data_4s2q_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 4s2q _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 ' 3' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 O3'--C3' 1.368 -4.838 1 C3'-C2'-C1' 95.485 -5.153 . . . . 235.54 . . . . . . . . . . 2 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.407 -2.04 2 O4'-C4'-C3' 100.939 -4.661 . . . . 116.61 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.41 -1.642 0 C4'-C3'-O3' 106.1 -1.909 . . . . 113.68 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.4 -2.522 1 P-O5'-C5' 114.167 -4.208 . . . . 126.71 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.392 -2.978 1 O4'-C1'-N19 111.141 4.176 . . . . 98.36 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.406 -1.907 0 P-O5'-C5' 117.079 -2.388 . . . . 91.81 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.394 -2.855 0 P-O5'-C5' 115.19 -3.569 . . . . 83.6 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.413 -1.688 0 P-O5'-C5' 116.38 -2.825 . . . . 81.42 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.411 -1.803 1 P-O5'-C5' 114.307 -4.12 . . . . 96.13 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.405 -2.191 1 C1'-O4'-C4' 103.962 -4.098 . . . . 90.95 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.57 0 C3'-C2'-C1' 105.433 1.952 . . . . 102.64 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ' DT' . . . . . 0.452 ' O4 ' ' N6 ' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.409 -1.655 0 C3'-C2'-C1' 97.927 -3.41 . . . . 106.28 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ' DC' . . . . . 0.579 ' N4 ' ' O6 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.392 -3.031 0 O4'-C1'-C2' 109.831 3.392 . . . . 137.05 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ' DC' . . . . . 0.737 ' N4 ' ' O6 ' ' B' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.404 -2.247 0 C4'-C3'-C2' 106.972 3.772 . . . . 141.65 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.42 -1.238 2 O4'-C1'-N19 111.873 5.091 . . . . 181.7 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.384 0 P-O5'-C5' 124.695 2.372 . . . . 166.08 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 0' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.608 1.48 0 C3'-C2'-C1' 99.055 -2.603 . . . . 225.68 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ' DG' . . . . . 0.737 ' O6 ' ' N4 ' ' A' ' 16' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.397 -2.648 0 C3'-C2'-C1' 97.787 -3.51 . . . . 173.48 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.579 ' O6 ' ' N4 ' ' A' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.409 -1.909 1 O4'-C1'-N19 111.545 4.681 . . . . 128.62 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.452 ' N6 ' ' O4 ' ' A' ' 14' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.417 -1.087 1 O4'-C1'-N19 112.193 5.492 . . . . 135.99 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.414 -1.614 0 C4'-C3'-C2' 105.08 1.88 . . . . 121.64 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.203 0 O4'-C1'-N19 110.661 3.576 . . . . 122.86 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ' DA' . . . . . 0.458 ' N3 ' ' OH ' ' D' ' 137' ' ' TYR . . . . . . . . 0 O3'--C3' 1.408 -1.743 0 C4'-C3'-C2' 105.771 2.571 . . . . 110.76 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.402 -2.233 0 O4'-C1'-C2' 102.658 -3.129 . . . . 94.99 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.394 -2.832 0 O4'-C1'-N19 110.745 3.681 . . . . 77.65 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.396 -2.674 0 O4'-C1'-C2' 110.112 3.647 . . . . 80.98 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.398 -2.572 1 O4'-C1'-N19 104.531 -4.086 . . . . 93.72 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.536 1.834 0 C4'-C3'-O3' 105.591 -2.141 . . . . 87.8 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.41 -1.618 1 P-O5'-C5' 112.697 -5.127 . . . . 113.5 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.414 -1.275 1 C3'-C2'-C1' 96.783 -4.226 . . . . 134.95 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.724 2 O4'-C1'-N19 113.704 7.38 . . . . 166.51 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.924 1 O5'-C5'-C4' 115.971 4.122 . . . . 147.04 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 66' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo . . . . . 0 CA--C 1.535 0.572 0 CA-C-O 118.243 -0.816 . . . . 158.46 111.521 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 67' ' ' HIS . . . . . . . . . . . . . 71.5 m-70 -140.32 103.47 4.58 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 113.698 0.999 . . . . 153.17 113.698 -179.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 68' ' ' VAL . . . . . . . . . . . . . 12.2 m -65.14 -176.38 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.782 0 CA-C-O 122.148 0.975 . . . . 112.79 113.114 -173.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 69' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -144.55 165.28 28.45 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 113.609 -1.632 . . . . 99.28 109.486 -169.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 70' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -82.08 146.17 54.57 Favored Pre-proline 0 N--CA 1.453 -0.28 0 N-CA-C 112.621 0.6 . . . . 84.97 112.621 -164.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 71' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -68.63 147.63 70.41 Favored 'Trans proline' 0 C--N 1.348 0.502 0 N-CA-C 108.81 -1.265 . . . . 75.96 108.81 175.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 72' ' ' MET . . . . . . . . . . . . . 73.6 mtm -73.72 139.38 45.26 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 123.632 0.582 . . . . 92.08 111.273 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -87.4 -176.79 5.75 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.561 -0.29 . . . . 74.56 110.88 177.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.03 -47.98 74.03 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 118.972 -1.091 . . . . 74.3 110.749 -175.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 75' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -60.94 -47.24 87.32 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.142 -0.481 . . . . 78.04 111.229 -175.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 76' ' ' MET . . . . . . . . . . . . . 26.3 mmt -63.85 -37.39 87.23 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.328 -0.949 . . . . 106.13 111.876 -179.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 77' ' ' VAL . . . . . . . . . . . . . 95.7 t -62.95 -44.22 99.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.616 0 CA-C-O 121.592 0.711 . . . . 77.49 109.612 -177.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 78' ' ' TRP . . . . . . . . . . . . . 73.2 t90 -69.7 -32.02 70.38 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.687 -1.142 . . . . 76.42 113.144 -179.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.38 -16.1 59.8 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 114.065 1.135 . . . . 68.06 114.065 -176.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 80' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -55.48 -63.99 0.99 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 107.583 -1.265 . . . . 86.87 107.583 177.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.77 -21.89 59.08 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 114.865 1.432 . . . . 77.59 114.865 -176.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.98 -44.66 26.05 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 119.728 -0.789 . . . . 69.39 111.523 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 83' ' ' ARG . . . . . . . . . . . . . 44.0 ttm-85 -53.84 -49.03 69.33 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 108.242 -1.022 . . . . 67.64 108.242 177.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 2.8 mtp180 -50.21 -58.24 6.03 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 114.793 -1.094 . . . . 98.27 111.878 177.