data_1jkp_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 1jkp _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 O5'-C5'-C4' 114.594 3.138 . . . . 94.94 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.62 1.062 0 C5'-C4'-C3' 111.235 -2.31 . . . . 95.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.412 -1.742 0 C4'-C3'-O3' 108.092 -1.004 . . . . 68.53 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.527 0 P-O5'-C5' 119.402 -0.937 . . . . 76.41 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.579 -1.363 0 C5'-C4'-C3' 111.338 -2.242 . . . . 73.2 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ' DT' . . . . . 0.421 ' N3 ' ' N1 ' ' B' ' 25' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.421 -1.218 0 P-O5'-C5' 118.194 -1.691 . . . . 77.27 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.457 1.008 0 O3'-P-O5' 99.409 -2.416 . . . . 53.75 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.41 -1.848 0 N19-C1'-C2' 117.105 1.816 . . . . 56.33 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 C5'-C4'-O4' 111.977 1.611 . . . . 83.55 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.503 ' N1 ' ' N3 ' ' B' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.507 -0.996 0 C3'-C2'-C1' 98.997 -2.645 . . . . 79.67 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ' DA' . . . . . 0.448 ' N1 ' ' N3 ' ' B' ' 20' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.416 -1.175 0 C5'-C4'-O4' 111.956 1.597 . . . . 70.08 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -1.021 0 O4'-C1'-N19 108.98 1.475 . . . . 79.74 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ' DG' . . . . . 0.411 " C4'" ' OP2' ' A' ' 15' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.413 -1.698 0 N19-C1'-C2' 117.124 1.827 . . . . 76.95 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ' DA' . . . . . 0.411 ' OP2' " C4'" ' A' ' 14' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.418 -1.352 0 N19-C1'-C2' 111.59 -1.632 . . . . 94.58 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ' DA' . . . . . 0.475 " C2'" " O5'" ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.54 2.182 3 C5'-C4'-C3' 127.489 8.526 . . . . 78.5 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ' DT' . . . . . 0.475 " O5'" " C2'" ' B' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.382 -3.609 0 O3'-P-O5' 98.05 -3.132 . . . . 66.72 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.564 -3.592 0 O4'-C1'-N19 106.554 -1.558 . . . . 69.97 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.41 -1.905 0 C5'-C4'-C3' 118.083 2.255 . . . . 60.25 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ' DT' . . . . . 0.448 ' N3 ' ' N1 ' ' A' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.417 -1.454 0 O3'-P-O5' 99.728 -2.249 . . . . 71.16 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ' DC' . . . . . 0.503 ' N3 ' ' N1 ' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.421 -1.207 0 O3'-P-O5' 101.14 -1.505 . . . . 94.92 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.617 0.792 0 C5'-C4'-O4' 111.765 1.478 . . . . 94.64 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.947 0 C5'-C4'-C3' 112.47 -1.487 . . . . 88.93 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 N19-C1'-C2' 116.297 1.31 . . . . 64.65 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ' DA' . . . . . 0.421 ' N1 ' ' N3 ' ' A' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.415 -1.532 0 C5'-C4'-C3' 110.899 -2.534 . . . . 77.09 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.423 -1.085 0 C5'-C4'-O4' 112.294 1.809 . . . . 80.3 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.413 -1.673 0 C5'-C4'-C3' 109.95 -3.167 . . . . 75.03 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ' DA' . . . . . 0.524 " C5'" ' CD ' ' C' ' 141' ' ' PRO . . . . . . . . 0 P--O3' 1.591 -1.315 0 O4'-C1'-N19 109.68 2.35 . . . . 78.79 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.88 0 C2'-C3'-O3' 106.342 -1.577 . . . . 85.77 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 139' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.656 0 N-CA-C 111.719 -0.552 . . . . 64.99 111.719 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 140' ' ' ARG . . . . . . . . . . . . . 37.8 ttt180 -82.77 128.84 64.45 Favored Pre-proline 0 C--N 1.331 -0.23 0 N-CA-C 107.97 -1.122 . . . . 72.0 107.97 179.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 141' ' ' PRO . . . . . 0.524 ' CD ' " C5'" ' B' ' 28' ' ' ' DA' . 75.6 Cg_endo -53.25 140.46 61.83 Favored 'Trans proline' 0 C--O 1.244 0.82 0 N-CA-C 109.976 -0.817 . . . . 60.85 109.976 179.99 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 142' ' ' ARG . . . . . . . . . . . . . 22.4 mtt-85 -61.05 173.19 0.84 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.981 -0.554 . . . . 63.38 110.243 179.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 143' ' ' ALA . . . . . . . . . . . . . . . -89.31 -29.58 19.06 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 112.918 0.71 . . . . 91.34 112.918 -179.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 144' ' ' ILE . . . . . . . . . . . . . 1.5 pt -153.09 134.49 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.122 0 N-CA-C 114.29 1.219 . . . . 68.91 114.29 -178.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 145' ' ' ASN . . . . . 0.698 ' ND2' ' OE1' ' C' ' 148' ' ' GLU . 7.7 p30 -80.39 167.87 19.69 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 113.934 1.087 . . . . 74.01 113.934 179.668 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 146' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.05 -44.23 31.09 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 112.173 0.434 . . . . 