL . . . . . 0.922 HG22 HG23 ' B' ' 96' ' ' VAL . 2.6 p -69.82 3.04 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 113.574 -1.648 . . . . 64.43 111.907 179.986 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 93' ' ' LEU . . . . . 0.438 ' O ' ' HB3' ' B' ' 97' ' ' ASN . 0.2 OUTLIER -50.09 -51.0 46.33 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.268 0.556 . . . . 56.65 111.026 179.945 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 94' ' ' ILE . . . . . 0.862 HG23 ' H ' ' B' ' 95' ' ' LEU . 0.6 OUTLIER -49.57 -88.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 114.868 1.433 . . . . 61.0 114.868 -178.92 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 95' ' ' LEU . . . . . 0.862 ' H ' HG23 ' B' ' 94' ' ' ILE . 0.0 OUTLIER -41.24 -40.57 1.65 Allowed 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 124.68 1.192 . . . . 72.26 111.839 -178.355 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 96' ' ' VAL . . . . . 0.922 HG23 HG22 ' B' ' 92' ' ' VAL 0.268 2.6 t -68.38 -61.56 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 O-C-N 125.202 1.564 . . . . 65.51 110.197 179.674 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ASN . . . . . 0.637 ' N ' HG12 ' B' ' 96' ' ' VAL . 1.6 t-20 -56.71 -26.67 57.45 Favored 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 106.378 -1.712 . . . . 72.48 106.378 177.306 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ALA . . . . . 0.991 ' HA ' ' HB2' ' B' ' 101' ' ' ARG . . . -79.6 -34.66 40.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.435 -1.257 . . . . 75.86 108.035 178.534 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 99' ' ' GLN . . . . . 0.659 ' N ' ' O ' ' B' ' 95' ' ' LEU . 4.3 tt0 -67.78 -52.66 34.61 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 105.238 -2.134 . . . . 59.7 105.238 178.23 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 100' ' ' GLN . . . . . 0.421 ' HA ' ' HB3' ' B' ' 103' ' ' LYS . 1.4 mp0 -66.73 -19.0 65.66 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 105.852 -1.907 . . . . 90.63 105.852 178.117 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 101' ' ' ARG . . . . . 0.991 ' HB2' ' HA ' ' B' ' 98' ' ' ALA . 0.4 OUTLIER -65.51 -53.77 37.71 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 124.811 2.244 . . . . 77.9 108.421 178.208 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 102' ' ' LYS . . . . . 0.928 ' HG3' ' HB2' ' B' ' 106' ' ' SER . 4.1 tppp? -61.8 -41.95 98.4 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 119.046 -2.284 . . . . 78.58 107.802 177.105 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 103' ' ' LYS . . . . . 0.547 ' HG3' ' O ' ' B' ' 103' ' ' LYS . 0.0 OUTLIER -56.65 -19.97 19.01 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.175 -1.046 . . . . 85.73 108.175 178.791 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ILE . . . . . 0.592 ' O ' ' HB3' ' B' ' 108' ' ' LEU . 0.2 OUTLIER -74.97 -38.27 42.85 Favored 'Isoleucine or valine' 0 C--N 1.357 0.92 0 C-N-CA 115.674 -2.41 . . . . 32.57 109.964 179.646 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 105' ' ' GLU . . . . . 0.888 ' HA ' HD22 ' B' ' 108' ' ' LEU . 1.0 OUTLIER -104.51 -33.05 8.69 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 119.939 -0.705 . . . . 67.66 111.061 -179.432 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 106' ' ' SER . . . . . 0.928 ' HB2' ' HG3' ' B' ' 102' ' ' LYS . 13.7 t -51.2 -74.5 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.146 0.795 . . . . 68.61 113.146 -179.047 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 107' ' ' LEU . . . . . 0.599 ' O ' ' N ' ' B' ' 110' ' ' ARG . 0.7 OUTLIER -59.35 -52.84 63.92 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 107.713 -1.217 . . . . 37.56 107.713 179.27 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 108' ' ' LEU . . . . . 0.888 HD22 ' HA ' ' B' ' 105' ' ' GLU . 0.2 OUTLIER -48.78 -28.85 3.95 Favored 'General case' 0 CA--C 1.462 -2.409 0 O-C-N 124.868 1.355 . . . . 78.93 110.116 178.133 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 109' ' ' SER . . . . . 0.49 ' O ' ' HB3' ' B' ' 113' ' ' LYS . 0.2 OUTLIER -80.35 -12.9 59.54 Favored 'General case' 0 N--CA 1.419 -2.017 1 C-N-CA 110.974 -4.29 . . . . 36.75 108.543 -179.439 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 110' ' ' ARG . . . . . 0.905 ' HA ' ' HB3' ' B' ' 113' ' ' LYS . 0.0 OUTLIER -84.62 -21.9 30.16 Favored 'General case' 0 N--CA 1.495 1.803 1 N-CA-C 99.695 -4.187 . . . . 57.01 99.695 169.476 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 111' ' ' VAL . . . . . 0.862 HG13 ' HA ' ' B' ' 108' ' ' LEU 0.453 4.1 m -60.61 -68.64 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 N-CA-C 108.672 -0.862 . . . . 43.37 108.672 179.68 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 112' ' ' ASN . . . . . 0.427 ' OD1' HG23 ' B' ' 111' ' ' VAL . 1.9 m-20 -66.4 -6.94 16.18 Favored 'General case' 0 C--O 1.224 -0.255 0 N-CA-C 108.313 -0.995 . . . . 78.8 108.313 177.351 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 113' ' ' LYS . . . . . 0.905 ' HB3' ' HA ' ' B' ' 110' ' ' ARG . 0.0 OUTLIER -81.97 -66.46 0.89 Allowed 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 115.736 -0.665 . . . . 100.0 110.171 178.525 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 114' ' ' ARG . . . . . 0.77 ' NH1' ' HE2' ' B' ' 113' ' ' LYS . 0.6 OUTLIER -44.38 -37.37 3.33 Favored 'General case' 0 C--O 1.243 0.751 0 O-C-N 124.281 0.988 . . . . 59.93 108.44 -179.885 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 115' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -62.24 -16.5 16.3 Favored 'Isoleucine or valine' 0 C--N 1.374 1.655 0 C-N-CA 117.375 -1.73 . . . . 63.51 109.342 -176.578 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 116' ' ' THR . . . . . 0.576 HG23 ' O ' ' B' ' 113' ' ' LYS . 0.7 OUTLIER . . . . . 0 C--N 1.327 -0.41 0 CA-C-N 115.073 -0.967 . . . . 87.66 110.679 179.126 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 200' ' ' ' CA' . . . . . 0.825 'CA ' ' OE2' ' D' ' 11' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' W' W ' 3' ' ' ' DA' . . . . . 1.267 ' N1 ' ' N6 ' ' K' ' 7' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.502 -2.563 3 OP1-P-OP2 102.893 -11.138 . . . . 61.26 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' W' W ' 4' ' ' ' DT' . . . . . 0.835 H2'' ' N7 ' ' W' ' 5' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.541 3.796 0 C4'-C3'-O3' 117.692 3.36 . . . . 39.44 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' W' W ' 5' ' ' ' DA' . . . . . 1.406 ' H61' ' N6 ' ' K' ' 5' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.541 3.692 1 O4'-C1'-C2' 110.501 4.001 . . . . 42.95 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' W' W ' 6' ' ' ' DT' . . . . . 0.976 " H5'" H2'' ' W' ' 5' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.545 4.234 2 C5'-C4'-C3' 124.111 6.274 . . . . 40.0 . . . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' W' W ' 7' ' ' ' DA' . . . . . 1.071 H2'' ' OP2' ' W' ' 8' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.541 3.763 4 P-O3'-C3' 129.524 8.187 . . . . 35.51 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' W' W ' 8' ' ' ' DT' . . . . . 1.071 ' OP2' H2'' ' W' ' 7' ' ' ' DA' . . . . . . . . 2 C5'--C4' 1.595 10.472 3 O4'-C4'-C3' 94.93 -10.67 . . . . 32.37 . . . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' W' W ' 9' ' ' ' DA' . . . . . 1.107 ' OP2' ' C8 ' ' W' ' 9' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.487 3.7 4 P-O5'-C5' 113.65 -4.532 . . . . 59.77 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' K' K ' 3' ' ' ' DA' . . . . . 0.75 H2'' ' OP2' ' K' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.473 2.464 3 OP1-P-OP2 143.715 16.077 . . . . 36.69 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' K' K ' 4' ' ' ' DT' . . . . . 0.848 H2'' ' N7 ' ' K' ' 5' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.538 3.396 0 C4'-C3'-O3' 117.602 3.319 . . . . 39.44 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' K' K ' 5' ' ' ' DA' . . . . . 1.406 ' N6 ' ' H61' ' W' ' 5' ' ' ' DA' . . . . . . . . 1 C5'--C4' 1.549 4.691 1 P-O3'-C3' 125.101 4.501 . . . . 42.95 . . . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' K' K ' 6' ' ' ' DT' . . . . . 0.745 " C5'" H2'' ' K' ' 5' ' ' ' DA' . . . . . . . . 3 C5'--C4' 1.563 6.479 1 O4'-C4'-C3' 99.823 -5.777 . . . . 40.0 . . . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' K' K ' 7' ' ' ' DA' . . . . . 1.267 ' N6 ' ' N1 ' ' W' ' 3' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.542 3.922 4 O4'-C4'-C3' 99.265 -6.335 . . . . 35.51 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' K' K ' 8' ' ' ' DT' . . . . . 1.124 ' OP2' H2'' ' K' ' 7' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.621 1 O4'-C4'-C3' 98.805 -6.795 . . . . 32.37 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' K' K ' 9' ' ' ' DA' . . . . . 0.957 ' OP2' H2'' ' K' ' 8' ' ' ' DT' . . . . . . . . 1 C5'--C4' 1.569 7.285 1 O4'-C1'-C2' 110.857 4.325 . . . . 39.42 . . . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.815 0 CA-C-O 121.925 0.869 . . . . 29.94 112.652 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' ILE . . . . . 1.061 HG12 HD13 ' D' ' 6' ' ' ILE . 5.3 mp -45.65 -178.06 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 117.399 2.37 . . . . 60.47 117.399 -177.537 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' THR . . . . . 0.922 ' N ' HG22 ' D' ' 3' ' ' ILE . 0.2 OUTLIER -130.16 -114.92 0.24 Allowed 'General case' 0 N--CA 1.473 0.714 1 O-C-N 129.378 4.174 . . . . 78.24 108.949 -179.089 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' LYS . . . . . 1.171 ' NZ ' ' HG3' ' D' ' 102' ' ' LYS . 13.9 ttmt -93.22 73.97 4.61 Favored 'General case' 0 C--N 1.32 -0.704 0 O-C-N 125.688 1.868 . . . . 81.0 106.013 177.128 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' ILE . . . . . 1.061 HD13 HG12 ' D' ' 3' ' ' ILE . 3.3 pt -101.26 -1.23 9.92 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 119.127 -1.029 . . . . 54.01 113.417 -177.281 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -64.38 139.22 58.74 Favored 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 106.116 -1.809 . . . . 100.0 106.116 177.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' ASP . . . . . 1.594 ' HB2' ' CD2' ' D' ' 13' ' ' LEU . 4.4 m-20 -44.68 163.78 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 114.794 1.405 . . . . 46.17 114.794 -173.27 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' CYS . . . . . 0.817 ' O ' ' HB2' ' D' ' 13' ' ' LEU . 0.1 OUTLIER -20.07 136.33 0.01 OUTLIER 'General case' 0 CA--C 1.497 -1.074 0 C-N-CA 126.997 2.119 . . . . 49.86 110.444 -178.102 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' PHE . . . . . 0.657 ' CD1' ' N ' ' D' ' 10' ' ' PHE . 0.1 OUTLIER -86.25 -59.62 2.23 Favored 'General case' 0 CA--C 1.576 1.973 0 C-N-CA 117.863 -1.535 . . . . 55.06 113.781 -172.733 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' GLU . . . . . 0.825 ' OE2' 'CA ' ' D' ' 200' ' ' ' CA' . 0.9 OUTLIER -54.47 -7.44 0.15 Allowed 'General case' 1 N--CA 1.547 4.402 1 O-C-N 116.275 -4.016 . . . . 100.0 110.893 -179.594 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' LEU . . . . . 0.568 HD21 ' HE1' ' B' ' 34' ' ' PHE . 2.7 tt -105.61 -63.2 1.27 Allowed 'General case' 0 C--O 1.234 0.288 0 N-CA-C 113.155 0.798 . . . . 35.34 113.155 -179.043 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' LEU . . . . . 1.594 ' CD2' ' HB2' ' D' ' 8' ' ' ASP . 0.0 OUTLIER -56.99 -26.44 60.16 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.012 -0.995 . . . . 25.07 111.192 -179.412 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' SER . . . . . 0.413 ' O ' ' HB ' ' D' ' 17' ' ' THR . 2.1 t -58.37 -58.22 9.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.871 -0.604 . . . . 42.74 110.883 179.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' MET . . . . . 0.574 ' SD ' " H3'" ' W' ' 7' ' ' ' DA' . 0.0 OUTLIER -71.84 -29.72 64.7 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.636 -0.256 . . . . 33.91 111.661 179.603 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' VAL . . . . . 1.073 HG22 ' HB1' ' B' ' 19' ' ' ALA 0.569 70.6 t -73.88 8.26 0.5 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.551 0 CA-C-O 121.811 0.815 . . . . 28.57 110.296 179.132 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' THR . . . . . 0.75 ' O ' ' HB2' ' D' ' 20' ' ' ASP . 98.2 m -112.3 -64.49 1.29 Allowed 'General case' 0 C--O 1.236 0.394 0 CA-C-O 122.996 1.379 . . . . 44.58 107.93 178.907 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' TYR . . . . . 0.614 ' HE2' HD21 ' D' ' 22' ' ' LEU 0.312 1.0 OUTLIER -51.42 -46.35 62.89 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-N 112.849 -1.978 . . . . 57.14 107.778 178.093 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' ALA . . . . . . . . . . . . . . . -52.04 -48.75 64.42 Favored 'General case' 0 C--O 1.226 -0.138 0 O-C-N 123.143 0.277 . . . . 35.21 110.299 178.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' ASP . . . . . 0.75 ' HB2' ' O ' ' D' ' 17' ' ' THR 0.363 0.9 OUTLIER -49.36 -54.76 15.64 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 122.214 1.006 . . . . 65.36 110.202 178.786 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' LYS . . . . . 0.541 ' O ' ' N ' ' D' ' 24' ' ' SER . 0.1 OUTLIER -48.89 -84.39 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 113.897 -1.501 . . . . 100.0 111.118 -179.695 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' LEU . . . . . 0.614 HD21 ' HE2' ' D' ' 18' ' ' TYR . 2.7 mp -31.12 -30.42 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 126.285 1.834 . . . . 31.07 113.225 -178.701 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' LYS . . . . . 0.759 ' O ' ' HG3' ' D' ' 27' ' ' LYS . 