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 85' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -59.74 -39.21 84.0 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.907 0.384 . . . . 106.78 110.744 -179.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 86' ' ' LEU . . . . . . . . . . . . . 11.5 tp -65.19 -42.15 93.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.878 -0.601 . . . . 69.04 111.508 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.4 -30.48 71.6 Favored 'General case' 0 CA--C 1.514 -0.435 0 C-N-CA 119.822 -0.751 . . . . 67.63 110.255 -177.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 88' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -64.56 -59.12 4.67 Favored 'General case' 0 CA--C 1.498 -1.053 0 N-CA-C 108.749 -0.834 . . . . 88.01 108.749 177.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 89' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -54.0 -40.92 67.4 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.587 -1.188 . . . . 76.0 110.929 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 90' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -123.27 64.02 25.72 Favored Pre-proline 0 C--O 1.237 0.405 0 N-CA-C 116.202 1.927 . . . . 77.44 116.202 -174.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 91' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -52.46 -27.89 33.64 Favored 'Trans proline' 0 C--N 1.331 -0.365 0 C-N-CA 122.311 2.007 . . . . 73.6 113.722 -174.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 92' ' ' HIS . . . . . . . . . . . . . 29.7 p-80 -80.0 -5.88 56.54 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.746 -0.781 . . . . 79.53 110.584 -171.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 93' ' ' LEU . . . . . . . . . . . . . 20.3 mt -95.37 148.35 22.54 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 112.708 0.633 . . . . 79.88 112.708 -175.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 94' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -103.72 166.13 10.61 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 116.165 -0.471 . . . . 95.85 110.041 179.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 95' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -61.07 -32.48 72.12 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 119.997 -0.681 . . . . 77.65 112.451 -168.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 96' ' ' ALA . . . . . . . . . . . . . . . -50.76 -62.39 1.63 Allowed 'General case' 0 C--O 1.239 0.511 0 O-C-N 123.626 0.579 . . . . 90.23 110.441 172.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 97' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -60.61 -46.44 90.25 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 120.253 -0.579 . . . . 109.55 111.298 -179.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 98' ' ' LEU . . . . . . . . . . . . . 16.2 mt -46.29 -50.51 16.05 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 115.931 -0.577 . . . . 74.99 109.666 176.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 99' ' ' SER . . . . . . . . . . . . . 67.2 m -58.31 -40.97 83.43 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 116.084 -0.507 . . . . 72.22 111.482 -173.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 100' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -59.89 -43.33 94.83 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.104 -0.638 . . . . 80.85 110.809 176.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' THR . . . . . . . . . . . . . 60.0 m -68.76 -35.64 77.34 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 118.882 -1.127 . . . . 71.46 110.691 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' LEU . . . . . . . . . . . . . 42.1 mt -62.15 -41.15 98.01 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.148 -0.933 . . . . 72.02 111.396 177.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 103' ' ' GLY . . . . . . . . . . . . . . . -52.65 -56.26 18.92 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.385 -1.086 . . . . 91.4 110.385 176.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 104' ' ' LYS . . . . . . . . . . . . . 26.2 mttp -61.46 -43.16 99.35 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.795 0.807 . . . . 84.17 109.906 -174.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.74 -40.97 94.4 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.913 -1.04 . . . . 84.52 110.682 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 106' ' ' TRP . . . . . . . . . . . . . 64.0 t-105 -58.75 -62.23 2.03 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.386 0.513 . . . . 68.5 112.386 175.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 107' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -64.09 -4.4 3.49 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.17 1.174 . . . . 100.62 114.17 -177.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 108' ' ' LEU . . . . . . . . . . . . . 15.8 tp -79.09 -20.07 49.67 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 120.431 -0.508 . . . . 80.84 111.131 174.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 109' ' ' LEU . . . . . . . . . . . . . 20.4 mt -73.3 157.13 37.62 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 114.495 1.294 . . . . 75.97 114.495 176.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 110' ' ' ASN . . . . . . . . . . . . . 52.4 p-10 -107.98 -174.06 2.43 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 120.436 -0.506 . . . . 79.06 110.228 176.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 111' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.41 -56.47 18.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.006 0.432 . . . . 128.42 112.021 -177.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 112' ' ' SER . . . . . . . . . . . . . 4.4 m -58.83 -41.19 86.32 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.073 -0.512 . . . . 97.89 111.426 -175.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 113' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -69.68 -26.16 64.24 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.359 0.503 . . . . 74.83 112.359 179.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 114' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -86.37 -27.29 24.33 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 113.812 1.041 . . . . 82.68 113.812 178.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 115' ' ' ARG . . . . . . . . . . . . . 25.9 ttm-85 -44.68 -44.98 23.04 Favored Pre-proline 0 C--N 1.329 -0.285 0 N-CA-C 116.326 1.973 . . . . 96.2 116.326 -174.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 116' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -64.6 -26.35 61.65 Favored 'Trans proline' 0 C--N 1.35 0.608 1 C-N-CA 112.998 -4.201 . . . . 70.62 112.638 -174.208 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 117' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -87.33 -33.98 19.0 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 108.485 -0.931 . . . . 79.71 108.485 -174.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 118' ' ' VAL . . . . . . . . . . . . . 41.1 t -60.68 -48.8 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 115.11 -0.95 . . . . 85.18 109.304 172.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 119' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -59.81 -40.02 87.0 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.134 0.492 . . . . 120.82 110.35 173.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 120' ' ' GLU . . . . . . . . . . . . . 46.7 tp10 -68.57 -36.07 78.25 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 118.592 -1.243 . . . . 80.64 111.999 -178.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.6 -28.57 67.04 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 119.656 -0.818 . . . . 76.83 112.48 176.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 122' ' ' GLU . . . . . . . . . . . . . 78.2 tt0 -78.76 -35.51 44.46 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.628 0.603 . . . . 106.59 112.628 -178.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 123' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -73.6 -34.49 65.1 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 118.518 -1.273 . . . . 