94.85 112.173 -178.429 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -58.41 -53.09 62.2 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 108.313 -0.995 . . . . 95.0 108.313 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 148' ' ' GLU . . . . . 0.698 ' OE1' ' ND2' ' C' ' 145' ' ' ASN . 47.8 mt-10 -58.16 -46.5 85.59 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 107.523 -1.288 . . . . 77.24 107.523 178.881 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 149' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -53.93 -44.13 70.35 Favored 'General case' 0 CA--C 1.508 -0.661 0 C-N-CA 120.939 -0.304 . . . . 89.21 111.512 -179.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 150' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' C' ' 151' ' ' GLN . 16.2 mt-10 -63.74 -60.16 3.66 Favored 'General case' 0 CA--C 1.495 -1.138 0 CA-C-O 122.007 0.908 . . . . 95.0 109.245 179.272 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 151' ' ' GLN . . . . . 0.435 ' C ' ' O ' ' C' ' 150' ' ' GLU . 21.4 tt0 -41.38 -57.28 2.22 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 114.076 -1.42 . . . . 94.87 108.036 177.973 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 152' ' ' ILE . . . . . . . . . . . . . 40.9 mt -60.18 -52.48 60.83 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.845 0 N-CA-C 114.658 1.355 . . . . 68.12 114.658 -179.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 153' ' ' SER . . . . . . . . . . . . . 20.0 t -52.76 -31.67 39.48 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.143 -0.623 . . . . 63.72 111.692 -178.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 154' ' ' ARG . . . . . . . . . . . . . 22.1 ttm180 -74.98 -54.52 7.04 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 107.187 -1.412 . . . . 81.54 107.187 179.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 155' ' ' LEU . . . . . . . . . . . . . 53.7 mt -52.04 -38.01 55.51 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 111.678 0.251 . . . . 61.78 111.678 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 156' ' ' LEU . . . . . . . . . . . . . 15.2 mt -67.97 -28.32 67.35 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 120.649 0.262 . . . . 94.65 111.003 -179.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . . . -88.44 -1.87 58.29 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.348 0.594 . . . . 80.78 112.504 -179.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 158' ' ' LYS . . . . . . . . . . . . . 45.3 mttt -95.93 -10.7 28.07 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.406 -1.331 . . . . 84.81 107.406 177.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 159' ' ' GLY . . . . . . . . . . . . . . . 114.29 -1.82 23.81 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 115.798 1.079 . . . . 78.97 115.798 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 160' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -63.52 130.35 94.26 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 117.806 0.803 . . . . 86.81 111.888 179.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 161' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -70.05 138.26 36.49 Favored 'Trans proline' 0 CA--C 1.51 -0.719 0 C-N-CA 122.991 2.461 . . . . 66.96 110.91 -179.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 162' ' ' ARG . . . . . . . . . . . . . 38.7 mtt85 -59.66 -31.62 69.72 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 119.147 -1.021 . . . . 61.42 110.201 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 163' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -57.76 -45.62 85.65 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 119.64 -0.824 . . . . 95.0 109.701 -179.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 164' ' ' GLN . . . . . . . . . . . . . . . -65.6 -63.62 1.05 Allowed 'General case' 0 CA--C 1.5 -0.967 0 CA-C-N 115.707 -0.678 . . . . 70.83 110.666 -179.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 165' ' ' LEU . . . . . . . . . . . . . 25.1 mt -43.68 -36.14 2.08 Favored 'General case' 0 N--CA 1.464 0.248 0 O-C-N 124.398 1.061 . . . . 51.78 111.426 178.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.87 -53.43 46.83 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.298 0.639 . . . . 57.56 110.315 179.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 167' ' ' ILE . . . . . . . . . . . . . 15.2 mt -57.52 -41.88 79.83 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 N-CA-C 109.506 -0.553 . . . . 67.25 109.506 179.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 168' ' ' ILE . . . . . . . . . . . . . 62.1 mt -67.55 -61.32 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 115.236 1.569 . . . . 94.96 115.236 -178.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 169' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -68.33 9.66 0.31 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 115.334 1.605 . . . . 95.0 115.334 -179.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 170' ' ' GLY . . . . . . . . . . . . . . . 60.53 43.69 98.57 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 119.62 -1.276 . . . . 79.66 114.494 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 171' ' ' ILE . . . . . . . . . . . . . 30.4 pt -146.48 151.77 14.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 O-C-N 122.151 -0.617 . . . . 58.53 109.924 178.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 172' ' ' GLY . . . . . . . . . . . . . . . -74.38 151.73 43.87 Favored Glycine 0 C--O 1.246 0.846 0 N-CA-C 116.564 1.386 . . . . 51.85 116.564 -178.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 173' ' ' VAL . . . . . . . . . . . . . 