0.0 OUTLIER -72.86 -41.64 64.55 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.436 0.636 . . . . 40.89 109.936 179.288 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' SER . . . . . 0.669 ' O ' ' HB2' ' D' ' 27' ' ' LYS . 0.4 OUTLIER -70.53 -37.54 74.09 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.598 -0.841 . . . . 20.06 111.288 -179.369 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tp -49.47 -45.79 47.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.637 -0.711 . . . . 33.28 111.124 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' ILE . . . . . 0.556 HD13 ' CE1' ' D' ' 34' ' ' PHE . 10.1 mt -74.92 -26.77 19.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 122.166 0.984 . . . . 43.15 109.092 178.817 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' LYS . . . . . 0.759 ' HG3' ' O ' ' D' ' 23' ' ' LYS . 1.9 mtpp -63.5 -61.59 2.23 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.64 -0.709 . . . . 72.37 110.641 179.208 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.38 -50.77 35.3 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.493 0.923 . . . . 87.85 113.493 -179.121 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' GLU . . . . . 0.912 ' HG2' ' HE2' ' D' ' 83' ' ' LYS 0.577 3.9 tp10 -55.11 -23.11 19.15 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 119.158 -1.017 . . . . 92.42 113.015 -179.436 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' PHE . . . . . 0.955 ' HZ ' ' HB3' ' D' ' 80' ' ' PHE 0.355 0.0 OUTLIER -173.96 -119.25 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.729 0 C-N-CA 123.777 0.831 . . . . 28.94 112.67 178.903 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' D' D ' 31' ' ' SER . . . . . 0.494 ' O ' ' O ' ' D' ' 30' ' ' PHE . 1.4 p -30.73 177.89 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 116.355 1.983 . . . . 47.4 116.355 -177.713 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 32' ' ' ILE . . . . . 0.536 HG23 ' N ' ' D' ' 33' ' ' SER . 0.2 OUTLIER -153.41 -43.84 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 113.564 -1.653 . . . . 25.91 108.917 179.371 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 33' ' ' SER . . . . . 0.536 ' N ' HG23 ' D' ' 32' ' ' ILE . 2.9 p -53.85 -7.15 0.11 Allowed 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 121.344 0.592 . . . . 59.75 112.375 179.418 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 34' ' ' PHE . . . . . 0.556 ' CE1' HD13 ' D' ' 26' ' ' ILE . 1.2 t80 -84.79 -22.96 29.37 Favored 'General case' 0 C--O 1.246 0.87 0 N-CA-C 105.703 -1.962 . . . . 99.54 105.703 176.883 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 35' ' ' GLU . . . . . 0.555 ' CD ' ' HD2' ' D' ' 27' ' ' LYS . 20.0 tp10 -76.52 -19.43 57.96 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 106.126 -1.805 . . . . 86.84 106.126 178.145 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' GLU . . . . . 0.815 ' HA ' HG12 ' D' ' 39' ' ' VAL . 0.2 OUTLIER -108.43 -31.82 7.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.007 -0.997 . . . . 100.0 111.458 179.006 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 37' ' ' PHE . . . . . 1.153 ' HA ' HD23 ' D' ' 40' ' ' LEU . 0.1 OUTLIER -50.32 -28.35 7.73 Favored 'General case' 0 C--N 1.332 -0.176 0 O-C-N 123.636 0.585 . . . . 88.82 109.968 179.494 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 38' ' ' ALA . . . . . 0.442 ' HB1' ' CG1' ' B' ' 16' ' ' VAL . . . -85.57 -55.88 3.78 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.093 -0.503 . . . . 88.83 110.393 179.211 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' VAL . . . . . 0.815 HG12 ' HA ' ' D' ' 36' ' ' GLU . 2.7 p -61.54 -23.85 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 108.027 -1.101 . . . . 84.94 108.027 179.03 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 40' ' ' LEU . . . . . 1.153 HD23 ' HA ' ' D' ' 37' ' ' PHE . 0.3 OUTLIER -59.87 -31.4 69.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.339 -0.846 . . . . 100.0 109.799 179.189 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 41' ' ' THR . . . . . 0.505 HG21 ' OG1' ' B' ' 17' ' ' THR . 40.3 p -54.92 -34.33 63.05 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.283 -0.636 . . . . 100.0 109.283 179.538 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 42' ' ' TYR . . . . . . . . . . . . 0.445 63.5 t80 -95.37 -8.19 36.39 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 112.788 0.662 . . . . 85.8 112.788 179.073 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 43' ' ' ILE . . . . . 0.91 HD12 ' H ' ' D' ' 44' ' ' SER 1.327 1.4 tp -141.89 168.46 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 N-CA-C 115.349 1.611 . . . . 76.61 115.349 179.994 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 44' ' ' SER . . . . . 0.91 ' H ' HD12 ' D' ' 43' ' ' ILE . 96.2 p -110.99 -32.79 6.69 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 122.97 0.508 . . . . 100.0 111.247 179.804 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 45' ' ' GLU . . . . . 0.58 ' OE1' ' HA ' ' D' ' 45' ' ' GLU . 0.0 OUTLIER -51.74 -27.04 10.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.749 -0.66 . . . . 100.0 111.028 -179.055 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 46' ' ' ASN . . . . . 0.553 ' HB3' ' HG2' ' D' ' 36' ' ' GLU . 2.7 m120 -75.55 0.29 17.85 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.427 -0.806 . . . . 99.73 110.051 179.373 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 47' ' ' LYS . . . . . 0.67 ' HB2' ' O ' ' D' ' 44' ' ' SER . 0.0 OUTLIER -84.88 -26.15 27.52 Favored 'General case' 0 CA--C 1.486 -1.488 0 CA-C-O 122.336 1.065 . . . . 60.36 113.432 179.9 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 48' ' ' GLU . . . . . 0.678 ' CD ' ' HB2' ' D' ' 52' ' ' TYR . 0.4 OUTLIER -93.48 -45.41 7.78 Favored 'General case' 0 C--N 1.296 -1.722 2 O-C-N 113.375 -5.828 . . . . 96.93 112.762 179.371 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' D' D ' 49' ' ' LYS . . . . . 0.427 ' C ' ' O ' ' D' ' 48' ' ' GLU . 0.0 OUTLIER -44.95 -23.6 0.15 Allowed 'General case' 0 N--CA 1.538 3.94 0 O-C-N 118.171 -2.831 . . . . 100.0 107.407 176.693 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 50' ' ' GLU . . . . . 0.616 ' OE2' ' HD3' ' D' ' 54' ' ' LYS . 0.0 OUTLIER -66.64 -62.5 1.42 Allowed 'General case' 0 C--O 1.21 -0.999 0 O-C-N 124.282 0.989 . . . . 63.54 111.788 -179.462 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 51' ' ' TYR . . . . . . . . . . . . 0.613 3.2 m-85 -82.48 -30.64 29.81 Favored 'General case' 0 C--O 1.223 -0.33 0 N-CA-C 114.715 1.376 . . . . 67.8 114.715 -178.656 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 52' ' ' TYR . . . . . 0.678 ' HB2' ' CD ' ' D' ' 48' ' ' GLU . 1.7 t80 -59.68 -13.02 8.09 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.393 -0.923 . . . . 66.43 109.69 179.107 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 53' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -126.48 -39.85 1.99 Allowed 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 113.389 0.885 . . . . 