89.92 109.276 175.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 124' ' ' LEU . . . . . . . . . . . . . 5.4 tp -63.4 -40.0 96.03 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 106.542 -1.651 . . . . 75.39 106.542 176.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 125' ' ' ARG . . . . . . . . . . . . . 12.8 ttp-105 -64.97 -48.92 72.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.255 -0.43 . . . . 128.36 110.254 -177.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 126' ' ' VAL . . . . . . . . . . . . . 17.1 t -58.79 -42.97 87.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.371 0 C-N-CA 120.457 -0.497 . . . . 87.46 110.299 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 127' ' ' GLN . . . . . . . . . . . . . 71.8 tp60 -61.9 -42.95 99.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.097 0.475 . . . . 97.33 110.697 -177.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 128' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -54.52 -42.61 71.03 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.751 -0.659 . . . . 101.17 111.276 176.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 129' ' ' LYS . . . . . . . . . . . . . 22.4 ttpp -65.89 -37.04 85.06 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 120.543 -0.463 . . . . 117.29 111.796 177.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 130' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -69.57 -39.76 77.16 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 110.001 -0.37 . . . . 99.23 110.001 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 131' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -72.81 -34.68 67.02 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.021 -0.536 . . . . 106.92 112.324 179.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 132' ' ' HIS . . . . . . . . . . . . . 40.9 m80 -132.07 82.8 58.05 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.08 0.467 . . . . 101.26 112.001 -179.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 133' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -65.45 -41.26 15.96 Favored 'Trans proline' 0 CA--C 1.513 -0.566 0 C-N-CA 122.934 2.423 . . . . 95.95 111.077 -172.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 134' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -92.56 14.58 16.44 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 115.183 -0.917 . . . . 118.7 111.128 -175.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 135' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -67.31 145.44 55.13 Favored 'General case' 0 CA--C 1.497 -1.06 0 C-N-CA 120.08 -0.648 . . . . 98.63 110.777 -179.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.27 131.19 17.14 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 114.86 -1.064 . . . . 108.39 108.9 166.826 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 137' ' ' TYR . . . . . 0.458 ' OH ' ' N3 ' ' B' ' 6' ' ' ' DA' . 9.0 t80 -70.8 115.9 10.48 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 114.863 -1.062 . . . . 103.87 108.921 -177.252 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 138' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -127.83 85.86 59.67 Favored Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 107.892 -1.151 . . . . 142.69 107.892 -179.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 139' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -64.81 158.6 50.0 Favored 'Trans proline' 0 C--O 1.239 0.562 0 C-N-CA 122.736 2.291 . . . . 87.19 110.301 178.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 140' ' ' ARG . . . . . . . . . . . . . 28.5 mtp-105 -91.75 168.03 11.75 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.776 0.672 . . . . 140.57 110.69 -177.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 141' ' ' ARG . . . . . . . . . . . . . 2.0 tpt180 . . . . . 0 CA--C 1.533 0.299 0 CA-C-O 121.424 0.631 . . . . 150.16 112.574 -179.343 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 O3'--C3' 1.368 -4.838 1 C3'-C2'-C1' 95.485 -5.153 . . . . 235.53999999999999 . . . . . . . . . . 2 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ' DG' . . . . . 0.501 " H1'" ' C8 ' ' A' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.407 -2.04 2 O4'-C4'-C3' 100.939 -4.661 . . . . 116.61 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ' DG' . . . . . 0.501 ' C8 ' " H1'" ' A' ' 4' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.41 -1.642 0 C4'-C3'-O3' 106.1 -1.909 . . . . 113.68000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.4 -2.522 1 P-O5'-C5' 114.167 -4.208 . . . . 126.70999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.392 -2.978 1 O4'-C1'-N19 111.141 4.176 . . . . 98.359999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ' DT' . . . . . 0.428 ' C6 ' ' H72' ' A' ' 9' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.406 -1.907 0 P-O5'-C5' 117.079 -2.388 . . . . 91.810000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ' DT' . . . . . 0.428 ' H72' ' C6 ' ' A' ' 8' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.394 -2.855 0 P-O5'-C5' 115.19 -3.569 . . . . 83.599999999999994 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ' DG' . . . . . 0.405 ' C8 ' H2'' ' A' ' 9' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.413 -1.688 0 P-O5'-C5' 116.38 -2.825 . . . . 81.420000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.411 -1.803 1 P-O5'-C5' 114.307 -4.12 . . . . 96.129999999999995 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.405 -2.191 1 C1'-O4'-C4' 103.962 -4.098 . . . . 90.950000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ' DC' . . . . . 0.529 H2'' " H5'" ' A' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.415 -1.57 0 C3'-C2'-C1' 105.433 1.952 . . . . 102.64 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ' DT' . . . . . 0.529 " H5'" H2'' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.409 -1.655 0 C3'-C2'-C1' 97.927 -3.41 . . . . 106.28 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ' DC' . . . . . 0.579 ' N4 ' ' O6 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.392 -3.031 0 O4'-C1'-C2' 109.831 3.392 . . . . 137.05000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ' DC' . . . . . 0.673 ' N4 ' ' O6 ' ' B' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.404 -2.247 0 C4'-C3'-C2' 106.972 3.772 . . . . 141.65000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.42 -1.238 2 O4'-C1'-N19 111.873 5.091 . . . . 181.69999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.384 0 P-O5'-C5' 124.695 2.372 . . . . 166.08000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 0' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.608 1.48 0 C3'-C2'-C1' 99.055 -2.603 . . . . 225.68000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ' DG' . . . . . 0.673 ' O6 ' ' N4 ' ' A' ' 16' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.397 -2.648 0 C3'-C2'-C1' 97.787 -3.51 . . . . 173.47999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' ' DG' . . . . . 0.579 ' O6 ' ' N4 ' ' A' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.409 -1.909 1 O4'-C1'-N19 111.545 4.681 . . . . 128.62 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ' DA' . . . . . 0.431 ' C8 ' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.417 -1.087 1 O4'-C1'-N19 112.193 5.492 . . . . 135.99000000000001 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.414 -1.614 0 C4'-C3'-C2' 105.08 1.88 . . . . 121.64 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.203 0 O4'-C1'-N19 110.661 3.576 . . . . 122.86 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ' DA' . . . . . 0.423 ' N3 ' ' OH ' ' D' ' 137' ' ' TYR . . . . . . . . 0 O3'--C3' 1.408 -1.743 0 C4'-C3'-C2' 105.771 2.571 . . . . 110.76000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.402 -2.233 0 O4'-C1'-C2' 102.658 -3.129 . . . . 94.989999999999995 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.394 -2.832 0 O4'-C1'-N19 110.745 3.681 . . . . 