38.4 t -57.47 -44.62 85.05 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.943 0 N-CA-C 115.61 1.708 . . . . 44.62 115.61 -177.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 174' ' ' SER . . . . . . . . . . . . . 2.4 p -57.92 -31.05 66.42 Favored 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 119.129 -1.029 . . . . 55.01 110.07 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 175' ' ' THR . . . . . . . . . . . . . 54.9 m -63.63 -48.33 77.72 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 108.922 -0.77 . . . . 67.21 108.922 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 176' ' ' LEU . . . . . . . . . . . . . 35.3 mt -59.2 -46.99 86.96 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 113.335 0.865 . . . . 65.64 113.335 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 177' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -58.79 -24.82 62.42 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 119.74 -0.784 . . . . 42.46 109.906 -179.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 178' ' ' ARG . . . . . . . . . . . . 0.526 8.2 ttp85 -76.65 -49.98 14.86 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 114.989 -1.005 . . . . 43.47 109.122 179.362 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 179' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -70.88 -19.4 62.62 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 120.166 -0.614 . . . . 65.57 111.676 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 180' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -152.56 91.74 3.51 Favored Pre-proline 0 CA--C 1.5 -0.969 0 O-C-N 121.877 -0.514 . . . . 63.99 110.428 179.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 181' ' ' PRO . . . . . 0.463 ' O ' ' N ' ' C' ' 184' ' ' SER . 52.5 Cg_exo -61.89 143.88 96.08 Favored 'Trans proline' 0 CA--C 1.514 -0.488 0 C-N-CA 122.117 1.878 . . . . 63.6 108.197 179.623 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 182' ' ' ALA . . . . . . . . . . . . . . . -58.2 -20.07 38.52 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 119.935 -0.706 . . . . 70.09 109.534 -179.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 183' ' ' SER . . . . . . . . . . . . . 29.9 p -96.78 20.45 10.95 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 107.407 -1.331 . . . . 89.03 107.407 178.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 184' ' ' SER . . . . . 0.463 ' N ' ' O ' ' C' ' 181' ' ' PRO . 11.0 p -125.88 41.3 3.55 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 109.509 -0.552 . . . . 95.0 109.509 178.661 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 185' ' ' ILE . . . . . . . . . . . . . 15.9 mm . . . . . 0 C--O 1.253 1.267 0 CA-C-O 116.826 -1.559 . . . . 95.0 113.051 -178.32 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ' DT' . . . . . 0.454 H2'' ' OP2' ' A' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 O5'-C5'-C4' 114.594 3.138 . . . . 94.939999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ' DG' . . . . . 0.536 H2'' ' H72' ' A' ' 4' ' ' ' DT' . . . . . . . . 0 P--O3' 1.62 1.062 0 C5'-C4'-C3' 111.235 -2.31 . . . . 95.0 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ' DT' . . . . . 0.536 ' H72' H2'' ' A' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.412 -1.742 0 C4'-C3'-O3' 108.092 -1.004 . . . . 68.530000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.527 0 P-O5'-C5' 119.402 -0.937 . . . . 76.409999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.579 -1.363 0 C5'-C4'-C3' 111.338 -2.242 . . . . 73.200000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.218 0 P-O5'-C5' 118.194 -1.691 . . . . 77.269999999999996 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ' DT' . . . . . 0.491 " H4'" ' HE ' ' C' ' 140' ' ' ARG . . . . . . . . 0 O4'--C4' 1.457 1.008 0 O3'-P-O5' 99.409 -2.416 . . . . 53.75 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.41 -1.848 0 N19-C1'-C2' 117.105 1.816 . . . . 56.329999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 C5'-C4'-O4' 111.977 1.611 . . . . 83.549999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.996 0 C3'-C2'-C1' 98.997 -2.645 . . . . 79.670000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ' DA' . . . . . 0.554 H2'' ' C8 ' ' A' ' 13' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.416 -1.175 0 C5'-C4'-O4' 111.956 1.597 . . . . 70.079999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ' DA' . . . . . 0.554 ' C8 ' H2'' ' A' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.021 0 O4'-C1'-N19 108.98 1.475 . . . . 79.739999999999995 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ' DG' . . . . . 0.744 " H4'" ' OP2' ' A' ' 15' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.413 -1.698 0 N19-C1'-C2' 117.124 1.827 . . . . 76.950000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ' DA' . . . . . 0.744 ' OP2' " H4'" ' A' ' 14' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.418 -1.352 0 N19-C1'-C2' 111.59 -1.632 . . . . 94.579999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ' DA' . . . . . 0.638 H2'' " O5'" ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.54 2.182 3 C5'-C4'-C3' 127.489 8.526 . . . . 78.5 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ' DT' . . . . . 0.638 " O5'" H2'' ' B' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.382 -3.609 0 O3'-P-O5' 98.05 -3.132 . . . . 66.719999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.564 -3.592 0 O4'-C1'-N19 106.554 -1.558 . . . . 69.969999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.41 -1.905 0 C5'-C4'-C3' 118.083 2.255 . . . . 60.25 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.417 -1.454 0 O3'-P-O5' 99.728 -2.249 . . . . 