51.21 113.389 -179.397 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 54' ' ' LYS . . . . . 0.616 ' HD3' ' OE2' ' D' ' 50' ' ' GLU 0.527 43.2 tttt -52.4 -6.88 0.05 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.629 0.974 . . . . 39.38 113.629 -177.643 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 55' ' ' ASP . . . . . 0.638 ' O ' HG13 ' D' ' 56' ' ' ILE . 42.7 t0 -139.97 19.68 2.47 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 122.168 0.985 . . . . 80.55 111.223 179.208 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 56' ' ' ILE . . . . . 0.638 HG13 ' O ' ' D' ' 55' ' ' ASP . 2.0 mp . . . . . 0 CA--C 1.541 0.625 0 O-C-N 121.138 -0.976 . . . . 75.97 112.212 -178.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 67' ' ' VAL . . . . . 0.522 HG13 ' H ' ' D' ' 68' ' ' VAL . 7.3 p . . . . . 0 CA--C 1.604 3.033 0 N-CA-C 117.56 2.43 . . . . 54.64 117.56 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 68' ' ' VAL . . . . . 0.522 ' H ' HG13 ' D' ' 67' ' ' VAL . 2.5 t -78.39 -39.13 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.004 0 O-C-N 118.28 -2.763 . . . . 86.27 111.63 -177.451 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 69' ' ' LYS . . . . . 0.769 ' HD3' ' O ' ' D' ' 69' ' ' LYS . 0.0 OUTLIER -69.33 0.05 5.57 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 121.489 0.662 . . . . 98.36 109.343 178.156 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 70' ' ' ALA . . . . . 0.407 ' H ' ' C ' ' D' ' 68' ' ' VAL . . . -95.7 -52.9 3.91 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.588 -1.187 . . . . 83.65 109.722 178.756 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 71' ' ' VAL . . . . . 0.432 ' CG1' ' N ' ' D' ' 72' ' ' LYS . 0.3 OUTLIER -67.26 -37.59 79.39 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 N-CA-C 107.433 -1.321 . . . . 52.98 107.433 178.297 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 72' ' ' LYS . . . . . 0.432 ' N ' ' CG1' ' D' ' 71' ' ' VAL . 12.2 tptm -56.15 -43.03 77.89 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.079 -0.964 . . . . 59.51 109.227 179.156 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 73' ' ' ILE . . . . . 0.592 HG22 ' N ' ' D' ' 74' ' ' LEU . 0.1 OUTLIER -72.66 -48.13 47.55 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.409 0 CA-C-N 116.118 -0.492 . . . . 57.72 110.441 179.48 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 74' ' ' LEU . . . . . 0.694 HD22 ' O ' ' D' ' 74' ' ' LEU . 0.3 OUTLIER -58.49 -44.74 89.5 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 119.796 -0.762 . . . . 73.01 111.001 -179.693 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 75' ' ' SER . . . . . . . . . . . . . 10.9 t -62.1 -50.32 72.4 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 120.297 -0.561 . . . . 67.15 110.698 179.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -7.79 43.72 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 120.115 -0.634 . . . . 55.73 110.771 -179.935 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 77' ' ' GLU . . . . . 0.93 ' HG2' ' CZ ' ' D' ' 80' ' ' PHE . 0.1 OUTLIER -92.57 -14.25 28.54 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.687 -1.227 . . . . 100.0 107.687 179.117 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 78' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -90.89 -32.97 15.81 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 107.558 -1.275 . . . . 100.0 107.558 177.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 79' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -53.9 -36.89 63.2 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.185 -0.916 . . . . 100.0 109.024 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 80' ' ' PHE . . . . . 0.955 ' HB3' ' HZ ' ' D' ' 30' ' ' PHE 0.462 0.3 OUTLIER -89.52 -27.87 20.0 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 113.004 0.742 . . . . 100.0 113.004 179.188 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' D' D ' 81' ' ' ASP . . . . . . . . . . . . 0.558 3.4 m-20 -66.94 -19.43 65.72 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 114.789 1.403 . . . . 46.4 114.789 -179.061 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 82' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -93.51 -39.5 10.84 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 121.664 0.745 . . . . 100.0 110.605 179.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 83' ' ' LYS . . . . . 0.912 ' HE2' ' HG2' ' D' ' 29' ' ' GLU . 37.4 tttp -59.81 -25.75 65.22 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 114.671 -1.149 . . . . 57.65 112.683 179.15 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 84' ' ' ARG . . . . . 0.514 ' HG2' ' CD2' ' D' ' 87' ' ' HIS 0.442 0.9 OUTLIER -95.63 -37.58 10.76 Favored 'General case' 0 C--N 1.352 0.682 0 N-CA-C 112.672 0.619 . . . . 59.76 112.672 179.398 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' D' D ' 85' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -64.15 -34.04 77.16 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 104.649 -2.352 . . . . 41.11 104.649 177.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 86' ' ' GLU . . . . . 1.065 ' HG3' HH12 ' D' ' 90' ' ' ARG . 15.5 pt-20 -70.88 -48.16 55.31 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.375 -0.83 . . . . 100.0 110.649 179.307 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 87' ' ' HIS . . . . . 1.124 ' HA ' ' HD3' ' D' ' 90' ' ' ARG 0.422 0.0 OUTLIER -65.09 -12.76 54.32 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 113.222 0.823 . . . . 100.0 113.222 -179.185 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' D' D ' 88' ' ' ASP . . . . . 0.512 ' O ' ' HB ' ' D' ' 92' ' ' VAL 0.642 10.9 m-20 -63.67 -1.34 1.26 Allowed 'General case' 0 C--O 1.238 0.47 0 CA-C-O 121.939 0.876 . . . . 99.05 111.856 179.738 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 89' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -111.26 -22.69 11.25 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.326 -1.306 . . . . 100.0 108.287 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 90' ' ' ARG . . . . . 1.124 ' HD3' ' HA ' ' D' ' 87' ' ' HIS 0.342 0.0 OUTLIER -88.78 -66.06 0.96 Allowed 'General case' 0 CA--C 1.509 -0.632 0 C-N-CA 119.752 -0.779 . . . . 100.0 109.834 178.44 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' D' D ' 91' ' ' THR . . . . . 0.602 ' O ' HG22 ' D' ' 94' ' ' ILE 0.295 90.4 m -56.81 -14.26 3.27 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 119.79 -0.764 . . . . 88.98 109.571 178.073 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 92' ' ' VAL . . . . . 0.984 HG13 HD23 ' D' ' 95' ' ' LEU 0.677 1.0 OUTLIER -56.35 5.99 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 123.404 0.682 . . . . 81.89 112.498 178.302 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' D' D ' 93' ' ' LEU . . . . . 