77.650000000000006 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 9' ' ' ' DA' . . . . . 0.401 H2'' " H5'" ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.396 -2.674 0 O4'-C1'-C2' 110.112 3.647 . . . . 80.980000000000004 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ' DA' . . . . . 0.615 " H2'" ' C8 ' ' B' ' 11' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.398 -2.572 1 O4'-C1'-N19 104.531 -4.086 . . . . 93.719999999999999 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ' DG' . . . . . 0.615 ' C8 ' " H2'" ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.536 1.834 0 C4'-C3'-O3' 105.591 -2.141 . . . . 87.799999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.41 -1.618 1 P-O5'-C5' 112.697 -5.127 . . . . 113.5 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.414 -1.275 1 C3'-C2'-C1' 96.783 -4.226 . . . . 134.94999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.724 2 O4'-C1'-N19 113.704 7.38 . . . . 166.50999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.924 1 O5'-C5'-C4' 115.971 4.122 . . . . 147.03999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 66' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo . . . . . 0 CA--C 1.535 0.572 0 CA-C-O 118.243 -0.816 . . . . 158.46000000000001 111.521 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 67' ' ' HIS . . . . . . . . . . . . . 71.5 m-70 -140.32 103.47 4.58 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 113.698 0.999 . . . . 153.16999999999999 113.698 -179.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 68' ' ' VAL . . . . . . . . . . . . . 12.2 m -65.14 -176.38 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.782 0 CA-C-O 122.148 0.975 . . . . 112.79000000000001 113.114 -173.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 69' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -144.55 165.28 28.45 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 113.609 -1.632 . . . . 99.280000000000001 109.486 -169.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 70' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -82.08 146.17 54.57 Favored Pre-proline 0 N--CA 1.453 -0.28 0 N-CA-C 112.621 0.6 . . . . 84.969999999999999 112.621 -164.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 71' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -68.63 147.63 70.41 Favored 'Trans proline' 0 C--N 1.348 0.502 0 N-CA-C 108.81 -1.265 . . . . 75.959999999999994 108.81 175.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 72' ' ' MET . . . . . . . . . . . . . 73.6 mtm -73.72 139.38 45.26 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 123.632 0.582 . . . . 92.079999999999998 111.273 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 73' ' ' ASN . . . . . 0.418 ' O ' HG23 ' D' ' 77' ' ' VAL . 31.0 p30 -87.4 -176.79 5.75 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.561 -0.29 . . . . 74.560000000000002 110.88 177.196 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.03 -47.98 74.03 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 118.972 -1.091 . . . . 74.299999999999997 110.749 -175.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 75' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -60.94 -47.24 87.32 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.142 -0.481 . . . . 78.040000000000006 111.229 -175.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 76' ' ' MET . . . . . . . . . . . . . 26.3 mmt -63.85 -37.39 87.23 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.328 -0.949 . . . . 106.13 111.876 -179.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 77' ' ' VAL . . . . . 0.418 HG23 ' O ' ' D' ' 73' ' ' ASN . 95.7 t -62.95 -44.22 99.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.616 0 CA-C-O 121.592 0.711 . . . . 77.489999999999995 109.612 -177.972 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 78' ' ' TRP . . . . . . . . . . . . . 73.2 t90 -69.7 -32.02 70.38 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.687 -1.142 . . . . 76.420000000000002 113.144 -179.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.38 -16.1 59.8 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 114.065 1.135 . . . . 68.060000000000002 114.065 -176.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 80' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -55.48 -63.99 0.99 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 107.583 -1.265 . . . . 86.870000000000005 107.583 177.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.77 -21.89 59.08 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 114.865 1.432 . . . . 77.590000000000003 114.865 -176.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.98 -44.66 26.05 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 119.728 -0.789 . . . . 69.390000000000001 111.523 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 83' ' ' ARG . . . . . . . . . . . . . 44.0 ttm-85 -53.84 -49.03 69.33 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 108.242 -1.022 . . . . 67.640000000000001 108.242 177.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 2.8 mtp180 -50.21 -58.24 6.03 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 114.793 -1.094 . . . . 98.269999999999996 111.878 177.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 85' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -59.74 -39.21 84.0 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.907 0.384 . . . . 106.78 110.744 -179.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 86' ' ' LEU . . . . . . . . . . . . . 11.5 tp -65.19 -42.15 93.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.878 -0.601 . . . . 69.040000000000006 111.508 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.4 -30.48 71.6 Favored 'General case' 0 CA--C 1.514 -0.435 0 C-N-CA 119.822 -0.751 . . . . 67.629999999999995 110.255 -177.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 88' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -64.56 -59.12 4.67 Favored 'General case' 0 CA--C 1.498 -1.053 0 N-CA-C 108.749 -0.834 . . . . 88.010000000000005 108.749 177.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 89' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -54.0 -40.92 67.4 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.587 -1.188 . . . . 76.0 110.929 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 90' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -123.27 64.02 25.72 Favored Pre-proline 0 C--O 1.237 0.405 0 N-CA-C 116.202 1.927 . . . . 77.439999999999998 116.202 -174.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 91' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -52.46 -27.89 33.64 Favored 'Trans proline' 0 C--N 1.331 -0.365 0 C-N-CA 122.311 2.007 . . . . 73.599999999999994 113.722 -174.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 92' ' ' HIS . . . . . . . . . . . . . 29.7 p-80 -80.0 -5.88 56.54 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.746 -0.781 . . . . 79.530000000000001 110.584 -171.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 93' ' ' LEU . . . . . . . . . . . . . 20.3 mt -95.37 148.35 22.54 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 112.708 0.633 . . . . 79.879999999999995 112.708 -175.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 94' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -103.72 166.13 10.61 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 116.165 -0.471 . . . . 95.849999999999994 110.041 179.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 95' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -61.07 -32.48 72.12 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 119.997 -0.681 . . . . 77.650000000000006 112.451 -168.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 96' ' ' ALA . . . . . . . . . . . . . . . -50.76 -62.39 1.63 Allowed 'General case' 0 C--O 1.239 0.511 0 O-C-N 123.626 0.579 . . . . 90.230000000000004 110.441 172.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 97' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -60.61 -46.44 90.25 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 120.253 -0.579 . . . . 109.55 111.298 -179.