71.159999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ' DC' . . . . . 0.453 ' H5 ' ' O ' ' B' ' 203' ' ' HOH . . . . . . . . 0 O5'--C5' 1.421 -1.207 0 O3'-P-O5' 101.14 -1.505 . . . . 94.920000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ' DT' . . . . . 0.624 ' H71' HH12 ' C' ' 178' ' ' ARG . . . . . . . . 0 P--O3' 1.617 0.792 0 C5'-C4'-O4' 111.765 1.478 . . . . 94.640000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ' DC' . . . . . 0.506 ' C6 ' H2'' ' B' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.947 0 C5'-C4'-C3' 112.47 -1.487 . . . . 88.930000000000007 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 N19-C1'-C2' 116.297 1.31 . . . . 64.650000000000006 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.532 0 C5'-C4'-C3' 110.899 -2.534 . . . . 77.090000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ' DA' . . . . . 0.416 ' N3 ' ' HD2' ' C' ' 140' ' ' ARG . . . . . . . . 0 O5'--C5' 1.423 -1.085 0 C5'-C4'-O4' 112.294 1.809 . . . . 80.299999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ' DA' . . . . . 0.522 " H5'" ' NH1' ' C' ' 140' ' ' ARG . . . . . . . . 0 O5'--C5' 1.413 -1.673 0 C5'-C4'-C3' 109.95 -3.167 . . . . 75.030000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ' DA' . . . . . 1.103 " H5'" ' HD3' ' C' ' 141' ' ' PRO . . . . . . . . 0 P--O3' 1.591 -1.315 0 O4'-C1'-N19 109.68 2.35 . . . . 78.790000000000006 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ' DC' . . . . . 0.419 ' OP2' H2'' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.88 0 C2'-C3'-O3' 106.342 -1.577 . . . . 85.769999999999996 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 139' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.656 0 N-CA-C 111.719 -0.552 . . . . 64.989999999999995 111.719 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 140' ' ' ARG . . . . . 0.522 ' NH1' " H5'" ' B' ' 27' ' ' ' DA' . 37.8 ttt180 -82.77 128.84 64.45 Favored Pre-proline 0 C--N 1.331 -0.23 0 N-CA-C 107.97 -1.122 . . . . 72.0 107.97 179.03 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 141' ' ' PRO . . . . . 1.103 ' HD3' " H5'" ' B' ' 28' ' ' ' DA' . 75.6 Cg_endo -53.25 140.46 61.83 Favored 'Trans proline' 0 C--O 1.244 0.82 0 N-CA-C 109.976 -0.817 . . . . 60.850000000000001 109.976 179.99 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 142' ' ' ARG . . . . . . . . . . . . . 22.4 mtt-85 -61.05 173.19 0.84 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.981 -0.554 . . . . 63.380000000000003 110.243 179.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 143' ' ' ALA . . . . . 0.401 ' C ' HG23 ' C' ' 144' ' ' ILE . . . -89.31 -29.58 19.06 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 112.918 0.71 . . . . 91.340000000000003 112.918 -179.56 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 144' ' ' ILE . . . . . 0.477 ' HA ' ' OE1' ' C' ' 148' ' ' GLU . 1.5 pt -153.09 134.49 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.122 0 N-CA-C 114.29 1.219 . . . . 68.909999999999997 114.29 -178.699 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 145' ' ' ASN . . . . . 0.698 ' ND2' ' OE1' ' C' ' 148' ' ' GLU . 7.7 p30 -80.39 167.87 19.69 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 113.934 1.087 . . . . 74.010000000000005 113.934 179.668 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 146' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.05 -44.23 31.09 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 112.173 0.434 . . . . 94.849999999999994 112.173 -178.429 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -58.41 -53.09 62.2 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 108.313 -0.995 . . . . 95.0 108.313 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 148' ' ' GLU . . . . . 0.698 ' OE1' ' ND2' ' C' ' 145' ' ' ASN . 47.8 mt-10 -58.16 -46.5 85.59 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 107.523 -1.288 . . . . 77.239999999999995 107.523 178.881 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 149' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -53.93 -44.13 70.35 Favored 'General case' 0 CA--C 1.508 -0.661 0 C-N-CA 120.939 -0.304 . . . . 89.209999999999994 111.512 -179.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 150' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' C' ' 151' ' ' GLN . 16.2 mt-10 -63.74 -60.16 3.66 Favored 'General case' 0 CA--C 1.495 -1.138 0 CA-C-O 122.007 0.908 . . . . 95.0 109.245 179.272 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 151' ' ' GLN . . . . . 0.435 ' C ' ' O ' ' C' ' 150' ' ' GLU . 21.4 tt0 -41.38 -57.28 2.22 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 114.076 -1.42 . . . . 94.870000000000005 108.036 177.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 152' ' ' ILE . . . . . . . . . . . . . 40.9 mt -60.18 -52.48 60.83 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.845 0 N-CA-C 114.658 1.355 . . . . 68.120000000000005 114.658 -179.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 153' ' ' SER . . . . . . . . . . . . . 20.0 t -52.76 -31.67 39.48 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.143 -0.623 . . . . 63.719999999999999 111.692 -178.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 154' ' ' ARG . . . . . . . . . . . . . 22.1 ttm180 -74.98 -54.52 7.04 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 107.187 -1.412 . . . . 81.540000000000006 107.187 179.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 155' ' ' LEU . . . . . . . . . . . . . 53.7 mt -52.04 -38.01 55.51 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 111.678 0.251 . . . . 61.780000000000001 111.678 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 156' ' ' LEU . . . . . 