data_3ktr_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 3ktr _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 ' 543' ' ' SER . . . . . . . . . . . . . 39.5 t . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 120.498 0.19 . . . . 45.48 110.955 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 544' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -68.17 158.83 55.77 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 120.82 1.014 . . . . 45.17 113.578 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 545' ' ' LEU . . . . . . . . . . . . . 51.2 tp -80.39 128.22 33.31 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.537 -0.912 . . . . 43.92 108.537 175.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 546' ' ' THR . . . . . . . . . . . . . 5.9 t -119.36 158.11 26.8 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.426 -0.352 . . . . 43.79 110.501 179.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -59.42 -33.75 71.63 Favored 'General case' 0 C--O 1.24 0.555 0 O-C-N 123.605 0.565 . . . . 43.21 112.467 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 28.4 m -69.54 -38.23 77.39 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 113.206 0.817 . . . . 44.42 113.206 174.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 549' ' ' MET . . . . . . . . . . . . . 7.2 mtp -55.83 -49.19 73.93 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.053 0.454 . . . . 45.4 110.189 172.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 550' ' ' LEU . . . . . . . . . . . . . 33.1 mt -63.21 -35.55 80.68 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.672 -0.694 . . . . 45.84 112.319 -178.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -62.04 -24.65 67.21 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.201 0.445 . . . . 43.8 112.201 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 552' ' ' SER . . . . . . . . . . . . . 48.8 m -74.14 -4.39 35.47 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.398 0.888 . . . . 43.0 113.398 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 553' ' ' ALA . . . . . . . . . . . . . . . -121.75 147.47 48.38 Favored Pre-proline 0 C--O 1.238 0.465 0 N-CA-C 114.989 1.477 . . . . 40.62 114.989 -168.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -51.28 144.11 31.5 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.276 1.984 . . . . 37.04 111.917 166.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -42.94 -44.93 9.24 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.103 2.535 . . . . 34.68 115.952 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 556' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -68.39 -34.93 76.91 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 118.272 -1.371 . . . . 33.29 110.284 -177.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -71.13 -37.27 72.3 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 109.148 -0.686 . . . . 25.03 109.148 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -56.71 -41.85 78.11 Favored 'General case' 0 C--O 1.252 1.213 0 C-N-CA 119.553 -0.859 . . . . 21.65 111.758 176.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -59.76 -44.37 93.88 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 120.796 0.331 . . . . 19.01 110.219 177.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 560' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -64.16 -42.61 96.68 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.259 -0.645 . . . . 18.58 109.259 -178.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 561' ' ' MET . . . . . . . . . . . . . 71.1 mtp -62.4 -44.64 95.96 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 116.578 -0.283 . . . . 22.15 110.382 -178.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 562' ' ' LEU . . . . . . . . . . . . . 50.9 mt -62.33 -44.27 96.88 Favored 'General case' 0 C--O 1.266 1.962 0 CA-C-N 115.662 -0.699 . . . . 18.19 110.334 177.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 563' ' ' GLY . . . . . . . . . . . . . . . -61.7 -38.31 95.69 Favored Glycine 0 N--CA 1.477 1.417 0 C-N-CA 120.578 -0.82 . . . . 16.02 111.558 -179.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 564' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -58.29 -35.56 72.01 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 117.44 0.62 . . . . 28.33 112.624 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -82.89 -36.28 25.48 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.383 0.611 . . . . 28.34 111.111 -178.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 566' ' ' LEU . . . . . . . . . . . . . 40.1 mt -71.74 -35.75 70.22 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 114.482 1.29 . . . . 22.01 114.482 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 567' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -56.57 -51.49 80.81 Favored Pre-proline 0 N--CA 1.448 -0.559 0 N-CA-C 113.803 1.038 . . . . 18.62 113.803 -170.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 568' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -56.8 -33.88 95.36 Favored 'Trans proline' 0 C--O 1.248 1.024 0 C-N-CA 117.582 -1.146 . . . . 18.36 113.484 -179.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 68.2 mt -70.54 -46.91 62.68 Favored 'General case' 0 CA--C 1.513 -0.477 0 O-C-N 124.116 0.885 . . . . 16.69 109.899 179.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 95.9 mt -64.32 -42.85 96.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 116.142 -0.481 . . . . 17.48 111.173 177.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -61.16 -34.86 75.71 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 122.202 -0.311 . . . . 19.55 111.495 178.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 572' ' ' ALA . . . . . . . . . . . . . . . -60.64 -39.59 88.83 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 120.015 -0.674 . . . . 16.98 111.509 177.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 573' ' ' MET . . . . . . . . . . . . . 25.4 mtp -75.27 -40.04 59.16 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.218 1.007 . . . . 28.55 111.781 -178.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -148.4 82.14 7.66 Favored Pre-proline 0 C--O 1.247 0.95 0 CA-C-N 116.015 -0.539 . . . . 24.81 111.062 -174.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 575' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -57.99 -36.43 98.08 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 O-C-N 123.025 1.013 . . . . 21.42 113.392 -173.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 88.7 m -71.41 -45.25 63.2 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.505 0.669 . . . . 23.82 112.717 -176.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 60.3 mt -89.65 1.21 56.32 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 115.599 -0.728 . . . . 25.82 111.873 -171.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -54.5 -47.44 73.05 Favored 'General case' 0 C--O 1.21 -1.014 0 N-CA-C 116.327 1.973 . . . . 20.73 116.327 -164.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . -60.61 -42.17 99.12 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.43 -0.89 . . . . 17.94 111.7 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 8.8 tptt -72.15 -43.23 64.94 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.591 -0.444 . . . . 23.58 111.832 -177.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 581' ' ' ILE . . . . . . . . . . . . . 73.0 mt -60.4 -46.64 94.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 C-N-CA 119.514 -0.874 . . . . 23.08 111.141 176.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 582' ' ' THR . . . . . . . . . . . . . 44.3 m -57.22 -46.56 82.82 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 119.971 -0.692 . . . . 