0.602 ' O ' ' N ' ' D' ' 97' ' ' ASN . 0.6 OUTLIER -78.56 -38.19 40.86 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 104.751 -2.314 . . . . 59.0 104.751 176.631 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 94' ' ' ILE . . . . . 0.602 HG22 ' O ' ' D' ' 91' ' ' THR . 10.9 tt -63.46 -45.33 98.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-N 113.473 -1.694 . . . . 75.81 110.679 178.612 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 95' ' ' LEU . . . . . 0.984 HD23 HG13 ' D' ' 92' ' ' VAL . 0.1 OUTLIER -52.68 -53.57 45.58 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 108.256 -1.016 . . . . 66.41 108.256 179.89 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 96' ' ' VAL . . . . . 0.876 HG12 ' HG3' ' D' ' 100' ' ' GLN . 82.3 t -73.16 -37.51 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.3 0 N-CA-C 107.334 -1.358 . . . . 79.13 107.334 177.883 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 97' ' ' ASN . . . . . 0.602 ' N ' ' O ' ' D' ' 93' ' ' LEU 0.49 2.5 m120 -56.02 -41.95 75.73 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.11 0.411 . . . . 100.0 112.11 -179.865 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 98' ' ' ALA . . . . . 0.624 ' O ' ' HG2' ' D' ' 102' ' ' LYS . . . -65.55 -63.75 1.02 Allowed 'General case' 0 C--O 1.234 0.252 0 N-CA-C 107.801 -1.185 . . . . 95.57 107.801 178.349 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 99' ' ' GLN . . . . . 0.912 HE22 HD12 ' D' ' 95' ' ' LEU 0.463 1.5 tt0 -56.87 -25.88 57.55 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.183 1.393 . . . . 76.08 111.289 179.298 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 100' ' ' GLN . . . . . 0.876 ' HG3' HG12 ' D' ' 96' ' ' VAL . 24.6 mt-30 -51.2 -127.42 0.0 OUTLIER 'General case' 0 C--O 1.234 0.268 0 N-CA-C 113.693 0.997 . . . . 100.0 113.693 -178.817 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' ARG . . . . . 0.973 ' HA ' ' HB ' ' D' ' 104' ' ' ILE . 0.5 OUTLIER -44.99 -17.82 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 114.56 -1.2 . . . . 100.0 113.079 -179.036 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' LYS . . . . . 1.171 ' HG3' ' NZ ' ' D' ' 5' ' ' LYS 0.644 0.3 OUTLIER -68.7 -55.8 10.22 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 119.825 -0.75 . . . . 37.05 109.917 179.474 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' D' D ' 103' ' ' LYS . . . . . 0.501 ' HA ' ' OG ' ' D' ' 106' ' ' SER . 4.8 tttt -67.45 -35.31 78.95 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 103.723 -2.695 . . . . 61.54 103.723 176.983 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 104' ' ' ILE . . . . . 0.973 ' HB ' ' HA ' ' D' ' 101' ' ' ARG . 0.0 OUTLIER -61.26 -22.03 26.39 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 N-CA-C 107.519 -1.289 . . . . 37.57 107.519 177.206 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 105' ' ' GLU . . . . . 0.866 ' CG ' HG22 ' D' ' 4' ' ' THR . 3.2 tp10 -74.26 -36.39 63.85 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 105.701 -1.962 . . . . 75.76 105.701 177.146 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 106' ' ' SER . . . . . 0.509 ' O ' ' N ' ' D' ' 109' ' ' SER . 0.3 OUTLIER -70.77 -45.9 63.92 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.012 -0.994 . . . . 41.8 110.363 178.475 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 107' ' ' LEU . . . . . 1.15 HD22 ' HB3' ' D' ' 110' ' ' ARG . 0.2 OUTLIER -55.18 -23.17 20.33 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.733 -0.84 . . . . 35.79 108.733 178.706 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 108' ' ' LEU . . . . . 0.776 ' HB3' ' O ' ' D' ' 105' ' ' GLU . 1.2 tp -58.1 -32.32 67.98 Favored 'General case' 0 CA--C 1.509 -0.62 0 N-CA-C 104.99 -2.226 . . . . 31.0 104.99 178.208 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 109' ' ' SER . . . . . 0.509 ' N ' ' O ' ' D' ' 106' ' ' SER . 0.7 OUTLIER -73.67 -30.9 63.17 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 113.32 -1.764 . . . . 96.1 108.708 178.049 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 110' ' ' ARG . . . . . 1.15 ' HB3' HD22 ' D' ' 107' ' ' LEU . 6.9 ttt85 -56.43 -53.48 56.88 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.377 -1.342 . . . . 60.43 107.377 178.397 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 111' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.235 0.323 0 N-CA-C 107.204 -1.406 . . . . 64.68 107.204 176.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' ALA . . . . . 0.445 ' O ' ' O ' ' B' ' 3' ' ' ILE . . . . . . . . 0 C--O 1.238 0.463 0 N-CA-C 112.379 0.511 . . . . 25.77 112.379 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.705 HD12 ' N ' ' B' ' 4' ' ' THR . 0.6 OUTLIER -38.43 178.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 N-CA-C 115.241 1.571 . . . . 58.42 115.241 -178.959 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' THR . . . . . 0.705 ' N ' HD12 ' B' ' 3' ' ' ILE . 0.2 OUTLIER -159.76 -66.17 0.07 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.6 -1.63 . . . . 91.74 106.6 179.182 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.631 ' O ' ' N ' ' B' ' 7' ' ' ASN . 16.4 mmtp -116.76 6.84 13.29 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 114.986 -1.007 . . . . 81.67 112.394 178.93 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ILE . . . . . 0.511 ' CG1' ' HB ' ' B' ' 3' ' ' ILE 0.305 1.3 pp -62.67 78.82 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.489 0 C-N-CA 118.333 -1.347 . . . . 41.23 108.003 179.155 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ASN . . . . . 0.631 ' N ' ' O ' ' B' ' 5' ' ' LYS . 0.8 OUTLIER -164.26 54.57 0.15 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.878 -1.055 . . . . 54.77 108.973 -178.34 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ASP . . . . . 0.597 ' HB3' ' HG3' ' D' ' 77' ' ' GLU 0.416 1.1 p-10 -55.14 130.38 41.77 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 114.485 -1.234 . . . . 100.0 109.601 179.322 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.689 ' O ' ' HB2' ' B' ' 13' ' ' LEU . 9.7 p -134.38 -169.1 2.26 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.939 1.296 . . . . 94.2 107.81 -0.117 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' PHE . . . . . 0.486 ' N ' ' CD1' ' B' ' 10' ' ' PHE 0.351 0.0 OUTLIER -80.37 -89.38 0.06 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.872 1.064 . . . . 80.18 113.872 -177.923 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.774 ' HG2' ' OP1' ' K' ' 9' ' ' ' DA' . 0.0 OUTLIER -42.42 -58.48 2.21 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.385 0.883 . . . . 91.67 113.385 -178.757 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.691 ' O ' HG23 ' B' ' 16' ' ' VAL . 0.0 OUTLIER -57.85 -39.28 77.35 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 121.265 -0.897 . . . . 