data_3zy1_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 3zy1 _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 ' 359' ' ' ASP . . . . . . . . . . . . . 19.3 t0 . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 113.161 0.8 . . . . 143.44 113.161 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 360' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -40.13 143.35 0.29 Allowed 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 119.038 2.977 . . . . 166.04 119.038 -164.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 361' ' ' LEU . . . . . . . . . . . . . 48.6 tp -101.6 109.1 20.84 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 121.449 0.642 . . . . 113.56 109.999 166.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 362' ' ' LEU . . . . . . . . . . . . . 6.0 mt -111.77 161.53 16.22 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.977 -1.01 . . . . 99.87 109.659 -172.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 363' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -126.0 123.63 38.9 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-O 120.967 0.413 . . . . 109.29 111.509 -174.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 364' ' ' LEU . . . . . . . . . . . . . 28.4 tp -109.95 111.78 58.31 Favored Pre-proline 0 N--CA 1.447 -0.598 0 CA-C-N 115.317 -0.856 . . . . 76.52 109.19 -179.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 365' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -76.18 132.91 14.33 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.013 1.809 . . . . 83.97 110.559 173.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 366' ' ' VAL . . . . . . . . . . . . . 4.3 t -125.1 119.71 56.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 O-C-N 123.632 0.582 . . . . 86.86 110.725 -179.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 367' ' ' ARG . . . . . . . . . . . . . . . -85.28 119.98 26.26 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.494 0.664 . . . . 87.74 109.965 166.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 368' ' ' GLY . . . . . . . . . . . . . . . 109.44 127.52 5.45 Favored Glycine 0 CA--C 1.505 -0.57 0 N-CA-C 109.911 -1.276 . . . . 93.27 109.911 -177.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 369' ' ' ARG . . . . . . . . . . . . . 29.0 ttm-85 -75.17 -34.14 61.55 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.244 -0.583 . . . . 138.11 111.689 176.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . . . -59.85 -44.58 94.05 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.218 0.607 . . . . 94.84 111.559 179.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 10.5 m -67.29 -55.9 11.98 Favored 'General case' 0 C--O 1.213 -0.826 0 C-N-CA 123.384 0.673 . . . . 79.82 111.131 175.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -45.08 -46.08 11.4 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 123.341 0.401 . . . . 83.91 111.987 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 373' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -69.4 -27.53 65.38 Favored 'General case' 0 C--O 1.245 0.819 0 N-CA-C 112.188 0.44 . . . . 125.49 112.188 -176.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 374' ' ' MET . . . . . . . . . . . . . 9.3 ttm -73.65 -50.28 21.79 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 123.988 0.915 . . . . 88.4 110.866 175.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.81 -40.33 97.05 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.968 -0.56 . . . . 66.72 110.766 178.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 67.0 tp -55.36 -54.94 37.41 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 112.559 0.577 . . . . 70.46 112.559 171.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 377' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -45.55 -56.18 5.41 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 124.475 1.11 . . . . 112.29 111.408 173.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 378' ' ' ILE . . . . . . . . . . . . . 88.9 mt -59.51 -47.67 90.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.152 -0.476 . . . . 61.49 111.56 -179.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 379' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -56.1 -46.31 79.11 Favored 'General case' 0 C--O 1.251 1.15 0 CA-C-O 121.518 0.675 . . . . 87.67 112.676 -178.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -66.02 -49.97 65.86 Favored 'General case' 0 CA--C 1.489 -1.38 0 CA-C-N 114.826 -1.079 . . . . 90.68 111.239 -176.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 81.7 p -62.6 -31.23 72.03 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 115.763 -0.653 . . . . 64.01 109.735 -177.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 382' ' ' LEU . . . . . . . . . . . . . 85.8 mt -72.27 -44.52 62.69 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 120.54 -0.464 . . . . 60.07 110.591 176.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 383' ' ' GLU . . . . . . . . . . . . . 79.4 mt-10 -66.99 -38.03 85.29 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 113.287 0.847 . . . . 