18.76 111.229 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 583' ' ' GLY . . . . . . . . . . . . . . . -54.06 -44.4 73.17 Favored Glycine 0 C--O 1.26 1.724 0 CA-C-O 121.992 0.773 . . . . 17.83 112.442 176.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 584' ' ' MET . . . . . . . . . . . . . 95.0 mtp -61.27 -44.39 97.32 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 115.313 -0.443 . . . . 17.65 112.179 177.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 585' ' ' LEU . . . . . . . . . . . . . 7.9 mp -71.29 -28.77 64.36 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 123.211 0.32 . . . . 18.48 110.943 -176.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 586' ' ' LEU . . . . . . . . . . . . . 57.7 mt -64.23 -11.84 35.11 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 114.56 1.318 . . . . 20.93 114.56 -179.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 587' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -67.62 -24.14 65.43 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.352 0.501 . . . . 29.63 112.352 171.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 85.6 mt -68.88 149.35 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.498 0.719 . . . . 20.67 110.715 -178.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 589' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -55.95 144.54 28.07 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.257 0.551 . . . . 31.41 111.432 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 590' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -60.13 -36.87 78.46 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 114.778 1.399 . . . . 21.7 114.778 -175.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 591' ' ' SER . . . . . . . . . . . . . 55.5 m -60.56 -41.2 94.09 Favored 'General case' 0 C--O 1.241 0.612 0 N-CA-C 112.57 0.582 . . . . 23.27 112.57 174.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 592' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -67.18 -37.58 83.95 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.423 -0.353 . . . . 35.94 111.088 176.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 593' ' ' LEU . . . . . . . . . . . . . 84.1 mt -63.49 -41.76 98.54 Favored 'General case' 0 C--O 1.248 1.022 0 C-N-CA 120.394 -0.522 . . . . 23.65 112.072 176.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 16.6 mt -55.79 -44.76 78.06 Favored 'General case' 0 C--O 1.247 0.967 0 O-C-N 123.865 0.728 . . . . 25.54 112.153 171.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 595' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -58.89 -41.42 87.14 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 121.514 0.673 . . . . 22.81 110.458 176.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 596' ' ' MET . . . . . . . . . . . . . 48.6 mtp -64.42 -36.13 83.15 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.171 0.51 . . . . 28.55 111.113 -179.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 597' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.65 -29.01 68.93 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 112.839 0.681 . . . . 27.94 112.839 177.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -87.28 -19.21 28.6 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.113 0.965 . . . . 28.98 113.394 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 599' ' ' SER . . . . . . . . . . . . . 27.8 t -126.9 92.28 44.94 Favored Pre-proline 0 C--O 1.25 1.086 0 O-C-N 121.946 -0.471 . . . . 19.64 111.427 -172.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 600' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -49.48 -40.45 45.12 Favored 'Trans proline' 0 N--CA 1.488 1.187 0 O-C-N 122.823 0.907 . . . . 16.18 114.331 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 601' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -60.58 -41.07 93.92 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 119.974 -0.69 . . . . 30.03 112.059 176.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 39.7 m -65.9 -45.52 81.68 Favored 'General case' 0 C--O 1.255 1.378 0 CA-C-O 121.304 0.573 . . . . 16.87 109.868 -178.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 603' ' ' LEU . . . . . . . . . . . . . 63.0 tp -63.14 -43.07 99.37 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 119.027 -1.069 . . . . 15.8 109.638 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -64.8 -41.9 95.46 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 120.385 -0.526 . . . . 30.39 109.641 -175.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 81.8 p -60.73 -43.95 97.25 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 120.456 -0.498 . . . . 26.44 110.061 178.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 606' ' ' LYS . . . . . . . . . . . . . 9.1 tppt? -66.86 -38.08 85.65 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.551 0.691 . . . . 32.32 112.121 -179.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 607' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.69 -40.86 84.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 119.035 -1.066 . . . . 17.9 110.127 178.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 608' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -56.54 -45.04 81.41 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.166 -0.47 . . . . 26.04 110.077 174.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -60.85 -46.16 91.67 Favored 'General case' 0 C--O 1.259 1.585 0 CA-C-O 121.349 0.595 . . . . 34.63 111.587 177.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 610' ' ' ALA . . . . . . . . . . . . . . . -63.55 -43.7 96.31 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.964 -0.562 . . . . 17.3 111.872 -178.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 611' ' ' VAL . . . . . . . . . . . . . 60.7 t -63.15 -42.16 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 CA-C-O 121.413 0.625 . . . . 16.6 110.553 179.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 612' ' ' ALA . . . . . . . . . . . . . . . -64.42 -42.44 96.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.032 -0.531 . . . . 17.41 110.512 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 613' ' ' VAL . . . . . . . . . . . . . 21.7 t -63.91 -48.57 85.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 CA-C-O 121.997 0.903 . . . . 17.93 111.642 176.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -45.99 89.3 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.82 -0.627 . . . . 21.7 109.466 -179.859 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 615' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -67.25 -36.96 82.72 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.069 1.137 . . . . 27.66 114.069 -178.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -63.97 -43.88 94.43 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.182 0.515 . . . . 18.94 111.494 174.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 617' ' ' HIS . . . . . . . . . . . . . 82.4 t60 -58.45 -46.97 85.48 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.159 -0.473 . . . . 21.54 110.538 174.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 618' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -60.86 -36.54 79.43 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 123.092 0.557 . . . . 34.02 110.728 -177.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 619' ' ' ALA . . . . . . . . . . . . . . . -63.7 -44.37 93.85 Favored 'General case' 0 C--O 1.244 0.803 0 O-C-N 123.388 0.43 . . . . 30.64 110.499 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 620' ' ' LYS . . . . . . . . . . . . . 24.5 ttmt -61.63 -45.22 94.98 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.226 -0.59 . . . . 