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 98' ' ' LEU . . . . . . . . . . . . . 16.2 mt -46.29 -50.51 16.05 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 115.931 -0.577 . . . . 74.989999999999995 109.666 176.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 99' ' ' SER . . . . . . . . . . . . . 67.2 m -58.31 -40.97 83.43 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 116.084 -0.507 . . . . 72.219999999999999 111.482 -173.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 100' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -59.89 -43.33 94.83 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.104 -0.638 . . . . 80.849999999999994 110.809 176.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 101' ' ' THR . . . . . . . . . . . . . 60.0 m -68.76 -35.64 77.34 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 118.882 -1.127 . . . . 71.459999999999994 110.691 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 102' ' ' LEU . . . . . . . . . . . . . 42.1 mt -62.15 -41.15 98.01 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.148 -0.933 . . . . 72.019999999999996 111.396 177.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 103' ' ' GLY . . . . . . . . . . . . . . . -52.65 -56.26 18.92 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.385 -1.086 . . . . 91.400000000000006 110.385 176.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 104' ' ' LYS . . . . . . . . . . . . . 26.2 mttp -61.46 -43.16 99.35 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.795 0.807 . . . . 84.170000000000002 109.906 -174.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.74 -40.97 94.4 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.913 -1.04 . . . . 84.519999999999996 110.682 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 106' ' ' TRP . . . . . . . . . . . . . 64.0 t-105 -58.75 -62.23 2.03 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.386 0.513 . . . . 68.5 112.386 175.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 107' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -64.09 -4.4 3.49 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.17 1.174 . . . . 100.62 114.17 -177.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 108' ' ' LEU . . . . . . . . . . . . . 15.8 tp -79.09 -20.07 49.67 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 120.431 -0.508 . . . . 80.840000000000003 111.131 174.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 109' ' ' LEU . . . . . 0.52 HD22 ' HB3' ' D' ' 113' ' ' GLU . 20.4 mt -73.3 157.13 37.62 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 114.495 1.294 . . . . 75.969999999999999 114.495 176.417 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 110' ' ' ASN . . . . . . . . . . . . . 52.4 p-10 -107.98 -174.06 2.43 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 120.436 -0.506 . . . . 79.060000000000002 110.228 176.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 111' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.41 -56.47 18.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.006 0.432 . . . . 128.41999999999999 112.021 -177.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 112' ' ' SER . . . . . . . . . . . . . 4.4 m -58.83 -41.19 86.32 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.073 -0.512 . . . . 97.890000000000001 111.426 -175.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 113' ' ' GLU . . . . . 0.52 ' HB3' HD22 ' D' ' 109' ' ' LEU . 40.7 mt-10 -69.68 -26.16 64.24 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.359 0.503 . . . . 74.829999999999998 112.359 179.67 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 114' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -86.37 -27.29 24.33 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 113.812 1.041 . . . . 82.680000000000007 113.812 178.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 115' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' D' ' 119' ' ' GLU . 25.9 ttm-85 -44.68 -44.98 23.04 Favored Pre-proline 0 C--N 1.329 -0.285 0 N-CA-C 116.326 1.973 . . . . 96.200000000000003 116.326 -174.4 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 116' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -64.6 -26.35 61.65 Favored 'Trans proline' 0 C--N 1.35 0.608 1 C-N-CA 112.998 -4.201 . . . . 70.620000000000005 112.638 -174.208 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 117' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -87.33 -33.98 19.0 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 108.485 -0.931 . . . . 79.709999999999994 108.485 -174.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 118' ' ' VAL . . . . . . . . . . . . . 41.1 t -60.68 -48.8 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 115.11 -0.95 . . . . 85.180000000000007 109.304 172.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 119' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' D' ' 115' ' ' ARG . 19.8 mt-10 -59.81 -40.02 87.0 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.134 0.492 . . . . 120.81999999999999 110.35 173.762 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 120' ' ' GLU . . . . . . . . . . . . . 46.7 tp10 -68.57 -36.07 78.25 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 118.592 -1.243 . . . . 80.640000000000001 111.999 -178.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.6 -28.57 67.04 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 119.656 -0.818 . . . . 76.829999999999998 112.48 176.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 122' ' ' GLU . . . . . 0.714 ' HG3' HH12 ' D' ' 125' ' ' ARG . 78.2 tt0 -78.76 -35.51 44.46 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.628 0.603 . . . . 106.59 112.628 -178.843 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 123' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -73.6 -34.49 65.1 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 118.518 -1.273 . . . . 89.920000000000002 109.276 175.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 124' ' ' LEU . . . . . . . . . . . . . 5.4 tp -63.4 -40.0 96.03 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 106.542 -1.651 . . . . 75.390000000000001 106.542 176.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 125' ' ' ARG . . . . . 0.714 HH12 ' HG3' ' D' ' 122' ' ' GLU . 12.8 ttp-105 -64.97 -48.92 72.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.255 -0.43 . . . . 128.36000000000001 110.254 -177.677 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 126' ' ' VAL . . . . . . . . . . . . . 17.1 t -58.79 -42.97 87.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.371 0 C-N-CA 120.457 -0.497 . . . . 87.459999999999994 110.299 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 127' ' ' GLN . . . . . . . . . . . . . 71.8 tp60 -61.9 -42.95 99.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.097 0.475 . . . . 97.329999999999998 110.697 -177.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 128' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -54.52 -42.61 71.03 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.751 -0.659 . . . . 101.17 111.276 176.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 129' ' ' LYS . . . . . . . . . . . . . 22.4 ttpp -65.89 -37.04 85.06 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 120.543 -0.463 . . . . 117.29000000000001 111.796 177.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 130' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -69.57 -39.76 77.16 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 110.001 -0.37 . . . . 99.230000000000004 110.001 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 131' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -72.81 -34.68 67.02 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.021 -0.536 . . . . 106.92 112.324 179.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 132' ' ' HIS . . . . . . . . . . . . . 40.9 m80 -132.07 82.8 58.05 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.08 0.467 . . . . 101.26000000000001 112.001 -179.