41.37 110.495 179.565 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.689 ' HB2' ' O ' ' B' ' 9' ' ' CYS 1.163 4.0 mt -49.61 -89.43 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 116.646 2.091 . . . . 76.13 116.646 -179.713 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' SER . . . . . 0.443 ' O ' ' HB3' ' B' ' 18' ' ' TYR 0.265 1.8 t -47.49 -31.28 4.1 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.964 1.098 . . . . 62.47 113.964 -178.532 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' MET . . . . . 0.465 ' SD ' ' HG2' ' D' ' 15' ' ' MET . 13.4 tpp -55.18 -61.31 2.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.355 0.598 . . . . 46.47 110.092 -179.983 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.691 HG23 ' O ' ' B' ' 12' ' ' LEU . 21.1 t -52.56 -49.71 43.41 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.899 0 CA-C-N 115.243 -0.89 . . . . 64.79 110.658 179.377 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' THR . . . . . 0.656 HG22 ' N ' ' B' ' 18' ' ' TYR . 1.2 m -62.24 -53.83 49.6 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.71 0.766 . . . . 36.12 111.335 179.732 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.656 ' N ' HG22 ' B' ' 17' ' ' THR . 0.1 OUTLIER -57.54 -29.36 64.31 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.231 -1.026 . . . . 36.96 108.231 178.087 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ALA . . . . . 1.073 ' HB1' HG22 ' D' ' 16' ' ' VAL . . . -81.49 -50.17 9.73 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.757 -0.59 . . . . 58.56 109.842 179.037 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.526 ' OD2' HG12 ' B' ' 16' ' ' VAL . 2.5 m-20 -57.39 -10.11 1.27 Allowed 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.719 -0.673 . . . . 85.92 110.436 179.522 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' LYS . . . . . 0.586 ' HD2' ' O ' ' B' ' 21' ' ' LYS . 1.9 tptm -84.38 -61.82 1.71 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.111 0.964 . . . . 92.23 113.44 -179.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' LEU . . . . . 0.817 HD22 ' NE2' ' B' ' 87' ' ' HIS 0.971 0.3 OUTLIER -72.45 -13.32 61.41 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.302 0.853 . . . . 48.28 113.302 179.767 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' LYS . . . . . 0.867 ' HZ3' ' HA ' ' B' ' 35' ' ' GLU 0.312 1.7 mtpp -66.43 -49.89 65.22 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.081 -1.081 . . . . 56.68 108.081 177.854 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' SER . . . . . 0.428 ' OG ' ' O ' ' B' ' 21' ' ' LYS 0.268 33.1 p -74.96 -41.46 59.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 114.142 -1.39 . . . . 45.21 111.429 179.588 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' LEU . . . . . 0.789 HD13 ' HE1' ' B' ' 87' ' ' HIS . 0.6 OUTLIER -51.65 -45.14 63.24 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 120.919 0.39 . . . . 45.63 111.212 -179.256 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ILE . . . . . 0.517 ' HA ' ' HE1' ' B' ' 30' ' ' PHE . 1.2 mp -75.6 -24.38 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-O 122.059 0.933 . . . . 31.84 108.971 179.483 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LYS . . . . . 0.708 ' HD2' ' HB2' ' B' ' 35' ' ' GLU . 2.4 tttp -62.61 -56.55 16.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.848 -0.614 . . . . 100.0 112.561 -179.505 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -52.48 43.22 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.14 0.422 . . . . 49.33 112.14 -179.966 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLU . . . . . 0.602 ' HG2' ' NZ ' ' B' ' 83' ' ' LYS . 4.1 tp10 -57.33 -20.32 28.12 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.608 0.966 . . . . 93.7 113.608 -179.007 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' PHE . . . . . 0.524 ' O ' ' O ' ' B' ' 31' ' ' SER 0.69 0.0 OUTLIER -157.46 -130.28 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.619 1.341 . . . . 66.7 114.619 179.372 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' SER . . . . . 0.524 ' O ' ' O ' ' B' ' 30' ' ' PHE . 12.4 p -49.49 -143.94 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 113.555 0.946 . . . . 67.72 113.555 -178.281 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ILE . . . . . 0.616 HG22 ' HG3' ' B' ' 27' ' ' LYS . 0.0 OUTLIER -173.16 -17.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.213 -0.819 0 CA-C-N 114.962 -1.017 . . . . 41.92 110.8 179.739 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.26 93.1 p -54.34 -15.25 1.51 Allowed 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.197 -0.601 . . . . 65.86 111.46 179.243 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' PHE . . . . . 0.612 ' CE2' HD22 ' D' ' 13' ' ' LEU . 1.0 OUTLIER -64.83 -46.01 83.72 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 112.848 0.684 . . . . 100.0 112.848 179.727 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.867 ' HA ' ' HZ3' ' B' ' 23' ' ' LYS . 32.8 tp10 -65.86 -21.29 66.45 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.238 -1.393 . . . . 92.39 107.238 178.824 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.74 ' OE1' ' HB3' ' B' ' 35' ' ' GLU . 6.1 mm-40 -88.34 -60.12 2.05 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 114.501 -1.227 . . . . 61.85 111.61 -179.421 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' PHE . . . . . 0.76 ' O ' ' HB3' ' B' ' 40' ' ' LEU . 0.7 OUTLIER -49.54 -46.96 49.3 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.722 0.638 . . . . 64.45 111.375 -179.737 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ALA . . . . . 0.876 ' HB1' HG12 ' D' ' 16' ' ' VAL . . . -52.16 -49.58 63.51 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.346 -0.388 . . . . 73.66 111.589 -179.524 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 2.5 p -77.13 -32.11 19.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.229 -0.588 . . . . 69.55 110.237 179.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.955 ' HA ' HD21 ' B' ' 46' ' ' ASN . 1.5 tm? -36.62 -34.99 0.08 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.293 1.437 . . . . 63.28 113.713 -179.412 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' THR . . . . . 0.502 ' O ' ' OG1' ' B' ' 41' ' ' THR . 0.1 OUTLIER -67.61 11.05 0.15 Allowed 'General case' 0 C--N 1.329 -0.31 0 O-C-N 122.067 -0.395 . . . . 83.79 111.114 179.955 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' TYR . . . . . 0.616 ' O ' HG13 ' B' ' 43' ' ' ILE . 7.0 t80 -139.82 -23.37 0.86 Allowed 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.257 0.466 . . . . 74.47 112.257 -179.171 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.616 HG13 ' O ' ' B' ' 42' ' ' TYR 0.698 9.6 mt -132.52 143.25 40.35 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 113.474 0.916 . . . . 66.49 113.474 179.431 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' SER . . . . . 0.612 ' O ' ' HG3' ' B' ' 47' ' ' LYS . 