35.79 112.55 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 621' ' ' GLU . . . . . . . . . . . . . 83.9 mt-10 -68.22 -35.46 78.0 Favored 'General case' 0 C--O 1.247 0.943 0 N-CA-C 113.281 0.845 . . . . 39.66 113.281 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 622' ' ' ALA . . . . . . . . . . . . . . . -67.01 -32.61 73.96 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 112.632 0.604 . . . . 34.38 112.632 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 623' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.272 0 C-N-CA 123.938 0.895 . . . . 35.88 111.148 -175.864 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 913' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.5 2.038 0 CA-C-O 120.715 0.293 . . . . 30.7 111.227 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 914' ' ' LEU . . . . . . . . . . . . . 19.3 mt -81.98 127.84 33.47 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.614 0.766 . . . . 25.9 112.282 -168.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 915' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -106.26 115.9 60.24 Favored Pre-proline 0 C--O 1.253 1.28 0 O-C-N 123.657 0.598 . . . . 24.82 109.906 -179.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 916' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.66 -7.14 19.63 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 121.455 1.436 . . . . 24.0 112.342 -178.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 917' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -90.45 7.18 40.09 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 114.268 1.21 . . . . 24.16 114.268 173.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 918' ' ' ALA . . . . . . . . . . . . . . . -59.28 150.41 25.93 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 113.738 1.014 . . . . 25.73 113.738 -179.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 919' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -56.27 131.42 47.98 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.579 -0.737 . . . . 34.34 109.759 174.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 920' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -65.11 145.76 55.86 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.0 -0.68 . . . . 37.17 111.037 171.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 921' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -88.69 136.32 33.06 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.361 -0.836 . . . . 27.64 111.087 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 922' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -112.45 112.27 51.73 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 115.972 -0.558 . . . . 35.56 112.204 173.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 923' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -74.82 164.96 32.47 Favored 'Trans proline' 0 C--O 1.247 0.947 0 C-N-CA 121.161 1.241 . . . . 28.09 110.314 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 924' ' ' ARG . . . . . . . . . . . . . 29.5 ttt85 -66.56 -35.25 79.77 Favored 'General case' 0 CA--C 1.514 -0.423 0 O-C-N 123.959 0.787 . . . . 40.56 109.944 175.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 925' ' ' SER . . . . . . . . . . . . . 59.6 p -152.51 158.51 42.65 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 115.64 -0.709 . . . . 30.58 110.688 172.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 926' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -88.6 -22.03 23.71 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.765 0.654 . . . . 32.98 112.765 179.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 927' ' ' SER . . . . . . . . . . . . . 1.4 p -64.56 -14.82 59.41 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.881 -0.599 . . . . 36.29 110.259 174.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 928' ' ' GLN . . . . . . . . . . . . . 64.6 mt-30 . . . . . 0 CA--C 1.519 -0.24 0 N-CA-C 107.049 -1.463 . . . . 40.19 107.049 160.543 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 627' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 628' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 629' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 543' ' ' SER . . . . . . . . . . . . . 39.5 t . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 120.498 0.19 . . . . 45.479999999999997 110.955 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 544' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -68.17 158.83 55.77 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 120.82 1.014 . . . . 45.170000000000002 113.578 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 545' ' ' LEU . . . . . . . . . . . . . 51.2 tp -80.39 128.22 33.31 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.537 -0.912 . . . . 43.920000000000002 108.537 175.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 546' ' ' THR . . . . . 0.505 HG23 ' H ' ' A' ' 549' ' ' MET . 5.9 t -119.36 158.11 26.8 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.426 -0.352 . . . . 43.789999999999999 110.501 179.684 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -59.42 -33.75 71.63 Favored 'General case' 0 C--O 1.24 0.555 0 O-C-N 123.605 0.565 . . . . 43.210000000000001 112.467 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 28.4 m -69.54 -38.23 77.39 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 113.206 0.817 . . . . 44.420000000000002 113.206 174.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 549' ' ' MET . . . . . 0.505 ' H ' HG23 ' A' ' 546' ' ' THR . 7.2 mtp -55.83 -49.19 73.93 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.053 0.454 . . . . 45.399999999999999 110.189 172.035 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 550' ' ' LEU . . . . . . . . . . . . . 33.1 mt -63.21 -35.55 80.68 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.672 -0.694 . . . . 45.840000000000003 112.319 -178.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -62.04 -24.65 67.21 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.201 0.445 . . . . 43.799999999999997 112.201 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 552' ' ' SER . . . . . . . . . . . . . 48.8 m -74.14 -4.39 35.47 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.398 0.888 . . . . 43.0 113.398 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 553' ' ' ALA . . . . . . . . . . . . . . . -121.75 147.47 48.38 Favored Pre-proline 0 C--O 1.238 0.465 0 N-CA-C 114.989 1.477 . . . . 40.619999999999997 114.989 -168.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -51.28 144.11 31.5 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.276 1.984 . . . . 37.039999999999999 111.917 166.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -42.94 -44.93 9.24 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.103 2.535 . . . . 34.68 115.952 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 556' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -68.39 -34.93 76.91 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 118.272 -1.371 . . . . 33.289999999999999 110.284 -177.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -71.13 -37.27 72.3 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 109.148 -0.686 . . . . 25.030000000000001 109.148 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -56.71 -41.85 78.11 Favored 'General case' 0 C--O 1.252 1.213 0 C-N-CA 119.553 -0.859 . . . . 21.649999999999999 111.758 176.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -59.76 -44.37 93.88 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 120.796 0.331 . . . . 19.010000000000002 110.219 177.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 560' ' ' GLN . . . . . 0.469 ' O ' ' HG2' ' A' ' 564' ' ' GLU . 59.1 tp60 -64.16 -42.61 96.68 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.259 -0.645 . . . . 