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 133' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -65.45 -41.26 15.96 Favored 'Trans proline' 0 CA--C 1.513 -0.566 0 C-N-CA 122.934 2.423 . . . . 95.950000000000003 111.077 -172.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 134' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -92.56 14.58 16.44 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 115.183 -0.917 . . . . 118.7 111.128 -175.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 135' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -67.31 145.44 55.13 Favored 'General case' 0 CA--C 1.497 -1.06 0 C-N-CA 120.08 -0.648 . . . . 98.629999999999995 110.777 -179.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 136' ' ' LYS . . . . . 0.425 ' HB3' ' HE2' ' D' ' 136' ' ' LYS . 0.0 OUTLIER -147.27 131.19 17.14 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 114.86 -1.064 . . . . 108.39 108.9 166.826 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 137' ' ' TYR . . . . . 0.423 ' OH ' ' N3 ' ' B' ' 6' ' ' ' DA' . 9.0 t80 -70.8 115.9 10.48 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 114.863 -1.062 . . . . 103.87 108.921 -177.252 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 138' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -127.83 85.86 59.67 Favored Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 107.892 -1.151 . . . . 142.69 107.892 -179.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 139' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -64.81 158.6 50.0 Favored 'Trans proline' 0 C--O 1.239 0.562 0 C-N-CA 122.736 2.291 . . . . 87.189999999999998 110.301 178.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 140' ' ' ARG . . . . . . . . . . . . . 28.5 mtp-105 -91.75 168.03 11.75 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.776 0.672 . . . . 140.56999999999999 110.69 -177.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 141' ' ' ARG . . . . . . . . . . . . . 2.0 tpt180 . . . . . 0 CA--C 1.533 0.299 0 CA-C-O 121.424 0.631 . . . . 150.16 112.574 -179.343 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 O3'--C3' 1.368 -4.838 1 C3'-C2'-C1' 95.485 -5.153 . . . . 235.53999999999999 . . . . . . . . . . 2 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.501 " H1'" ' C8 ' ' A' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.407 -2.04 2 O4'-C4'-C3' 100.939 -4.661 . . . . 116.61 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ' DG' . . . . . 0.501 ' C8 ' " H1'" ' A' ' 4' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.41 -1.642 0 C4'-C3'-O3' 106.1 -1.909 . . . . 113.68000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.4 -2.522 1 P-O5'-C5' 114.167 -4.208 . . . . 126.70999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.392 -2.978 1 O4'-C1'-N19 111.141 4.176 . . . . 98.359999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ' DT' . . . . . 0.428 ' C6 ' ' H72' ' A' ' 9' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.406 -1.907 0 P-O5'-C5' 117.079 -2.388 . . . . 91.810000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ' DT' . . . . . 0.428 ' H72' ' C6 ' ' A' ' 8' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.394 -2.855 0 P-O5'-C5' 115.19 -3.569 . . . . 83.599999999999994 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ' DG' . . . . . 0.405 ' C8 ' H2'' ' A' ' 9' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.413 -1.688 0 P-O5'-C5' 116.38 -2.825 . . . . 81.420000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.411 -1.803 1 P-O5'-C5' 114.307 -4.12 . . . . 96.129999999999995 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.405 -2.191 1 C1'-O4'-C4' 103.962 -4.098 . . . . 90.950000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.529 H2'' " H5'" ' A' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.415 -1.57 0 C3'-C2'-C1' 105.433 1.952 . . . . 102.64 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ' DT' . . . . . 0.529 " H5'" H2'' ' A' ' 13' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.409 -1.655 0 C3'-C2'-C1' 97.927 -3.41 . . . . 106.28 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ' DC' . . . . . 0.579 ' N4 ' ' O6 ' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.392 -3.031 0 O4'-C1'-C2' 109.831 3.392 . . . . 137.05000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ' DC' . . . . . 0.673 ' N4 ' ' O6 ' ' B' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.404 -2.247 0 C4'-C3'-C2' 106.972 3.772 . . . . 141.65000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.42 -1.238 2 O4'-C1'-N19 111.873 5.091 . . . . 181.69999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.384 0 P-O5'-C5' 124.695 2.372 . . . . 166.08000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 0' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.608 1.48 0 C3'-C2'-C1' 99.055 -2.603 . . . . 225.68000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ' DG' . . . . . 0.673 ' O6 ' ' N4 ' ' A' ' 16' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.397 -2.648 0 C3'-C2'-C1' 97.787 -3.51 . . . . 173.47999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.579 ' O6 ' ' N4 ' ' A' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.409 -1.909 1 O4'-C1'-N19 111.545 4.681 . . . . 128.62 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.431 ' C8 ' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.417 -1.087 1 O4'-C1'-N19 112.193 5.492 . . . . 135.99000000000001 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.414 -1.614 0 C4'-C3'-C2' 105.08 1.88 . . . . 121.64 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.203 0 O4'-C1'-N19 110.661 3.576 . . . . 122.86 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ' DA' . . . . . 0.423 ' N3 ' ' OH ' ' D' ' 137' ' ' TYR . . . . . . . . 0 O3'--C3' 1.408 -1.743 0 C4'-C3'-C2' 105.771 2.571 . . . . 110.76000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.402 -2.233 0 O4'-C1'-C2' 102.658 -3.129 . . . . 94.989999999999995 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.394 -2.832 0 O4'-C1'-N19 110.745 3.681 . . . . 77.650000000000006 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' ' DA' . . . . . 0.401 H2'' " H5'" ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.396 -2.674 0 O4'-C1'-C2' 110.112 3.647 . . . . 80.980000000000004 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.615 " H2'" ' C8 ' ' B' ' 11' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.398 -2.572 1 O4'-C1'-N19 104.531 -4.086 . . . . 93.719999999999999 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ' DG' . . . . . 0.615 ' C8 ' " H2'" ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.536 1.834 0 C4'-C3'-O3' 105.591 -2.141 . . . . 87.799999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.41 -1.618 1 P-O5'-C5' 112.697 -5.127 . . . . 113.5 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.414 -1.275 1 C3'-C2'-C1' 96.783 -4.226 . . . . 134.94999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.724 2 O4'-C1'-N19 113.704 7.38 . . . . 166.50999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.924 1 O5'-C5'-C4' 115.971 4.122 . . . . 147.03999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 66' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo . . . . . 0 CA--C 1.535 0.572 0 CA-C-O 118.243 -0.816 . . . . 158.46000000000001 111.521 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 67' ' ' HIS . . . . . . . . . . . . . 71.5 m-70 -140.32 103.47 4.58 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 113.698 0.999 . . . . 153.16999999999999 113.698 -179.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 68' ' ' VAL . . . . . . . . . . . . . 12.2 m -65.14 -176.38 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.782 0 CA-C-O 122.148 0.975 . . . . 112.79000000000001 113.114 -173.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 69' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -144.55 165.28 28.45 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 113.609 -1.632 . . . . 99.280000000000001 109.486 -169.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 70' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -82.08 146.17 54.57 Favored Pre-proline 0 N--CA 1.453 -0.28 0 N-CA-C 112.621 0.6 . . . . 