0.423 ' CD2' HD12 ' C' ' 165' ' ' LEU . 15.2 mt -67.97 -28.32 67.35 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 120.649 0.262 . . . . 94.650000000000006 111.003 -179.688 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . . . -88.44 -1.87 58.29 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.348 0.594 . . . . 80.780000000000001 112.504 -179.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 158' ' ' LYS . . . . . . . . . . . . . 45.3 mttt -95.93 -10.7 28.07 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.406 -1.331 . . . . 84.810000000000002 107.406 177.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 159' ' ' GLY . . . . . . . . . . . . . . . 114.29 -1.82 23.81 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 115.798 1.079 . . . . 78.969999999999999 115.798 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 160' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -63.52 130.35 94.26 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 117.806 0.803 . . . . 86.810000000000002 111.888 179.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 161' ' ' PRO . . . . . 0.469 ' HG2' ' CB ' ' C' ' 164' ' ' GLN . 25.1 Cg_endo -70.05 138.26 36.49 Favored 'Trans proline' 0 CA--C 1.51 -0.719 0 C-N-CA 122.991 2.461 . . . . 66.959999999999994 110.91 -179.888 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 162' ' ' ARG . . . . . 0.53 ' HD2' ' CE1' ' C' ' 177' ' ' TYR . 38.7 mtt85 -59.66 -31.62 69.72 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 119.147 -1.021 . . . . 61.420000000000002 110.201 179.775 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 163' ' ' GLN . . . . . 0.659 ' O ' HG13 ' C' ' 167' ' ' ILE . 3.3 mt-30 -57.76 -45.62 85.65 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 119.64 -0.824 . . . . 95.0 109.701 -179.57 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 164' ' ' GLN . . . . . 0.469 ' CB ' ' HG2' ' C' ' 161' ' ' PRO . . . -65.6 -63.62 1.05 Allowed 'General case' 0 CA--C 1.5 -0.967 0 CA-C-N 115.707 -0.678 . . . . 70.829999999999998 110.666 -179.467 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 165' ' ' LEU . . . . . 0.423 HD12 ' CD2' ' C' ' 156' ' ' LEU . 25.1 mt -43.68 -36.14 2.08 Favored 'General case' 0 N--CA 1.464 0.248 0 O-C-N 124.398 1.061 . . . . 51.780000000000001 111.426 178.562 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.87 -53.43 46.83 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.298 0.639 . . . . 57.560000000000002 110.315 179.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 167' ' ' ILE . . . . . 0.659 HG13 ' O ' ' C' ' 163' ' ' GLN . 15.2 mt -57.52 -41.88 79.83 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 N-CA-C 109.506 -0.553 . . . . 67.25 109.506 179.104 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 168' ' ' ILE . . . . . . . . . . . . . 62.1 mt -67.55 -61.32 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 115.236 1.569 . . . . 94.959999999999994 115.236 -178.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 169' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -68.33 9.66 0.31 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 115.334 1.605 . . . . 95.0 115.334 -179.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 170' ' ' GLY . . . . . . . . . . . . . . . 60.53 43.69 98.57 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 119.62 -1.276 . . . . 79.659999999999997 114.494 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 171' ' ' ILE . . . . . . . . . . . . . 30.4 pt -146.48 151.77 14.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 O-C-N 122.151 -0.617 . . . . 58.530000000000001 109.924 178.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 172' ' ' GLY . . . . . . . . . . . . . . . -74.38 151.73 43.87 Favored Glycine 0 C--O 1.246 0.846 0 N-CA-C 116.564 1.386 . . . . 51.850000000000001 116.564 -178.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 173' ' ' VAL . . . . . . . . . . . . . 38.4 t -57.47 -44.62 85.05 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.943 0 N-CA-C 115.61 1.708 . . . . 44.619999999999997 115.61 -177.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 174' ' ' SER . . . . . . . . . . . . . 2.4 p -57.92 -31.05 66.42 Favored 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 119.129 -1.029 . . . . 55.009999999999998 110.07 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 175' ' ' THR . . . . . 0.798 ' O ' ' HB3' ' C' ' 178' ' ' ARG . 54.9 m -63.63 -48.33 77.72 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 108.922 -0.77 . . . . 67.209999999999994 108.922 179.295 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 176' ' ' LEU . . . . . . . . . . . . . 35.3 mt -59.2 -46.99 86.96 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 113.335 0.865 . . . . 65.640000000000001 113.335 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 177' ' ' TYR . . . . . 0.53 ' CE1' ' HD2' ' C' ' 162' ' ' ARG . 33.8 m-85 -58.79 -24.82 62.42 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 119.74 -0.784 . . . . 42.460000000000001 109.906 -179.074 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 178' ' ' ARG . . . . . 0.798 ' HB3' ' O ' ' C' ' 175' ' ' THR 0.526 8.2 ttp85 -76.65 -49.98 14.86 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 114.989 -1.005 . . . . 50.170000000000002 109.122 179.362 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 179' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -70.88 -19.4 62.62 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 120.166 -0.614 . . . . 65.569999999999993 111.676 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 180' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -152.56 91.74 3.51 Favored Pre-proline 0 CA--C 1.5 -0.969 0 O-C-N 121.877 -0.514 . . . . 