18.579999999999998 109.259 -178.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 561' ' ' MET . . . . . . . . . . . . . 71.1 mtp -62.4 -44.64 95.96 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 116.578 -0.283 . . . . 22.149999999999999 110.382 -178.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 562' ' ' LEU . . . . . . . . . . . . . 50.9 mt -62.33 -44.27 96.88 Favored 'General case' 0 C--O 1.266 1.962 0 CA-C-N 115.662 -0.699 . . . . 18.190000000000001 110.334 177.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 563' ' ' GLY . . . . . . . . . . . . . . . -61.7 -38.31 95.69 Favored Glycine 0 N--CA 1.477 1.417 0 C-N-CA 120.578 -0.82 . . . . 16.02 111.558 -179.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 564' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 560' ' ' GLN . 35.2 mm-40 -58.29 -35.56 72.01 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 117.44 0.62 . . . . 28.329999999999998 112.624 179.132 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -82.89 -36.28 25.48 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.383 0.611 . . . . 28.34 111.111 -178.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 566' ' ' LEU . . . . . . . . . . . . . 40.1 mt -71.74 -35.75 70.22 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 114.482 1.29 . . . . 22.010000000000002 114.482 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 567' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -56.57 -51.49 80.81 Favored Pre-proline 0 N--CA 1.448 -0.559 0 N-CA-C 113.803 1.038 . . . . 18.620000000000001 113.803 -170.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 568' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -56.8 -33.88 95.36 Favored 'Trans proline' 0 C--O 1.248 1.024 0 C-N-CA 117.582 -1.146 . . . . 18.359999999999999 113.484 -179.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 569' ' ' LEU . . . . . 0.428 ' O ' ' HG3' ' A' ' 573' ' ' MET . 68.2 mt -70.54 -46.91 62.68 Favored 'General case' 0 CA--C 1.513 -0.477 0 O-C-N 124.116 0.885 . . . . 16.690000000000001 109.899 179.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 95.9 mt -64.32 -42.85 96.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 116.142 -0.481 . . . . 17.48 111.173 177.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 571' ' ' GLN . . . . . 0.434 ' HA ' ' HB2' ' A' ' 578' ' ' ALA . 17.9 tt0 -61.16 -34.86 75.71 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 122.202 -0.311 . . . . 19.550000000000001 111.495 178.263 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 572' ' ' ALA . . . . . . . . . . . . . . . -60.64 -39.59 88.83 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 120.015 -0.674 . . . . 16.98 111.509 177.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 573' ' ' MET . . . . . 0.428 ' HG3' ' O ' ' A' ' 569' ' ' LEU . 25.4 mtp -75.27 -40.04 59.16 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.218 1.007 . . . . 28.550000000000001 111.781 -178.796 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -148.4 82.14 7.66 Favored Pre-proline 0 C--O 1.247 0.95 0 CA-C-N 116.015 -0.539 . . . . 24.809999999999999 111.062 -174.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 575' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -57.99 -36.43 98.08 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 O-C-N 123.025 1.013 . . . . 21.420000000000002 113.392 -173.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 88.7 m -71.41 -45.25 63.2 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.505 0.669 . . . . 23.82 112.717 -176.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 60.3 mt -89.65 1.21 56.32 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 115.599 -0.728 . . . . 25.82 111.873 -171.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 578' ' ' ALA . . . . . 0.434 ' HB2' ' HA ' ' A' ' 571' ' ' GLN . . . -54.5 -47.44 73.05 Favored 'General case' 0 C--O 1.21 -1.014 0 N-CA-C 116.327 1.973 . . . . 20.73 116.327 -164.702 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . -60.61 -42.17 99.12 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.43 -0.89 . . . . 17.940000000000001 111.7 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 8.8 tptt -72.15 -43.23 64.94 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.591 -0.444 . . . . 23.579999999999998 111.832 -177.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 581' ' ' ILE . . . . . . . . . . . . . 73.0 mt -60.4 -46.64 94.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 C-N-CA 119.514 -0.874 . . . . 23.079999999999998 111.141 176.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 582' ' ' THR . . . . . . . . . . . . . 44.3 m -57.22 -46.56 82.82 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 119.971 -0.692 . . . . 18.760000000000002 111.229 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 583' ' ' GLY . . . . . . . . . . . . . . . -54.06 -44.4 73.17 Favored Glycine 0 C--O 1.26 1.724 0 CA-C-O 121.992 0.773 . . . . 17.829999999999998 112.442 176.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 584' ' ' MET . . . . . . . . . . . . . 95.0 mtp -61.27 -44.39 97.32 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 115.313 -0.443 . . . . 17.649999999999999 112.179 177.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 585' ' ' LEU . . . . . 0.557 HD22 ' HG3' ' A' ' 606' ' ' LYS . 7.9 mp -71.29 -28.77 64.36 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 123.211 0.32 . . . . 21.149999999999999 110.943 -176.886 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 586' ' ' LEU . . . . . . . . . . . . . 57.7 mt -64.23 -11.84 35.11 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 114.56 1.318 . . . . 20.93 114.56 -179.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 587' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -67.62 -24.14 65.43 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.352 0.501 . . . . 29.629999999999999 112.352 171.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 85.6 mt -68.88 149.35 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.498 0.719 . . . . 20.670000000000002 110.715 -178.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 589' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -55.95 144.54 28.07 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.257 0.551 . . . . 31.41 111.432 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 590' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -60.13 -36.87 78.46 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 114.778 1.399 . . . . 21.699999999999999 114.778 -175.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 591' ' ' SER . . . . . . . . . . . . . 55.5 m -60.56 -41.2 94.09 Favored 'General case' 0 C--O 1.241 0.612 0 N-CA-C 112.57 0.582 . . . . 23.27 112.57 174.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 592' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -67.18 -37.58 83.95 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.423 -0.353 . . . . 35.939999999999998 111.088 176.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 593' ' ' LEU . . . . . . . . . . . . . 84.1 mt -63.49 -41.76 98.54 Favored 'General case' 0 C--O 1.248 1.022 0 C-N-CA 120.394 -0.522 . . . . 23.649999999999999 112.072 176.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 16.6 mt -55.79 -44.76 78.06 Favored 'General case' 0 C--O 1.247 0.967 0 O-C-N 123.865 0.728 . . . . 25.539999999999999 112.153 171.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 595' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -58.89 -41.42 87.14 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 121.514 0.673 . . . . 22.809999999999999 110.458 176.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 596' ' ' MET . . . . . 