84.969999999999999 112.621 -164.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 71' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -68.63 147.63 70.41 Favored 'Trans proline' 0 C--N 1.348 0.502 0 N-CA-C 108.81 -1.265 . . . . 75.959999999999994 108.81 175.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 72' ' ' MET . . . . . . . . . . . . . 73.6 mtm -73.72 139.38 45.26 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 123.632 0.582 . . . . 92.079999999999998 111.273 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 73' ' ' ASN . . . . . 0.418 ' O ' HG23 ' D' ' 77' ' ' VAL . 31.0 p30 -87.4 -176.79 5.75 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.561 -0.29 . . . . 74.560000000000002 110.88 177.196 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.03 -47.98 74.03 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 118.972 -1.091 . . . . 74.299999999999997 110.749 -175.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 75' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -60.94 -47.24 87.32 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.142 -0.481 . . . . 78.040000000000006 111.229 -175.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 76' ' ' MET . . . . . . . . . . . . . 26.3 mmt -63.85 -37.39 87.23 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.328 -0.949 . . . . 106.13 111.876 -179.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 77' ' ' VAL . . . . . 0.418 HG23 ' O ' ' D' ' 73' ' ' ASN . 95.7 t -62.95 -44.22 99.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.616 0 CA-C-O 121.592 0.711 . . . . 77.489999999999995 109.612 -177.972 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 78' ' ' TRP . . . . . . . . . . . . . 73.2 t90 -69.7 -32.02 70.38 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.687 -1.142 . . . . 76.420000000000002 113.144 -179.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.38 -16.1 59.8 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 114.065 1.135 . . . . 68.060000000000002 114.065 -176.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 80' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -55.48 -63.99 0.99 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 107.583 -1.265 . . . . 86.870000000000005 107.583 177.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.77 -21.89 59.08 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 114.865 1.432 . . . . 77.590000000000003 114.865 -176.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.98 -44.66 26.05 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 119.728 -0.789 . . . . 69.390000000000001 111.523 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 83' ' ' ARG . . . . . . . . . . . . . 44.0 ttm-85 -53.84 -49.03 69.33 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 108.242 -1.022 . . . . 67.640000000000001 108.242 177.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 2.8 mtp180 -50.21 -58.24 6.03 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 114.793 -1.094 . . . . 98.269999999999996 111.878 177.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 85' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -59.74 -39.21 84.0 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.907 0.384 . . . . 106.78 110.744 -179.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 86' ' ' LEU . . . . . . . . . . . . . 11.5 tp -65.19 -42.15 93.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.878 -0.601 . . . . 69.040000000000006 111.508 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.4 -30.48 71.6 Favored 'General case' 0 CA--C 1.514 -0.435 0 C-N-CA 119.822 -0.751 . . . . 67.629999999999995 110.255 -177.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 88' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -64.56 -59.12 4.67 Favored 'General case' 0 CA--C 1.498 -1.053 0 N-CA-C 108.749 -0.834 . . . . 88.010000000000005 108.749 177.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 89' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -54.0 -40.92 67.4 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.587 -1.188 . . . . 76.0 110.929 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 90' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -123.27 64.02 25.72 Favored Pre-proline 0 C--O 1.237 0.405 0 N-CA-C 116.202 1.927 . . . . 77.439999999999998 116.202 -174.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 91' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -52.46 -27.89 33.64 Favored 'Trans proline' 0 C--N 1.331 -0.365 0 C-N-CA 122.311 2.007 . . . . 73.599999999999994 113.722 -174.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 92' ' ' HIS . . . . . . . . . . . . . 29.7 p-80 -80.0 -5.88 56.54 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.746 -0.781 . . . . 79.530000000000001 110.584 -171.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 93' ' ' LEU . . . . . . . . . . . . . 20.3 mt -95.37 148.35 22.54 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 112.708 0.633 . . . . 79.879999999999995 112.708 -175.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 94' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -103.72 166.13 10.61 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 116.165 -0.471 . . . . 95.849999999999994 110.041 179.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 95' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -61.07 -32.48 72.12 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 119.997 -0.681 . . . . 77.650000000000006 112.451 -168.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 96' ' ' ALA . . . . . . . . . . . . . . . -50.76 -62.39 1.63 Allowed 'General case' 0 C--O 1.239 0.511 0 O-C-N 123.626 0.579 . . . . 90.230000000000004 110.441 172.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 97' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -60.61 -46.44 90.25 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 120.253 -0.579 . . . . 109.55 111.298 -179.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 98' ' ' LEU . . . . . . . . . . . . . 16.2 mt -46.29 -50.51 16.05 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 115.931 -0.577 . . . . 74.989999999999995 109.666 176.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 99' ' ' SER . . . . . . . . . . . . . 67.2 m -58.31 -40.97 83.43 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 116.084 -0.507 . . . . 72.219999999999999 111.482 -173.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 100' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -59.89 -43.33 94.83 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.104 -0.638 . . . . 80.849999999999994 110.809 176.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' THR . . . . . . . . . . . . . 60.0 m -68.76 -35.64 77.34 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 118.882 -1.127 . . . . 71.459999999999994 110.691 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' LEU . . . . . . . . . . . . . 42.1 mt -62.15 -41.15 98.01 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.148 -0.933 . . . . 72.019999999999996 111.396 177.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 103' ' ' GLY . . . . . . . . . . . . . . . -52.65 -56.26 18.92 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.385 -1.086 . . . . 91.400000000000006 110.385 176.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 104' ' ' LYS . . . . . . . . . . . . . 26.2 mttp -61.46 -43.16 99.35 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.795 0.807 . . . . 84.170000000000002 109.906 -174.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.74 -40.97 94.4 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.913 -1.04 . . . . 84.519999999999996 110.682 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 106' ' ' TRP . . . . . . . . . . . . . 64.0 t-105 -58.75 -62.23 2.03 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.386 0.513 . . . . 68.5 112.386 175.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 107' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -64.09 -4.4 3.49 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.17 1.174 . . . . 