63.990000000000002 110.428 179.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 181' ' ' PRO . . . . . 0.434 ' HD2' ' CB ' ' C' ' 184' ' ' SER . 52.5 Cg_exo -61.89 143.88 96.08 Favored 'Trans proline' 0 CA--C 1.514 -0.488 0 C-N-CA 122.117 1.878 . . . . 63.600000000000001 108.197 179.623 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 182' ' ' ALA . . . . . . . . . . . . . . . -58.2 -20.07 38.52 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 119.935 -0.706 . . . . 70.090000000000003 109.534 -179.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 183' ' ' SER . . . . . . . . . . . . . 29.9 p -96.78 20.45 10.95 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 107.407 -1.331 . . . . 89.030000000000001 107.407 178.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 184' ' ' SER . . . . . 0.434 ' CB ' ' HD2' ' C' ' 181' ' ' PRO . 11.0 p -125.88 41.3 3.55 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 109.509 -0.552 . . . . 95.0 109.509 178.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 185' ' ' ILE . . . . . . . . . . . . . 15.9 mm . . . . . 0 C--O 1.253 1.267 0 CA-C-O 116.826 -1.559 . . . . 95.0 113.051 -178.32 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . 0.453 ' O ' ' H5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ' DT' . . . . . 0.454 H2'' ' OP2' ' A' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 O5'-C5'-C4' 114.594 3.138 . . . . 94.939999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ' DG' . . . . . 0.536 H2'' ' H72' ' A' ' 4' ' ' ' DT' . . . . . . . . 0 P--O3' 1.62 1.062 0 C5'-C4'-C3' 111.235 -2.31 . . . . 95.0 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ' DT' . . . . . 0.536 ' H72' H2'' ' A' ' 3' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.412 -1.742 0 C4'-C3'-O3' 108.092 -1.004 . . . . 68.530000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.527 0 P-O5'-C5' 119.402 -0.937 . . . . 76.409999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.579 -1.363 0 C5'-C4'-C3' 111.338 -2.242 . . . . 73.200000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.218 0 P-O5'-C5' 118.194 -1.691 . . . . 77.269999999999996 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ' DT' . . . . . 0.491 " H4'" ' HE ' ' C' ' 140' ' ' ARG . . . . . . . . 0 O4'--C4' 1.457 1.008 0 O3'-P-O5' 99.409 -2.416 . . . . 53.75 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.41 -1.848 0 N19-C1'-C2' 117.105 1.816 . . . . 56.329999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.619 0 C5'-C4'-O4' 111.977 1.611 . . . . 83.549999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.996 0 C3'-C2'-C1' 98.997 -2.645 . . . . 79.670000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ' DA' . . . . . 0.554 H2'' ' C8 ' ' A' ' 13' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.416 -1.175 0 C5'-C4'-O4' 111.956 1.597 . . . . 70.079999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ' DA' . . . . . 0.554 ' C8 ' H2'' ' A' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.021 0 O4'-C1'-N19 108.98 1.475 . . . . 79.739999999999995 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ' DG' . . . . . 0.744 " H4'" ' OP2' ' A' ' 15' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.413 -1.698 0 N19-C1'-C2' 117.124 1.827 . . . . 76.950000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ' DA' . . . . . 0.744 ' OP2' " H4'" ' A' ' 14' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.418 -1.352 0 N19-C1'-C2' 111.59 -1.632 . . . . 94.579999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ' DA' . . . . . 0.638 H2'' " O5'" ' B' ' 17' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.54 2.182 3 C5'-C4'-C3' 127.489 8.526 . . . . 78.5 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ' DT' . . . . . 0.638 " O5'" H2'' ' B' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.382 -3.609 0 O3'-P-O5' 98.05 -3.132 . . . . 66.719999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.564 -3.592 0 O4'-C1'-N19 106.554 -1.558 . . . . 69.969999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.41 -1.905 0 C5'-C4'-C3' 118.083 2.255 . . . . 60.25 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.417 -1.454 0 O3'-P-O5' 99.728 -2.249 . . . . 71.159999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ' DC' . . . . . 0.453 ' H5 ' ' O ' ' B' ' 203' ' ' HOH . . . . . . . . 0 O5'--C5' 1.421 -1.207 0 O3'-P-O5' 101.14 -1.505 . . . . 94.920000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ' DT' . . . . . 0.624 ' H71' HH12 ' C' ' 178' ' ' ARG . . . . . . . . 0 P--O3' 1.617 0.792 0 C5'-C4'-O4' 111.765 1.478 . . . . 94.640000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ' DC' . . . . . 0.506 ' C6 ' H2'' ' B' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.947 0 C5'-C4'-C3' 112.47 -1.487 . . . . 88.930000000000007 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 N19-C1'-C2' 116.297 1.31 . . . . 64.650000000000006 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.532 0 C5'-C4'-C3' 110.899 -2.534 . . . . 77.090000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ' DA' . . . . . 0.416 ' N3 ' ' HD2' ' C' ' 140' ' ' ARG . . . . . . . . 0 O5'--C5' 1.423 -1.085 0 C5'-C4'-O4' 112.294 1.809 . . . . 80.299999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ' DA' . . . . . 0.522 " H5'" ' NH1' ' C' ' 140' ' ' ARG . . . . . . . . 0 O5'--C5' 1.413 -1.673 0 C5'-C4'-C3' 109.95 -3.167 . . . . 75.030000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ' DA' . . . . . 1.103 " H5'" ' HD3' ' C' ' 141' ' ' PRO . . . . . . . . 0 P--O3' 1.591 -1.315 0 O4'-C1'-N19 109.68 2.35 . . . . 78.790000000000006 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ' DC' . . . . . 