9.2 p -96.85 -2.44 43.98 Favored 'General case' 0 CA--C 1.484 -1.561 0 N-CA-C 115.165 1.543 . . . . 50.11 115.165 -178.346 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.71 ' OE1' ' HB2' ' B' ' 48' ' ' GLU . 0.8 OUTLIER -100.12 -13.34 19.02 Favored 'General case' 0 C--N 1.301 -1.506 2 O-C-N 113.913 -5.492 . . . . 100.0 113.213 -179.839 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ASN . . . . . 0.955 HD21 ' HA ' ' B' ' 40' ' ' LEU . 28.0 p30 -57.32 -21.31 34.28 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 107.047 -1.464 . . . . 48.82 107.047 177.22 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.768 ' NZ ' HD21 ' B' ' 40' ' ' LEU . 0.0 OUTLIER -67.94 -17.89 64.59 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 112.68 -2.055 . . . . 66.39 110.985 179.91 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' GLU . . . . . 0.845 ' HA ' ' OE2' ' B' ' 48' ' ' GLU . 0.0 OUTLIER -67.08 -74.82 0.1 Allowed 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 115.461 -2.495 . . . . 100.0 112.459 -176.216 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.764 ' HB2' HD23 ' B' ' 53' ' ' LEU . 0.0 OUTLIER -62.58 -12.22 21.46 Favored 'General case' 0 N--CA 1.5 2.073 1 O-C-N 116.136 -4.102 . . . . 60.8 107.98 -178.685 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' GLU . . . . . 0.616 ' CB ' ' HA ' ' B' ' 47' ' ' LYS . 0.0 OUTLIER -49.15 -63.31 1.14 Allowed 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 114.252 -1.34 . . . . 99.43 108.689 178.438 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' TYR . . . . . 0.447 ' CE2' ' HB3' ' B' ' 54' ' ' LYS 0.685 0.2 OUTLIER -79.0 -24.92 43.42 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 119.592 -0.843 . . . . 58.78 112.017 178.692 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' TYR . . . . . 0.619 ' HB3' ' HA ' ' B' ' 49' ' ' LYS . 2.3 t80 -64.23 -21.33 66.54 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.557 0.694 . . . . 94.43 109.514 178.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.764 HD23 ' HB2' ' B' ' 49' ' ' LYS . 4.0 mm? -106.38 -43.43 4.77 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.312 -0.858 . . . . 77.74 112.086 -179.878 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.447 ' HB3' ' CE2' ' B' ' 51' ' ' TYR 0.333 0.1 OUTLIER -57.89 6.84 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 114.223 1.194 . . . . 89.1 114.223 -179.081 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ASP . . . . . 0.454 ' H ' ' C ' ' B' ' 53' ' ' LEU . 25.1 t70 -138.52 -48.58 0.52 Allowed 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.558 -0.457 . . . . 91.09 110.616 178.402 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.234 0.253 0 CA-C-N 116.221 -0.445 . . . . 100.0 110.532 179.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 115.466 1.654 . . . . 66.72 115.466 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 48.2 t -76.29 -57.32 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 119.117 -2.239 . . . . 100.0 109.116 -179.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' B' ' 69' ' ' LYS . 0.0 OUTLIER -64.99 -17.27 64.28 Favored 'General case' 0 C--O 1.253 1.262 0 C-N-CA 119.956 -0.698 . . . . 81.79 110.121 179.781 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.67 -76.77 0.05 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.397 -0.594 . . . . 58.37 109.397 179.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 43.2 t -55.1 -22.42 10.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.92 -0.582 . . . . 49.4 111.873 179.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 4.4 tptm -71.0 -45.55 63.78 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 107.803 -1.184 . . . . 100.0 107.803 178.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ILE . . . . . 0.653 HG22 ' N ' ' B' ' 74' ' ' LEU . 1.1 mp -70.12 -44.92 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 115.103 -0.953 . . . . 42.17 110.292 179.211 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.653 ' N ' HG22 ' B' ' 73' ' ' ILE . 1.2 tm? -55.08 -47.08 75.37 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 113.621 0.971 . . . . 44.9 113.621 -178.632 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' SER . . . . . 0.598 ' O ' ' HB3' ' B' ' 78' ' ' ASP 0.507 26.3 t -62.14 -34.41 76.32 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 113.747 1.017 . . . . 48.68 113.747 -179.219 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' GLN . . . . . 0.645 ' HA ' ' HB2' ' B' ' 79' ' ' TYR . 0.0 OUTLIER -80.2 -33.04 38.52 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.431 -0.951 . . . . 83.09 108.431 178.372 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' GLU . . . . . 0.705 ' O ' ' HB2' ' B' ' 81' ' ' ASP . 0.1 OUTLIER -60.33 -23.86 64.57 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 107.137 -1.431 . . . . 100.0 107.137 178.559 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ASP . . . . . 0.598 ' HB3' ' O ' ' B' ' 75' ' ' SER . 6.6 t0 -81.82 -35.23 29.69 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 113.896 -1.502 . . . . 100.0 108.164 177.384 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' TYR . . . . . 0.645 ' HB2' ' HA ' ' B' ' 76' ' ' GLN . 0.0 OUTLIER -52.94 -54.62 32.26 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 114.957 -1.019 . . . . 78.89 111.069 -179.929 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' PHE . . . . . 0.505 ' HB3' ' CZ ' ' B' ' 30' ' ' PHE . 0.0 OUTLIER -81.97 -15.03 55.12 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 121.699 0.761 . . . . 49.76 110.215 -179.918 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ASP . . . . . 0.705 ' HB2' ' O ' ' B' ' 77' ' ' GLU . 0.2 OUTLIER -68.38 -26.55 65.63 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.981 -1.009 . . . . 74.3 111.477 -178.769 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' LYS . . . . . 0.583 ' O ' ' HB2' ' B' ' 86' ' ' GLU . 12.2 ttmm -85.07 -40.78 16.42 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.08 -0.964 . . . . 100.0 110.589 179.631 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' LYS . . . . . 0.602 ' NZ ' ' HG2' ' B' ' 29' ' ' GLU . 10.8 mttt -71.76 6.46 1.97 Allowed 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.393 0.886 . . . . 38.91 113.393 -179.477 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ARG . . . . . 0.45 ' O ' ' HB2' ' B' ' 88' ' ' ASP . 1.7 tmt_? -104.89 -49.07 3.58 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 108.167 -1.049 . . . . 90.06 108.167 179.139 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -69.26 -28.48 66.35 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 107.917 -1.142 . . . . 100.0 107.917 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.583 ' HB2' ' O ' ' B' ' 82' ' ' LYS . 16.1 tt0 -77.56 -49.72 14.07 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 113.972 -1.467 . . . . 