100.62 114.17 -177.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 108' ' ' LEU . . . . . . . . . . . . . 15.8 tp -79.09 -20.07 49.67 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 120.431 -0.508 . . . . 80.840000000000003 111.131 174.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 109' ' ' LEU . . . . . 0.52 HD22 ' HB3' ' D' ' 113' ' ' GLU . 20.4 mt -73.3 157.13 37.62 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 114.495 1.294 . . . . 75.969999999999999 114.495 176.417 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 110' ' ' ASN . . . . . . . . . . . . . 52.4 p-10 -107.98 -174.06 2.43 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 120.436 -0.506 . . . . 79.060000000000002 110.228 176.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 111' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.41 -56.47 18.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.006 0.432 . . . . 128.41999999999999 112.021 -177.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 112' ' ' SER . . . . . . . . . . . . . 4.4 m -58.83 -41.19 86.32 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.073 -0.512 . . . . 97.890000000000001 111.426 -175.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 113' ' ' GLU . . . . . 0.52 ' HB3' HD22 ' D' ' 109' ' ' LEU . 40.7 mt-10 -69.68 -26.16 64.24 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.359 0.503 . . . . 74.829999999999998 112.359 179.67 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 114' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -86.37 -27.29 24.33 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 113.812 1.041 . . . . 82.680000000000007 113.812 178.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 115' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' D' ' 119' ' ' GLU . 25.9 ttm-85 -44.68 -44.98 23.04 Favored Pre-proline 0 C--N 1.329 -0.285 0 N-CA-C 116.326 1.973 . . . . 96.200000000000003 116.326 -174.4 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 116' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -64.6 -26.35 61.65 Favored 'Trans proline' 0 C--N 1.35 0.608 1 C-N-CA 112.998 -4.201 . . . . 70.620000000000005 112.638 -174.208 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 117' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -87.33 -33.98 19.0 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 108.485 -0.931 . . . . 79.709999999999994 108.485 -174.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 118' ' ' VAL . . . . . . . . . . . . . 41.1 t -60.68 -48.8 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 115.11 -0.95 . . . . 85.180000000000007 109.304 172.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 119' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' D' ' 115' ' ' ARG . 19.8 mt-10 -59.81 -40.02 87.0 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.134 0.492 . . . . 120.81999999999999 110.35 173.762 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 120' ' ' GLU . . . . . . . . . . . . . 46.7 tp10 -68.57 -36.07 78.25 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 118.592 -1.243 . . . . 80.640000000000001 111.999 -178.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.6 -28.57 67.04 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 119.656 -0.818 . . . . 76.829999999999998 112.48 176.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 122' ' ' GLU . . . . . 0.714 ' HG3' HH12 ' D' ' 125' ' ' ARG . 78.2 tt0 -78.76 -35.51 44.46 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.628 0.603 . . . . 106.59 112.628 -178.843 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 123' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -73.6 -34.49 65.1 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 118.518 -1.273 . . . . 89.920000000000002 109.276 175.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 124' ' ' LEU . . . . . . . . . . . . . 5.4 tp -63.4 -40.0 96.03 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 106.542 -1.651 . . . . 75.390000000000001 106.542 176.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 125' ' ' ARG . . . . . 0.714 HH12 ' HG3' ' D' ' 122' ' ' GLU . 12.8 ttp-105 -64.97 -48.92 72.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.255 -0.43 . . . . 128.36000000000001 110.254 -177.677 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 126' ' ' VAL . . . . . . . . . . . . . 17.1 t -58.79 -42.97 87.0 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.371 0 C-N-CA 120.457 -0.497 . . . . 87.459999999999994 110.299 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 127' ' ' GLN . . . . . . . . . . . . . 71.8 tp60 -61.9 -42.95 99.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.097 0.475 . . . . 97.329999999999998 110.697 -177.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 128' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -54.52 -42.61 71.03 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.751 -0.659 . . . . 101.17 111.276 176.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 129' ' ' LYS . . . . . . . . . . . . . 22.4 ttpp -65.89 -37.04 85.06 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 120.543 -0.463 . . . . 117.29000000000001 111.796 177.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 130' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -69.57 -39.76 77.16 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 110.001 -0.37 . . . . 99.230000000000004 110.001 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 131' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -72.81 -34.68 67.02 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.021 -0.536 . . . . 106.92 112.324 179.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 132' ' ' HIS . . . . . . . . . . . . . 40.9 m80 -132.07 82.8 58.05 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.08 0.467 . . . . 101.26000000000001 112.001 -179.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 133' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -65.45 -41.26 15.96 Favored 'Trans proline' 0 CA--C 1.513 -0.566 0 C-N-CA 122.934 2.423 . . . . 95.950000000000003 111.077 -172.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 134' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -92.56 14.58 16.44 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 115.183 -0.917 . . . . 118.7 111.128 -175.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 135' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -67.31 145.44 55.13 Favored 'General case' 0 CA--C 1.497 -1.06 0 C-N-CA 120.08 -0.648 . . . . 98.629999999999995 110.777 -179.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 136' ' ' LYS . . . . . 0.425 ' HB3' ' HE2' ' D' ' 136' ' ' LYS . 0.0 OUTLIER -147.27 131.19 17.14 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 114.86 -1.064 . . . . 108.39 108.9 166.826 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 137' ' ' TYR . . . . . 0.423 ' OH ' ' N3 ' ' B' ' 6' ' ' ' DA' . 9.0 t80 -70.8 115.9 10.48 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 114.863 -1.062 . . . . 103.87 108.921 -177.252 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 138' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -127.83 85.86 59.67 Favored Pre-proline 0 C--N 1.325 -0.469 0 N-CA-C 107.892 -1.151 . . . . 142.69 107.892 -179.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 139' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -64.81 158.6 50.0 Favored 'Trans proline' 0 C--O 1.239 0.562 0 C-N-CA 122.736 2.291 . . . . 87.189999999999998 110.301 178.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 140' ' ' ARG . . . . . . . . . . . . . 28.5 mtp-105 -91.75 168.03 11.75 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.776 0.672 . . . . 140.56999999999999 110.69 -177.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 141' ' ' ARG . . . . . . . . . . . . . 2.0 tpt180 . . . . . 0 CA--C 1.533 0.299 0 CA-C-O 121.424 0.631 . . . . 150.16 112.574 -179.343 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_