99.64 113.287 176.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 384' ' ' LEU . . . . . . . . . . . . . 13.1 mt -71.06 -8.34 52.74 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.094 1.146 . . . . 69.38 114.094 -177.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 385' ' ' MET . . . . . . . . . . . . . 19.3 mtm -75.22 -21.23 58.79 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 114.897 1.443 . . . . 102.37 114.897 179.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 386' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -68.97 -6.52 28.21 Favored 'General case' 0 CA--C 1.552 1.057 0 N-CA-C 114.23 1.196 . . . . 124.37 114.23 175.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 387' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 -88.47 -11.42 45.93 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.872 0.469 . . . . 91.73 110.187 177.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 388' ' ' LEU . . . . . . . . . . . . . 95.7 mt -94.1 144.54 28.23 Favored Pre-proline 0 C--O 1.246 0.874 0 CA-C-N 116.317 -0.401 . . . . 66.36 111.684 173.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 389' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -61.01 146.88 97.17 Favored 'Trans proline' 0 C--O 1.244 0.777 0 C-N-CA 122.885 2.39 . . . . 76.31 110.479 173.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 390' ' ' GLN . . . . . . . . . . . . . 69.0 tp60 -59.86 -33.38 71.72 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.895 -0.78 . . . . 105.84 108.895 179.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 391' ' ' HIS . . . . . . . . . . . . . 64.6 t60 -63.7 -37.77 88.61 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 114.435 1.272 . . . . 119.57 114.435 178.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 392' ' ' THR . . . . . . . . . . . . . 62.9 m -65.89 -46.97 76.42 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.971 -0.455 . . . . 76.59 110.79 177.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 393' ' ' ILE . . . . . . . . . . . . . 62.6 mt -61.26 -36.74 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 114.89 -1.05 . . . . 92.5 108.82 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 394' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -73.24 -41.23 63.96 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 114.184 1.179 . . . . 142.62 114.184 177.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 395' ' ' THR . . . . . . . . . . . . . 21.3 m -67.88 -29.38 68.48 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 122.783 0.433 . . . . 99.04 111.255 176.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 396' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -67.28 -36.98 82.68 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.172 -0.467 . . . . 101.9 110.848 174.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 397' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -70.27 -41.48 73.37 Favored 'General case' 0 CA--C 1.56 1.328 0 N-CA-C 113.999 1.111 . . . . 132.0 113.999 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 398' ' ' GLN . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.569 0 C-N-CA 123.381 0.672 . . . . 121.27 111.225 175.656 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 359' ' ' ASP . . . . . . . . . . . . . 19.3 t0 . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 113.161 0.8 . . . . 143.44 113.161 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 360' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -40.13 143.35 0.29 Allowed 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 119.038 2.977 . . . . 166.04 119.038 -164.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 361' ' ' LEU . . . . . . . . . . . . . 48.6 tp -101.6 109.1 20.84 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 121.449 0.642 . . . . 113.56 109.999 166.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 362' ' ' LEU . . . . . . . . . . . . . 6.0 mt -111.77 161.53 16.22 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.977 -1.01 . . . . 99.87 109.659 -172.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 363' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -126.0 123.63 38.9 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-O 120.967 0.413 . . . . 109.29 111.509 -174.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 364' ' ' LEU . . . . . . . . . . . . . 28.4 tp -109.95 111.78 58.31 Favored Pre-proline 0 N--CA 1.447 -0.598 0 CA-C-N 115.317 -0.856 . . . . 76.52 109.19 -179.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 365' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -76.18 132.91 14.33 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.013 1.809 . . . . 83.97 110.559 173.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 366' ' ' VAL . . . . . . . . . . . . . 4.3 t -125.1 119.71 56.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 O-C-N 123.632 0.582 . . . . 86.86 110.725 -179.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 367' ' ' ARG . . . . . . . . . . . . . . . -85.28 119.98 26.26 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.494 0.664 . . . . 