0.488 ' CE ' HD23 ' A' ' 585' ' ' LEU . 48.6 mtp -64.42 -36.13 83.15 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.171 0.51 . . . . 28.550000000000001 111.113 -179.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 597' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.65 -29.01 68.93 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 112.839 0.681 . . . . 27.940000000000001 112.839 177.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -87.28 -19.21 28.6 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.113 0.965 . . . . 28.98 113.394 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 599' ' ' SER . . . . . . . . . . . . . 27.8 t -126.9 92.28 44.94 Favored Pre-proline 0 C--O 1.25 1.086 0 O-C-N 121.946 -0.471 . . . . 19.640000000000001 111.427 -172.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 600' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -49.48 -40.45 45.12 Favored 'Trans proline' 0 N--CA 1.488 1.187 0 O-C-N 122.823 0.907 . . . . 16.18 114.331 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 601' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -60.58 -41.07 93.92 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 119.974 -0.69 . . . . 30.030000000000001 112.059 176.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 39.7 m -65.9 -45.52 81.68 Favored 'General case' 0 C--O 1.255 1.378 0 CA-C-O 121.304 0.573 . . . . 16.870000000000001 109.868 -178.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 603' ' ' LEU . . . . . . . . . . . . . 63.0 tp -63.14 -43.07 99.37 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 119.027 -1.069 . . . . 15.800000000000001 109.638 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -64.8 -41.9 95.46 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 120.385 -0.526 . . . . 30.390000000000001 109.641 -175.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 81.8 p -60.73 -43.95 97.25 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 120.456 -0.498 . . . . 26.440000000000001 110.061 178.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 606' ' ' LYS . . . . . 0.557 ' HG3' HD22 ' A' ' 585' ' ' LEU . 9.1 tppt? -66.86 -38.08 85.65 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.551 0.691 . . . . 32.32 112.121 -179.252 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 607' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.69 -40.86 84.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 119.035 -1.066 . . . . 17.899999999999999 110.127 178.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 608' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -56.54 -45.04 81.41 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.166 -0.47 . . . . 26.039999999999999 110.077 174.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -60.85 -46.16 91.67 Favored 'General case' 0 C--O 1.259 1.585 0 CA-C-O 121.349 0.595 . . . . 34.630000000000003 111.587 177.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 610' ' ' ALA . . . . . . . . . . . . . . . -63.55 -43.7 96.31 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.964 -0.562 . . . . 17.300000000000001 111.872 -178.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 611' ' ' VAL . . . . . . . . . . . . . 60.7 t -63.15 -42.16 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 CA-C-O 121.413 0.625 . . . . 16.600000000000001 110.553 179.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 612' ' ' ALA . . . . . . . . . . . . . . . -64.42 -42.44 96.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.032 -0.531 . . . . 17.41 110.512 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 613' ' ' VAL . . . . . . . . . . . . . 21.7 t -63.91 -48.57 85.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 CA-C-O 121.997 0.903 . . . . 17.93 111.642 176.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -45.99 89.3 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.82 -0.627 . . . . 21.699999999999999 109.466 -179.859 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 615' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -67.25 -36.96 82.72 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.069 1.137 . . . . 27.66 114.069 -178.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -63.97 -43.88 94.43 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.182 0.515 . . . . 18.940000000000001 111.494 174.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 617' ' ' HIS . . . . . . . . . . . . . 82.4 t60 -58.45 -46.97 85.48 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.159 -0.473 . . . . 21.539999999999999 110.538 174.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 618' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -60.86 -36.54 79.43 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 123.092 0.557 . . . . 34.020000000000003 110.728 -177.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 619' ' ' ALA . . . . . . . . . . . . . . . -63.7 -44.37 93.85 Favored 'General case' 0 C--O 1.244 0.803 0 O-C-N 123.388 0.43 . . . . 30.640000000000001 110.499 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 620' ' ' LYS . . . . . . . . . . . . . 24.5 ttmt -61.63 -45.22 94.98 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.226 -0.59 . . . . 35.789999999999999 112.55 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 621' ' ' GLU . . . . . . . . . . . . . 83.9 mt-10 -68.22 -35.46 78.0 Favored 'General case' 0 C--O 1.247 0.943 0 N-CA-C 113.281 0.845 . . . . 39.659999999999997 113.281 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 622' ' ' ALA . . . . . . . . . . . . . . . -67.01 -32.61 73.96 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 112.632 0.604 . . . . 34.380000000000003 112.632 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 623' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.272 0 C-N-CA 123.938 0.895 . . . . 35.880000000000003 111.148 -175.864 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 913' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.5 2.038 0 CA-C-O 120.715 0.293 . . . . 30.699999999999999 111.227 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 914' ' ' LEU . . . . . . . . . . . . . 19.3 mt -81.98 127.84 33.47 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.614 0.766 . . . . 25.899999999999999 112.282 -168.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 915' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -106.26 115.9 60.24 Favored Pre-proline 0 C--O 1.253 1.28 0 O-C-N 123.657 0.598 . . . . 24.82 109.906 -179.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 916' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.66 -7.14 19.63 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 121.455 1.436 . . . . 24.0 112.342 -178.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 917' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -90.45 7.18 40.09 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 114.268 1.21 . . . . 24.16 114.268 173.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 918' ' ' ALA . . . . . . . . . . . . . . . -59.28 150.41 25.93 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 113.738 1.014 . . . . 25.73 113.738 -179.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 919' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -56.27 131.42 47.98 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.579 -0.737 . . . . 34.340000000000003 109.759 174.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 920' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -65.11 145.76 55.86 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.0 -0.68 . . . . 37.170000000000002 111.037 171.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 921' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -88.69 136.32 33.06 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.361 -0.836 . . . . 