0.419 ' OP2' H2'' ' B' ' 28' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.88 0 C2'-C3'-O3' 106.342 -1.577 . . . . 85.769999999999996 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 139' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.656 0 N-CA-C 111.719 -0.552 . . . . 64.989999999999995 111.719 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 140' ' ' ARG . . . . . 0.522 ' NH1' " H5'" ' B' ' 27' ' ' ' DA' . 37.8 ttt180 -82.77 128.84 64.45 Favored Pre-proline 0 C--N 1.331 -0.23 0 N-CA-C 107.97 -1.122 . . . . 72.0 107.97 179.03 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 141' ' ' PRO . . . . . 1.103 ' HD3' " H5'" ' B' ' 28' ' ' ' DA' . 75.6 Cg_endo -53.25 140.46 61.83 Favored 'Trans proline' 0 C--O 1.244 0.82 0 N-CA-C 109.976 -0.817 . . . . 60.850000000000001 109.976 179.99 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 142' ' ' ARG . . . . . . . . . . . . . 22.4 mtt-85 -61.05 173.19 0.84 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.981 -0.554 . . . . 63.380000000000003 110.243 179.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 143' ' ' ALA . . . . . 0.401 ' C ' HG23 ' C' ' 144' ' ' ILE . . . -89.31 -29.58 19.06 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 112.918 0.71 . . . . 91.340000000000003 112.918 -179.56 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 144' ' ' ILE . . . . . 0.477 ' HA ' ' OE1' ' C' ' 148' ' ' GLU . 1.5 pt -153.09 134.49 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.122 0 N-CA-C 114.29 1.219 . . . . 68.909999999999997 114.29 -178.699 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 145' ' ' ASN . . . . . 0.698 ' ND2' ' OE1' ' C' ' 148' ' ' GLU . 7.7 p30 -80.39 167.87 19.69 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 113.934 1.087 . . . . 74.010000000000005 113.934 179.668 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 146' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.05 -44.23 31.09 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 112.173 0.434 . . . . 94.849999999999994 112.173 -178.429 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 147' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -58.41 -53.09 62.2 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 108.313 -0.995 . . . . 95.0 108.313 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 148' ' ' GLU . . . . . 0.698 ' OE1' ' ND2' ' C' ' 145' ' ' ASN . 47.8 mt-10 -58.16 -46.5 85.59 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 107.523 -1.288 . . . . 77.239999999999995 107.523 178.881 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 149' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -53.93 -44.13 70.35 Favored 'General case' 0 CA--C 1.508 -0.661 0 C-N-CA 120.939 -0.304 . . . . 89.209999999999994 111.512 -179.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 150' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' C' ' 151' ' ' GLN . 16.2 mt-10 -63.74 -60.16 3.66 Favored 'General case' 0 CA--C 1.495 -1.138 0 CA-C-O 122.007 0.908 . . . . 95.0 109.245 179.272 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 151' ' ' GLN . . . . . 0.435 ' C ' ' O ' ' C' ' 150' ' ' GLU . 21.4 tt0 -41.38 -57.28 2.22 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 114.076 -1.42 . . . . 94.870000000000005 108.036 177.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 152' ' ' ILE . . . . . . . . . . . . . 40.9 mt -60.18 -52.48 60.83 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.845 0 N-CA-C 114.658 1.355 . . . . 68.120000000000005 114.658 -179.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 153' ' ' SER . . . . . . . . . . . . . 20.0 t -52.76 -31.67 39.48 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.143 -0.623 . . . . 63.719999999999999 111.692 -178.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 154' ' ' ARG . . . . . . . . . . . . . 22.1 ttm180 -74.98 -54.52 7.04 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 107.187 -1.412 . . . . 81.540000000000006 107.187 179.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 155' ' ' LEU . . . . . . . . . . . . . 53.7 mt -52.04 -38.01 55.51 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 111.678 0.251 . . . . 61.780000000000001 111.678 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 156' ' ' LEU . . . . . 0.423 ' CD2' HD12 ' C' ' 165' ' ' LEU . 15.2 mt -67.97 -28.32 67.35 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 120.649 0.262 . . . . 94.650000000000006 111.003 -179.688 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 157' ' ' GLU . . . . . . . . . . . . . . . -88.44 -1.87 58.29 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.348 0.594 . . . . 80.780000000000001 112.504 -179.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 158' ' ' LYS . . . . . . . . . . . . . 45.3 mttt -95.93 -10.7 28.07 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.406 -1.331 . . . . 84.810000000000002 107.406 177.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 159' ' ' GLY . . . . . . . . . . . . . . . 114.29 -1.82 23.81 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 115.798 1.079 . . . . 78.969999999999999 115.798 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 160' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -63.52 130.35 94.26 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 117.806 0.803 . . . . 86.810000000000002 111.888 179.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 161' ' ' PRO . . . . . 0.469 ' HG2' ' CB ' ' C' ' 164' ' ' GLN . 25.1 Cg_endo -70.05 138.26 36.49 Favored 'Trans proline' 0 CA--C 1.51 -0.719 0 C-N-CA 122.991 2.461 . . . . 66.959999999999994 110.91 -179.888 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 162' ' ' ARG . . . . . 