87.74 109.965 166.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 368' ' ' GLY . . . . . . . . . . . . . . . 109.44 127.52 5.45 Favored Glycine 0 CA--C 1.505 -0.57 0 N-CA-C 109.911 -1.276 . . . . 93.27 109.911 -177.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 369' ' ' ARG . . . . . 0.409 ' O ' ' HG2' ' A' ' 373' ' ' GLU . 29.0 ttm-85 -75.17 -34.14 61.55 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.244 -0.583 . . . . 138.11 111.689 176.858 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . . . -59.85 -44.58 94.05 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.218 0.607 . . . . 94.84 111.559 179.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 10.5 m -67.29 -55.9 11.98 Favored 'General case' 0 C--O 1.213 -0.826 0 C-N-CA 123.384 0.673 . . . . 79.82 111.131 175.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -45.08 -46.08 11.4 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 123.341 0.401 . . . . 83.91 111.987 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 373' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 369' ' ' ARG . 4.6 mm-40 -69.4 -27.53 65.38 Favored 'General case' 0 C--O 1.245 0.819 0 N-CA-C 112.188 0.44 . . . . 125.49 112.188 -176.558 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 374' ' ' MET . . . . . . . . . . . . . 9.3 ttm -73.65 -50.28 21.79 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 123.988 0.915 . . . . 88.4 110.866 175.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.81 -40.33 97.05 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.968 -0.56 . . . . 66.72 110.766 178.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 67.0 tp -55.36 -54.94 37.41 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 112.559 0.577 . . . . 70.46 112.559 171.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 377' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -45.55 -56.18 5.41 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 124.475 1.11 . . . . 112.29 111.408 173.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 378' ' ' ILE . . . . . . . . . . . . . 88.9 mt -59.51 -47.67 90.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.152 -0.476 . . . . 61.49 111.56 -179.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 379' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -56.1 -46.31 79.11 Favored 'General case' 0 C--O 1.251 1.15 0 CA-C-O 121.518 0.675 . . . . 87.67 112.676 -178.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -66.02 -49.97 65.86 Favored 'General case' 0 CA--C 1.489 -1.38 0 CA-C-N 114.826 -1.079 . . . . 90.68 111.239 -176.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 81.7 p -62.6 -31.23 72.03 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 115.763 -0.653 . . . . 64.01 109.735 -177.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 382' ' ' LEU . . . . . . . . . . . . . 85.8 mt -72.27 -44.52 62.69 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 120.54 -0.464 . . . . 60.07 110.591 176.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 383' ' ' GLU . . . . . . . . . . . . . 79.4 mt-10 -66.99 -38.03 85.29 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 113.287 0.847 . . . . 99.64 113.287 176.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 384' ' ' LEU . . . . . . . . . . . . . 13.1 mt -71.06 -8.34 52.74 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.094 1.146 . . . . 69.38 114.094 -177.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 385' ' ' MET . . . . . . . . . . . . . 19.3 mtm -75.22 -21.23 58.79 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 114.897 1.443 . . . . 102.37 114.897 179.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 386' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -68.97 -6.52 28.21 Favored 'General case' 0 CA--C 1.552 1.057 0 N-CA-C 114.23 1.196 . . . . 124.37 114.23 175.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 387' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 -88.47 -11.42 45.93 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.872 0.469 . . . . 91.73 110.187 177.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 388' ' ' LEU . . . . . . . . . . . . . 95.7 mt -94.1 144.54 28.23 Favored Pre-proline 0 C--O 1.246 0.874 0 CA-C-N 116.317 -0.401 . . . . 66.36 111.684 173.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 389' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -61.01 146.88 97.17 Favored 'Trans proline' 0 C--O 1.244 0.777 0 C-N-CA 122.885 2.39 . . . . 76.31 110.479 173.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 390' ' ' GLN . . . . . 0.473 ' O ' ' HG2' ' A' ' 394' ' ' GLU . 69.0 tp60 -59.86 -33.38 71.72 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.895 -0.78 . . . . 105.84 108.895 179.46 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 391' ' ' HIS . . . . . . . . . . . . . 64.6 t60 -63.7 -37.77 88.61 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 114.435 1.272 . . . . 119.57 114.435 178.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 392' ' ' THR . . . . . . . . . . . . . 