27.640000000000001 111.087 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 922' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -112.45 112.27 51.73 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 115.972 -0.558 . . . . 35.560000000000002 112.204 173.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 923' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -74.82 164.96 32.47 Favored 'Trans proline' 0 C--O 1.247 0.947 0 C-N-CA 121.161 1.241 . . . . 28.09 110.314 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 924' ' ' ARG . . . . . . . . . . . . . 29.5 ttt85 -66.56 -35.25 79.77 Favored 'General case' 0 CA--C 1.514 -0.423 0 O-C-N 123.959 0.787 . . . . 40.560000000000002 109.944 175.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 925' ' ' SER . . . . . 0.532 ' H ' HE21 ' B' ' 928' ' ' GLN . 59.6 p -152.51 158.51 42.65 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 115.64 -0.709 . . . . 30.579999999999998 110.688 172.806 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 926' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -88.6 -22.03 23.71 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.765 0.654 . . . . 32.979999999999997 112.765 179.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 927' ' ' SER . . . . . . . . . . . . . 1.4 p -64.56 -14.82 59.41 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.881 -0.599 . . . . 36.289999999999999 110.259 174.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 928' ' ' GLN . . . . . 0.532 HE21 ' H ' ' B' ' 925' ' ' SER . 64.6 mt-30 . . . . . 0 CA--C 1.519 -0.24 0 N-CA-C 107.049 -1.463 . . . . 40.189999999999998 107.049 160.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 627' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 628' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 629' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 543' ' ' SER . . . . . . . . . . . . . 39.5 t . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 120.498 0.19 . . . . 45.479999999999997 110.955 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 544' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -68.17 158.83 55.77 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 120.82 1.014 . . . . 45.170000000000002 113.578 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 545' ' ' LEU . . . . . . . . . . . . . 51.2 tp -80.39 128.22 33.31 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.537 -0.912 . . . . 43.920000000000002 108.537 175.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 546' ' ' THR . . . . . 0.505 HG23 ' H ' ' A' ' 549' ' ' MET . 5.9 t -119.36 158.11 26.8 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.426 -0.352 . . . . 43.789999999999999 110.501 179.684 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -59.42 -33.75 71.63 Favored 'General case' 0 C--O 1.24 0.555 0 O-C-N 123.605 0.565 . . . . 43.210000000000001 112.467 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 28.4 m -69.54 -38.23 77.39 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 113.206 0.817 . . . . 44.420000000000002 113.206 174.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 549' ' ' MET . . . . . 0.505 ' H ' HG23 ' A' ' 546' ' ' THR . 7.2 mtp -55.83 -49.19 73.93 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.053 0.454 . . . . 45.399999999999999 110.189 172.035 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 550' ' ' LEU . . . . . . . . . . . . . 33.1 mt -63.21 -35.55 80.68 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.672 -0.694 . . . . 45.840000000000003 112.319 -178.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -62.04 -24.65 67.21 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 112.201 0.445 . . . . 43.799999999999997 112.201 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 552' ' ' SER . . . . . . . . . . . . . 48.8 m -74.14 -4.39 35.47 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.398 0.888 . . . . 43.0 113.398 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 553' ' ' ALA . . . . . . . . . . . . . . . -121.75 147.47 48.38 Favored Pre-proline 0 C--O 1.238 0.465 0 N-CA-C 114.989 1.477 . . . . 40.619999999999997 114.989 -168.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 554' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -51.28 144.11 31.5 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.276 1.984 . . . . 37.039999999999999 111.917 166.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 555' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -42.94 -44.93 9.24 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.103 2.535 . . . . 34.68 115.952 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 556' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -68.39 -34.93 76.91 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 118.272 -1.371 . . . . 33.289999999999999 110.284 -177.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 557' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -71.13 -37.27 72.3 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 109.148 -0.686 . . . . 25.030000000000001 109.148 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 558' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -56.71 -41.85 78.11 Favored 'General case' 0 C--O 1.252 1.213 0 C-N-CA 119.553 -0.859 . . . . 21.649999999999999 111.758 176.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -59.76 -44.37 93.88 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 120.796 0.331 . . . . 19.010000000000002 110.219 177.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 560' ' ' GLN . . . . . 0.469 ' O ' ' HG2' ' A' ' 564' ' ' GLU . 59.1 tp60 -64.16 -42.61 96.68 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.259 -0.645 . . . . 18.579999999999998 109.259 -178.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 561' ' ' MET . . . . . . . . . . . . . 71.1 mtp -62.4 -44.64 95.96 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 116.578 -0.283 . . . . 22.149999999999999 110.382 -178.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 562' ' ' LEU . . . . . . . . . . . . . 50.9 mt -62.33 -44.27 96.88 Favored 'General case' 0 C--O 1.266 1.962 0 CA-C-N 115.662 -0.699 . . . . 18.190000000000001 110.334 177.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 563' ' ' GLY . . . . . . . . . . . . . . . -61.7 -38.31 95.69 Favored Glycine 0 N--CA 1.477 1.417 0 C-N-CA 120.578 -0.82 . . . . 16.02 111.558 -179.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 564' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 560' ' ' GLN . 35.2 mm-40 -58.29 -35.56 72.01 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 117.44 0.62 . . . . 28.329999999999998 112.624 179.132 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -82.89 -36.28 25.48 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.383 0.611 . . . . 28.34 111.111 -178.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 566' ' ' LEU . . . . . . . . . . . . . 40.1 mt -71.74 -35.75 70.22 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 114.482 1.29 . . . . 22.010000000000002 114.482 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 567' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -56.57 -51.49 80.81 Favored Pre-proline 0 N--CA 1.448 -0.559 0 N-CA-C 113.803 1.038 . . . . 18.620000000000001 113.803 -170.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 568' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -56.8 -33.88 95.36 Favored 'Trans proline' 0 C--O 1.248 1.024 0 C-N-CA 117.582 -1.146 . . . . 18.359999999999999 113.484 -179.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 569' ' ' LEU . . . . . 0.428 ' O ' ' HG3' ' A' ' 573' ' ' MET . 68.2 mt -70.54 -46.91 62.68 Favored 'General case' 0 CA--C 1.513 -0.477 0 O-C-N 124.116 0.885 . . . . 