77.36 109.765 179.503 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' HIS . . . . . 0.817 ' NE2' HD22 ' B' ' 22' ' ' LEU 0.744 0.0 OUTLIER -70.17 -14.11 62.49 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.283 -0.871 . . . . 47.85 113.177 -179.007 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' B' ' 84' ' ' ARG . 0.4 OUTLIER -73.44 -7.81 53.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.1 -0.955 . . . . 61.73 112.143 179.597 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.558 ' C ' ' HG3' ' B' ' 90' ' ' ARG . 0.2 OUTLIER -82.45 -11.73 58.32 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.124 0.488 . . . . 100.0 110.728 179.688 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' ARG . . . . . 0.645 ' HB2' HH11 ' B' ' 90' ' ' ARG . 0.1 OUTLIER -140.3 24.51 2.3 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 112.954 0.724 . . . . 62.29 112.954 -178.075 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' THR . . . . . . . . . . . . 0.347 2.9 t -99.56 5.42 46.02 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 122.598 1.19 . . . . 52.4 107.905 177.434 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.922 HG22 HG23 ' B' ' 96' ' ' VAL . 2.6 p -69.82 3.04 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 113.574 -1.648 . . . . 64.43 111.907 179.986 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.438 ' O ' ' HB3' ' B' ' 97' ' ' ASN . 0.2 OUTLIER -50.09 -51.0 46.33 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.268 0.556 . . . . 56.65 111.026 179.945 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' ILE . . . . . 0.862 HG23 ' H ' ' B' ' 95' ' ' LEU . 0.6 OUTLIER -49.57 -88.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 114.868 1.433 . . . . 61.0 114.868 -178.92 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.862 ' H ' HG23 ' B' ' 94' ' ' ILE . 0.0 OUTLIER -41.24 -40.57 1.65 Allowed 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 124.68 1.192 . . . . 72.26 111.839 -178.355 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' VAL . . . . . 0.922 HG23 HG22 ' B' ' 92' ' ' VAL 0.268 2.6 t -68.38 -61.56 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 O-C-N 125.202 1.564 . . . . 65.51 110.197 179.674 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ASN . . . . . 0.637 ' N ' HG12 ' B' ' 96' ' ' VAL . 1.6 t-20 -56.71 -26.67 57.45 Favored 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 106.378 -1.712 . . . . 72.48 106.378 177.306 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ALA . . . . . 0.991 ' HA ' ' HB2' ' B' ' 101' ' ' ARG . . . -79.6 -34.66 40.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.435 -1.257 . . . . 75.86 108.035 178.534 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.659 ' N ' ' O ' ' B' ' 95' ' ' LEU . 0.1 OUTLIER -67.78 -52.66 34.61 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 105.238 -2.134 . . . . 59.7 105.238 178.23 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' GLN . . . . . 0.421 ' HA ' ' HB3' ' B' ' 103' ' ' LYS . 1.4 mp0 -66.73 -19.0 65.66 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 105.852 -1.907 . . . . 90.63 105.852 178.117 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' ARG . . . . . 0.991 ' HB2' ' HA ' ' B' ' 98' ' ' ALA . 0.4 OUTLIER -65.51 -53.77 37.71 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 124.811 2.244 . . . . 77.9 108.421 178.208 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.928 ' HG3' ' HB2' ' B' ' 106' ' ' SER . 4.1 tppp? -61.8 -41.95 98.4 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 119.046 -2.284 . . . . 78.58 107.802 177.105 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' LYS . . . . . 0.547 ' HG3' ' O ' ' B' ' 103' ' ' LYS . 0.0 OUTLIER -56.65 -19.97 19.01 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.175 -1.046 . . . . 85.73 108.175 178.791 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ILE . . . . . 0.592 ' O ' ' HB3' ' B' ' 108' ' ' LEU . 0.2 OUTLIER -74.97 -38.27 42.85 Favored 'Isoleucine or valine' 0 C--N 1.357 0.92 0 C-N-CA 115.674 -2.41 . . . . 32.57 109.964 179.646 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' GLU . . . . . 0.888 ' HA ' HD22 ' B' ' 108' ' ' LEU . 1.0 OUTLIER -104.51 -33.05 8.69 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 119.939 -0.705 . . . . 67.66 111.061 -179.432 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' SER . . . . . 0.928 ' HB2' ' HG3' ' B' ' 102' ' ' LYS . 13.7 t -51.2 -74.5 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.146 0.795 . . . . 68.61 113.146 -179.047 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' LEU . . . . . 0.599 ' O ' ' N ' ' B' ' 110' ' ' ARG . 0.7 OUTLIER -59.35 -52.84 63.92 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 107.713 -1.217 . . . . 37.56 107.713 179.27 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' LEU . . . . . 0.888 HD22 ' HA ' ' B' ' 105' ' ' GLU . 0.2 OUTLIER -48.78 -28.85 3.95 Favored 'General case' 0 CA--C 1.462 -2.409 0 O-C-N 124.868 1.355 . . . . 78.93 110.116 178.133 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' SER . . . . . 0.49 ' O ' ' HB3' ' B' ' 113' ' ' LYS . 0.2 OUTLIER -80.35 -12.9 59.54 Favored 'General case' 0 N--CA 1.419 -2.017 1 C-N-CA 110.974 -4.29 . . . . 36.75 108.543 -179.439 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' ARG . . . . . 0.905 ' HA ' ' HB3' ' B' ' 113' ' ' LYS . 0.0 OUTLIER -84.62 -21.9 30.16 Favored 'General case' 0 N--CA 1.495 1.803 1 N-CA-C 99.695 -4.187 . . . . 57.01 99.695 169.476 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' VAL . . . . . 0.862 HG13 ' HA ' ' B' ' 108' ' ' LEU 0.453 4.1 m -60.61 -68.64 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 N-CA-C 108.672 -0.862 . . . . 43.37 108.672 179.68 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' ASN . . . . . 0.427 ' OD1' HG23 ' B' ' 111' ' ' VAL . 1.9 m-20 -66.4 -6.94 16.18 Favored 'General case' 0 C--O 1.224 -0.255 0 N-CA-C 108.313 -0.995 . . . . 78.8 108.313 177.351 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' LYS . . . . . 0.905 ' HB3' ' HA ' ' B' ' 110' ' ' ARG . 0.0 OUTLIER -81.97 -66.46 0.89 Allowed 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 115.736 -0.665 . . . . 100.0 110.171 178.525 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' ARG . . . . . 0.77 ' NH1' ' HE2' ' B' ' 113' ' ' LYS . 0.6 OUTLIER -44.38 -37.37 3.33 Favored 'General case' 0 C--O 1.243 0.751 0 O-C-N 124.281 0.988 . . . . 59.93 108.44 -179.885 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -62.24 -16.5 16.3 Favored 'Isoleucine or valine' 0 C--N 1.374 1.655 0 C-N-CA 117.375 -1.73 . . . . 63.51 109.342 -176.578 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' THR . . . . . 0.576 HG23 ' O ' ' B' ' 113' ' ' LYS . 0.7 OUTLIER . . . . . 0 C--N 1.327 -0.41 0 CA-C-N 115.073 -0.967 . . . . 87.66 110.679 179.126 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 200' ' ' ' CA' . . . . . 0.825 'CA ' ' OE2' ' D' ' 11' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_