62.9 m -65.89 -46.97 76.42 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.971 -0.455 . . . . 76.59 110.79 177.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 393' ' ' ILE . . . . . . . . . . . . . 62.6 mt -61.26 -36.74 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 114.89 -1.05 . . . . 92.5 108.82 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 394' ' ' GLU . . . . . 0.476 ' OE1' ' HA ' ' A' ' 394' ' ' GLU . 30.1 mm-40 -73.24 -41.23 63.96 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 114.184 1.179 . . . . 142.62 114.184 177.056 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 395' ' ' THR . . . . . . . . . . . . . 21.3 m -67.88 -29.38 68.48 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 122.783 0.433 . . . . 99.04 111.255 176.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 396' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -67.28 -36.98 82.68 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.172 -0.467 . . . . 101.9 110.848 174.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 397' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -70.27 -41.48 73.37 Favored 'General case' 0 CA--C 1.56 1.328 0 N-CA-C 113.999 1.111 . . . . 132.0 113.999 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 398' ' ' GLN . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.569 0 C-N-CA 123.381 0.672 . . . . 121.27 111.225 175.656 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 359' ' ' ASP . . . . . . . . . . . . . 19.3 t0 . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 113.161 0.8 . . . . 143.44 113.161 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 360' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -40.13 143.35 0.29 Allowed 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 119.038 2.977 . . . . 166.03999999999999 119.038 -164.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 361' ' ' LEU . . . . . . . . . . . . . 48.6 tp -101.6 109.1 20.84 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 121.449 0.642 . . . . 113.56 109.999 166.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 362' ' ' LEU . . . . . . . . . . . . . 6.0 mt -111.77 161.53 16.22 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.977 -1.01 . . . . 99.870000000000005 109.659 -172.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 363' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -126.0 123.63 38.9 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-O 120.967 0.413 . . . . 109.29000000000001 111.509 -174.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 364' ' ' LEU . . . . . . . . . . . . . 28.4 tp -109.95 111.78 58.31 Favored Pre-proline 0 N--CA 1.447 -0.598 0 CA-C-N 115.317 -0.856 . . . . 76.519999999999996 109.19 -179.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 365' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -76.18 132.91 14.33 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.013 1.809 . . . . 83.969999999999999 110.559 173.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 366' ' ' VAL . . . . . . . . . . . . . 4.3 t -125.1 119.71 56.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 O-C-N 123.632 0.582 . . . . 86.859999999999999 110.725 -179.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 367' ' ' ARG . . . . . . . . . . . . . . . -85.28 119.98 26.26 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.494 0.664 . . . . 87.739999999999995 109.965 166.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 368' ' ' GLY . . . . . . . . . . . . . . . 109.44 127.52 5.45 Favored Glycine 0 CA--C 1.505 -0.57 0 N-CA-C 109.911 -1.276 . . . . 93.269999999999996 109.911 -177.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 369' ' ' ARG . . . . . 0.409 ' O ' ' HG2' ' A' ' 373' ' ' GLU . 29.0 ttm-85 -75.17 -34.14 61.55 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.244 -0.583 . . . . 138.11000000000001 111.689 176.858 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 370' ' ' GLU . . . . . . . . . . . . . . . -59.85 -44.58 94.05 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.218 0.607 . . . . 94.840000000000003 111.559 179.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 10.5 m -67.29 -55.9 11.98 Favored 'General case' 0 C--O 1.213 -0.826 0 C-N-CA 123.384 0.673 . . . . 79.819999999999993 111.131 175.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -45.08 -46.08 11.4 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 123.341 0.401 . . . . 83.909999999999997 111.987 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 373' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 369' ' ' ARG . 4.6 mm-40 -69.4 -27.53 65.38 Favored 'General case' 0 C--O 1.245 0.819 0 N-CA-C 112.188 0.44 . . . . 125.48999999999999 112.188 -176.558 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 374' ' ' MET . . . . . . . . . . . . . 9.3 ttm -73.65 -50.28 21.79 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 123.988 0.915 . . . . 88.400000000000006 110.866 175.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.81 -40.33 97.05 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.968 -0.56 . . . . 