16.690000000000001 109.899 179.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 95.9 mt -64.32 -42.85 96.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 116.142 -0.481 . . . . 17.48 111.173 177.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.434 ' HA ' ' HB2' ' A' ' 578' ' ' ALA . 17.9 tt0 -61.16 -34.86 75.71 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 122.202 -0.311 . . . . 19.550000000000001 111.495 178.263 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 572' ' ' ALA . . . . . . . . . . . . . . . -60.64 -39.59 88.83 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 120.015 -0.674 . . . . 16.98 111.509 177.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 573' ' ' MET . . . . . 0.428 ' HG3' ' O ' ' A' ' 569' ' ' LEU . 25.4 mtp -75.27 -40.04 59.16 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.218 1.007 . . . . 28.550000000000001 111.781 -178.796 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 574' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -148.4 82.14 7.66 Favored Pre-proline 0 C--O 1.247 0.95 0 CA-C-N 116.015 -0.539 . . . . 24.809999999999999 111.062 -174.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 575' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -57.99 -36.43 98.08 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 O-C-N 123.025 1.013 . . . . 21.420000000000002 113.392 -173.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 88.7 m -71.41 -45.25 63.2 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.505 0.669 . . . . 23.82 112.717 -176.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 577' ' ' LEU . . . . . . . . . . . . . 60.3 mt -89.65 1.21 56.32 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 115.599 -0.728 . . . . 25.82 111.873 -171.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 578' ' ' ALA . . . . . 0.434 ' HB2' ' HA ' ' A' ' 571' ' ' GLN . . . -54.5 -47.44 73.05 Favored 'General case' 0 C--O 1.21 -1.014 0 N-CA-C 116.327 1.973 . . . . 20.73 116.327 -164.702 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . -60.61 -42.17 99.12 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.43 -0.89 . . . . 17.940000000000001 111.7 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 8.8 tptt -72.15 -43.23 64.94 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.591 -0.444 . . . . 23.579999999999998 111.832 -177.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 581' ' ' ILE . . . . . . . . . . . . . 73.0 mt -60.4 -46.64 94.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 C-N-CA 119.514 -0.874 . . . . 23.079999999999998 111.141 176.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 582' ' ' THR . . . . . . . . . . . . . 44.3 m -57.22 -46.56 82.82 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 119.971 -0.692 . . . . 18.760000000000002 111.229 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 583' ' ' GLY . . . . . . . . . . . . . . . -54.06 -44.4 73.17 Favored Glycine 0 C--O 1.26 1.724 0 CA-C-O 121.992 0.773 . . . . 17.829999999999998 112.442 176.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 584' ' ' MET . . . . . . . . . . . . . 95.0 mtp -61.27 -44.39 97.32 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 115.313 -0.443 . . . . 17.649999999999999 112.179 177.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 585' ' ' LEU . . . . . 0.557 HD22 ' HG3' ' A' ' 606' ' ' LYS . 7.9 mp -71.29 -28.77 64.36 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 123.211 0.32 . . . . 21.149999999999999 110.943 -176.886 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 586' ' ' LEU . . . . . . . . . . . . . 57.7 mt -64.23 -11.84 35.11 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 114.56 1.318 . . . . 20.93 114.56 -179.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 587' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -67.62 -24.14 65.43 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.352 0.501 . . . . 29.629999999999999 112.352 171.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 588' ' ' ILE . . . . . . . . . . . . . 85.6 mt -68.88 149.35 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.498 0.719 . . . . 20.670000000000002 110.715 -178.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 589' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -55.95 144.54 28.07 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.257 0.551 . . . . 31.41 111.432 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 590' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -60.13 -36.87 78.46 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 114.778 1.399 . . . . 21.699999999999999 114.778 -175.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 591' ' ' SER . . . . . . . . . . . . . 55.5 m -60.56 -41.2 94.09 Favored 'General case' 0 C--O 1.241 0.612 0 N-CA-C 112.57 0.582 . . . . 23.27 112.57 174.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 592' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -67.18 -37.58 83.95 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.423 -0.353 . . . . 35.939999999999998 111.088 176.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 593' ' ' LEU . . . . . . . . . . . . . 84.1 mt -63.49 -41.76 98.54 Favored 'General case' 0 C--O 1.248 1.022 0 C-N-CA 120.394 -0.522 . . . . 23.649999999999999 112.072 176.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 16.6 mt -55.79 -44.76 78.06 Favored 'General case' 0 C--O 1.247 0.967 0 O-C-N 123.865 0.728 . . . . 25.539999999999999 112.153 171.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 595' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -58.89 -41.42 87.14 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 121.514 0.673 . . . . 22.809999999999999 110.458 176.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 596' ' ' MET . . . . . 0.488 ' CE ' HD23 ' A' ' 585' ' ' LEU . 48.6 mtp -64.42 -36.13 83.15 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.171 0.51 . . . . 28.550000000000001 111.113 -179.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 597' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.65 -29.01 68.93 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 112.839 0.681 . . . . 27.940000000000001 112.839 177.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -87.28 -19.21 28.6 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.113 0.965 . . . . 28.98 113.394 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 599' ' ' SER . . . . . . . . . . . . . 27.8 t -126.9 92.28 44.94 Favored Pre-proline 0 C--O 1.25 1.086 0 O-C-N 121.946 -0.471 . . . . 19.640000000000001 111.427 -172.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 600' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -49.48 -40.45 45.12 Favored 'Trans proline' 0 N--CA 1.488 1.187 0 O-C-N 122.823 0.907 . . . . 16.18 114.331 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 601' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -60.58 -41.07 93.92 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 119.974 -0.69 . . . . 30.030000000000001 112.059 176.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 39.7 m -65.9 -45.52 81.68 Favored 'General case' 0 C--O 1.255 1.378 0 CA-C-O 121.304 0.573 . . . . 16.870000000000001 109.868 -178.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 603' ' ' LEU . . . . . . . . . . . . . 63.0 tp -63.14 -43.07 99.37 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 119.027 -1.069 . . . . 15.800000000000001 109.638 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -64.8 -41.9 95.46 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 120.385 -0.526 . . . . 30.390000000000001 109.641 -175.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 81.8 p -60.73 -43.95 97.25 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 120.456 -0.498 . . . . 