0.53 ' HD2' ' CE1' ' C' ' 177' ' ' TYR . 38.7 mtt85 -59.66 -31.62 69.72 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 119.147 -1.021 . . . . 61.420000000000002 110.201 179.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 163' ' ' GLN . . . . . 0.659 ' O ' HG13 ' C' ' 167' ' ' ILE . 3.3 mt-30 -57.76 -45.62 85.65 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 119.64 -0.824 . . . . 95.0 109.701 -179.57 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 164' ' ' GLN . . . . . 0.469 ' CB ' ' HG2' ' C' ' 161' ' ' PRO . . . -65.6 -63.62 1.05 Allowed 'General case' 0 CA--C 1.5 -0.967 0 CA-C-N 115.707 -0.678 . . . . 70.829999999999998 110.666 -179.467 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 165' ' ' LEU . . . . . 0.423 HD12 ' CD2' ' C' ' 156' ' ' LEU . 25.1 mt -43.68 -36.14 2.08 Favored 'General case' 0 N--CA 1.464 0.248 0 O-C-N 124.398 1.061 . . . . 51.780000000000001 111.426 178.562 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.87 -53.43 46.83 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.298 0.639 . . . . 57.560000000000002 110.315 179.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 167' ' ' ILE . . . . . 0.659 HG13 ' O ' ' C' ' 163' ' ' GLN . 15.2 mt -57.52 -41.88 79.83 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 N-CA-C 109.506 -0.553 . . . . 67.25 109.506 179.104 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 168' ' ' ILE . . . . . . . . . . . . . 62.1 mt -67.55 -61.32 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 115.236 1.569 . . . . 94.959999999999994 115.236 -178.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 169' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -68.33 9.66 0.31 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 115.334 1.605 . . . . 95.0 115.334 -179.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 170' ' ' GLY . . . . . . . . . . . . . . . 60.53 43.69 98.57 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 119.62 -1.276 . . . . 79.659999999999997 114.494 -179.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 171' ' ' ILE . . . . . . . . . . . . . 30.4 pt -146.48 151.77 14.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 O-C-N 122.151 -0.617 . . . . 58.530000000000001 109.924 178.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 172' ' ' GLY . . . . . . . . . . . . . . . -74.38 151.73 43.87 Favored Glycine 0 C--O 1.246 0.846 0 N-CA-C 116.564 1.386 . . . . 51.850000000000001 116.564 -178.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 173' ' ' VAL . . . . . . . . . . . . . 38.4 t -57.47 -44.62 85.05 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.943 0 N-CA-C 115.61 1.708 . . . . 44.619999999999997 115.61 -177.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 174' ' ' SER . . . . . . . . . . . . . 2.4 p -57.92 -31.05 66.42 Favored 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 119.129 -1.029 . . . . 55.009999999999998 110.07 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 175' ' ' THR . . . . . 0.798 ' O ' ' HB3' ' C' ' 178' ' ' ARG . 54.9 m -63.63 -48.33 77.72 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 108.922 -0.77 . . . . 67.209999999999994 108.922 179.295 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 176' ' ' LEU . . . . . . . . . . . . . 35.3 mt -59.2 -46.99 86.96 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 113.335 0.865 . . . . 65.640000000000001 113.335 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 177' ' ' TYR . . . . . 0.53 ' CE1' ' HD2' ' C' ' 162' ' ' ARG . 33.8 m-85 -58.79 -24.82 62.42 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 119.74 -0.784 . . . . 42.460000000000001 109.906 -179.074 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 178' ' ' ARG . . . . . 0.798 ' HB3' ' O ' ' C' ' 175' ' ' THR 0.526 8.2 ttp85 -76.65 -49.98 14.86 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 114.989 -1.005 . . . . 50.170000000000002 109.122 179.362 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 179' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -70.88 -19.4 62.62 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 120.166 -0.614 . . . . 65.569999999999993 111.676 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 180' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -152.56 91.74 3.51 Favored Pre-proline 0 CA--C 1.5 -0.969 0 O-C-N 121.877 -0.514 . . . . 63.990000000000002 110.428 179.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 181' ' ' PRO . . . . . 0.434 ' HD2' ' CB ' ' C' ' 184' ' ' SER . 52.5 Cg_exo -61.89 143.88 96.08 Favored 'Trans proline' 0 CA--C 1.514 -0.488 0 C-N-CA 122.117 1.878 . . . . 63.600000000000001 108.197 179.623 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 182' ' ' ALA . . . . . . . . . . . . . . . -58.2 -20.07 38.52 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 119.935 -0.706 . . . . 70.090000000000003 109.534 -179.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 183' ' ' SER . . . . . . . . . . . . . 29.9 p -96.78 20.45 10.95 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 107.407 -1.331 . . . . 89.030000000000001 107.407 178.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 184' ' ' SER . . . . . 0.434 ' CB ' ' HD2' ' C' ' 181' ' ' PRO . 11.0 p -125.88 41.3 3.55 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 109.509 -0.552 . . . . 95.0 109.509 178.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 185' ' ' ILE . . . . . . . . . . . . . 15.9 mm . . . . . 0 C--O 1.253 1.267 0 CA-C-O 116.826 -1.559 . . . . 95.0 113.051 -178.32 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . 0.453 ' O ' ' H5 ' ' B' ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_