66.719999999999999 110.766 178.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 67.0 tp -55.36 -54.94 37.41 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 112.559 0.577 . . . . 70.459999999999994 112.559 171.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 377' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -45.55 -56.18 5.41 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 124.475 1.11 . . . . 112.29000000000001 111.408 173.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 378' ' ' ILE . . . . . . . . . . . . . 88.9 mt -59.51 -47.67 90.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.152 -0.476 . . . . 61.490000000000002 111.56 -179.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 379' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -56.1 -46.31 79.11 Favored 'General case' 0 C--O 1.251 1.15 0 CA-C-O 121.518 0.675 . . . . 87.670000000000002 112.676 -178.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -66.02 -49.97 65.86 Favored 'General case' 0 CA--C 1.489 -1.38 0 CA-C-N 114.826 -1.079 . . . . 90.680000000000007 111.239 -176.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 81.7 p -62.6 -31.23 72.03 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 115.763 -0.653 . . . . 64.010000000000005 109.735 -177.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 382' ' ' LEU . . . . . . . . . . . . . 85.8 mt -72.27 -44.52 62.69 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 120.54 -0.464 . . . . 60.07 110.591 176.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 383' ' ' GLU . . . . . . . . . . . . . 79.4 mt-10 -66.99 -38.03 85.29 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 113.287 0.847 . . . . 99.640000000000001 113.287 176.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 384' ' ' LEU . . . . . . . . . . . . . 13.1 mt -71.06 -8.34 52.74 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.094 1.146 . . . . 69.379999999999995 114.094 -177.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 385' ' ' MET . . . . . . . . . . . . . 19.3 mtm -75.22 -21.23 58.79 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 114.897 1.443 . . . . 102.37 114.897 179.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 386' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -68.97 -6.52 28.21 Favored 'General case' 0 CA--C 1.552 1.057 0 N-CA-C 114.23 1.196 . . . . 124.37 114.23 175.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 387' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 -88.47 -11.42 45.93 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.872 0.469 . . . . 91.730000000000004 110.187 177.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 388' ' ' LEU . . . . . . . . . . . . . 95.7 mt -94.1 144.54 28.23 Favored Pre-proline 0 C--O 1.246 0.874 0 CA-C-N 116.317 -0.401 . . . . 66.359999999999999 111.684 173.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 389' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -61.01 146.88 97.17 Favored 'Trans proline' 0 C--O 1.244 0.777 0 C-N-CA 122.885 2.39 . . . . 76.310000000000002 110.479 173.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 390' ' ' GLN . . . . . 0.473 ' O ' ' HG2' ' A' ' 394' ' ' GLU . 69.0 tp60 -59.86 -33.38 71.72 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.895 -0.78 . . . . 105.84 108.895 179.46 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 391' ' ' HIS . . . . . . . . . . . . . 64.6 t60 -63.7 -37.77 88.61 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 114.435 1.272 . . . . 119.56999999999999 114.435 178.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 392' ' ' THR . . . . . . . . . . . . . 62.9 m -65.89 -46.97 76.42 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.971 -0.455 . . . . 76.590000000000003 110.79 177.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 393' ' ' ILE . . . . . . . . . . . . . 62.6 mt -61.26 -36.74 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 114.89 -1.05 . . . . 92.5 108.82 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 394' ' ' GLU . . . . . 0.476 ' OE1' ' HA ' ' A' ' 394' ' ' GLU . 30.1 mm-40 -73.24 -41.23 63.96 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 114.184 1.179 . . . . 142.62 114.184 177.056 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 395' ' ' THR . . . . . . . . . . . . . 21.3 m -67.88 -29.38 68.48 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 122.783 0.433 . . . . 99.040000000000006 111.255 176.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 396' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -67.28 -36.98 82.68 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.172 -0.467 . . . . 101.90000000000001 110.848 174.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 397' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -70.27 -41.48 73.37 Favored 'General case' 0 CA--C 1.56 1.328 0 N-CA-C 113.999 1.111 . . . . 132.0 113.999 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 398' ' ' GLN . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.569 0 C-N-CA 123.381 0.672 . . . . 121.27 111.225 175.656 . . . . . . . . 0 0 . 1 stop_ save_