26.440000000000001 110.061 178.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 606' ' ' LYS . . . . . 0.557 ' HG3' HD22 ' A' ' 585' ' ' LEU . 9.1 tppt? -66.86 -38.08 85.65 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.551 0.691 . . . . 32.32 112.121 -179.252 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 607' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.69 -40.86 84.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 119.035 -1.066 . . . . 17.899999999999999 110.127 178.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 608' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -56.54 -45.04 81.41 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.166 -0.47 . . . . 26.039999999999999 110.077 174.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -60.85 -46.16 91.67 Favored 'General case' 0 C--O 1.259 1.585 0 CA-C-O 121.349 0.595 . . . . 34.630000000000003 111.587 177.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 610' ' ' ALA . . . . . . . . . . . . . . . -63.55 -43.7 96.31 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.964 -0.562 . . . . 17.300000000000001 111.872 -178.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 611' ' ' VAL . . . . . . . . . . . . . 60.7 t -63.15 -42.16 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 CA-C-O 121.413 0.625 . . . . 16.600000000000001 110.553 179.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 612' ' ' ALA . . . . . . . . . . . . . . . -64.42 -42.44 96.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.032 -0.531 . . . . 17.41 110.512 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 613' ' ' VAL . . . . . . . . . . . . . 21.7 t -63.91 -48.57 85.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 CA-C-O 121.997 0.903 . . . . 17.93 111.642 176.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -45.99 89.3 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.82 -0.627 . . . . 21.699999999999999 109.466 -179.859 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 615' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -67.25 -36.96 82.72 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.069 1.137 . . . . 27.66 114.069 -178.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -63.97 -43.88 94.43 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.182 0.515 . . . . 18.940000000000001 111.494 174.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 617' ' ' HIS . . . . . . . . . . . . . 82.4 t60 -58.45 -46.97 85.48 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.159 -0.473 . . . . 21.539999999999999 110.538 174.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 618' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -60.86 -36.54 79.43 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 123.092 0.557 . . . . 34.020000000000003 110.728 -177.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 619' ' ' ALA . . . . . . . . . . . . . . . -63.7 -44.37 93.85 Favored 'General case' 0 C--O 1.244 0.803 0 O-C-N 123.388 0.43 . . . . 30.640000000000001 110.499 177.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 620' ' ' LYS . . . . . . . . . . . . . 24.5 ttmt -61.63 -45.22 94.98 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.226 -0.59 . . . . 35.789999999999999 112.55 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 621' ' ' GLU . . . . . . . . . . . . . 83.9 mt-10 -68.22 -35.46 78.0 Favored 'General case' 0 C--O 1.247 0.943 0 N-CA-C 113.281 0.845 . . . . 39.659999999999997 113.281 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 622' ' ' ALA . . . . . . . . . . . . . . . -67.01 -32.61 73.96 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 112.632 0.604 . . . . 34.380000000000003 112.632 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 623' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.272 0 C-N-CA 123.938 0.895 . . . . 35.880000000000003 111.148 -175.864 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 913' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.5 2.038 0 CA-C-O 120.715 0.293 . . . . 30.699999999999999 111.227 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 914' ' ' LEU . . . . . . . . . . . . . 19.3 mt -81.98 127.84 33.47 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.614 0.766 . . . . 25.899999999999999 112.282 -168.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 915' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -106.26 115.9 60.24 Favored Pre-proline 0 C--O 1.253 1.28 0 O-C-N 123.657 0.598 . . . . 24.82 109.906 -179.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 916' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.66 -7.14 19.63 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 121.455 1.436 . . . . 24.0 112.342 -178.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 917' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -90.45 7.18 40.09 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 114.268 1.21 . . . . 24.16 114.268 173.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 918' ' ' ALA . . . . . . . . . . . . . . . -59.28 150.41 25.93 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 113.738 1.014 . . . . 25.73 113.738 -179.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 919' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -56.27 131.42 47.98 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.579 -0.737 . . . . 34.340000000000003 109.759 174.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 920' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -65.11 145.76 55.86 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.0 -0.68 . . . . 37.170000000000002 111.037 171.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 921' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -88.69 136.32 33.06 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.361 -0.836 . . . . 27.640000000000001 111.087 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 922' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -112.45 112.27 51.73 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 115.972 -0.558 . . . . 35.560000000000002 112.204 173.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 923' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -74.82 164.96 32.47 Favored 'Trans proline' 0 C--O 1.247 0.947 0 C-N-CA 121.161 1.241 . . . . 28.09 110.314 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 924' ' ' ARG . . . . . . . . . . . . . 29.5 ttt85 -66.56 -35.25 79.77 Favored 'General case' 0 CA--C 1.514 -0.423 0 O-C-N 123.959 0.787 . . . . 40.560000000000002 109.944 175.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 925' ' ' SER . . . . . 0.532 ' H ' HE21 ' B' ' 928' ' ' GLN . 59.6 p -152.51 158.51 42.65 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 115.64 -0.709 . . . . 30.579999999999998 110.688 172.806 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 926' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -88.6 -22.03 23.71 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.765 0.654 . . . . 32.979999999999997 112.765 179.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 927' ' ' SER . . . . . . . . . . . . . 1.4 p -64.56 -14.82 59.41 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.881 -0.599 . . . . 36.289999999999999 110.259 174.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 928' ' ' GLN . . . . . 0.532 HE21 ' H ' ' B' ' 925' ' ' SER . 64.6 mt-30 . . . . . 0 CA--C 1.519 -0.24 0 N-CA-C 107.049 -1.463 . . . . 40.189999999999998 107.049 160.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 627' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 628' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 629' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_