data_6sxw_residue ############################ # Computer software used # ############################ 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 6sxw _Structure_validation_residue.Date_analyzed 2019-10-11 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 ' 676' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 CA--C 1.53 0.186 0 N-CA-C 111.967 0.358 . . . . 113.0 111.967 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 677' ' ' VAL . . . . . . . . . . . . . 83.8 t -115.16 137.21 49.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 N-CA-C 109.097 -0.705 . . . . 109.13 109.097 -173.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 678' ' ' LEU . . . . . . . . . . . . . 4.9 mt -118.11 157.41 26.94 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.157 0.503 . . . . 115.37 109.971 178.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 679' ' ' LEU . . . . . 0.453 ' O ' ' N ' ' A' ' 747' ' ' CYS . 7.5 tp -126.59 127.87 45.93 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.259 -1.015 . . . . 111.92 108.259 175.102 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 680' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -116.52 135.47 56.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 108.087 -1.079 . . . . 104.61 108.087 172.808 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 681' ' ' THR . . . . . . . . . . . . . 66.1 p -122.39 177.51 5.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.452 0.644 . . . . 105.82 109.72 -176.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 58.63 49.79 9.87 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.42 -0.809 . . . . 130.54 111.001 178.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 683' ' ' LEU . . . . . . . . . . . . . 65.5 mt -71.04 165.61 46.0 Favored Pre-proline 0 N--CA 1.451 -0.402 0 CA-C-N 115.601 -0.727 . . . . 117.6 109.753 179.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 684' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -57.98 138.15 84.5 Favored 'Trans proline' 0 C--O 1.233 0.229 0 CA-C-O 121.394 0.497 . . . . 126.06 111.498 171.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 685' ' ' GLU . . . . . 0.464 ' N ' ' O1 ' ' A' ' 801' ' ' SO4 . . . -62.05 -23.7 66.64 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.442 -0.799 . . . . 130.46 112.213 179.28 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 686' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -146.3 108.46 4.41 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.555 -1.276 . . . . 147.4 107.555 174.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 687' ' ' GLY . . . . . . . . . . . . . . . 134.44 40.38 0.17 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 121.224 -0.512 . . . . 144.23 113.936 -179.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 688' ' ' CYS . . . . . . . . . . . . . 28.2 p -122.49 117.81 26.81 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 109.145 -0.687 . . . . 144.5 109.145 177.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 689' ' ' THR . . . . . . . . . . . . . 47.5 p -129.8 167.91 17.38 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.675 -0.861 . . . . 127.88 108.675 174.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -63.28 -33.67 76.01 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.896 -0.722 . . . . 122.94 110.588 173.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 691' ' ' GLU . . . . . . . . . . . . . . . -71.96 -40.68 68.5 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.942 -0.303 . . . . 126.05 111.503 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 692' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -48.0 -58.82 3.93 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.153 0.501 . . . . 126.23 111.609 175.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 693' ' ' VAL . . . . . . . . . . . . . 66.3 t -60.45 -37.56 75.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-N 116.016 -0.538 . . . . 113.89 110.764 -175.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . . . -59.88 -52.29 66.08 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 121.962 -0.461 . . . . 116.29 110.953 178.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 695' ' ' LYS . . . . . . . . . . . . . . . -54.38 -41.77 69.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.959 0.409 . . . . 109.12 111.575 -175.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 22.5 tp -64.65 -42.68 95.26 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.942 -0.303 . . . . 108.2 111.787 -177.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 697' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -96.13 -15.81 21.9 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 114.236 1.199 . . . . 98.07 114.236 -170.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 698' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -49.42 -44.0 73.18 Favored Pre-proline 0 C--O 1.245 0.819 0 N-CA-C 113.627 0.973 . . . . 130.13 113.627 179.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.55 -9.42 3.78 Favored 'Trans proline' 0 C--N 1.35 0.651 0 CA-C-N 121.169 1.453 . . . . 96.53 114.777 179.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 700' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -97.67 -30.11 13.01 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 113.805 1.039 . . . . 98.05 113.805 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 701' ' ' GLY . . . . . . . . . . . . . . . -179.27 -172.27 43.3 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.201 -0.999 . . . . 103.59 110.892 179.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 702' ' ' LYS . . . . . . . . . . . . . . . -80.43 114.01 19.02 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.918 -0.771 . . . . 109.79 108.918 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 703' ' ' VAL . . . . . . . . . . . . . 72.3 t -99.92 122.88 52.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 107.943 -1.132 . . . . 111.73 107.943 177.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 704' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -97.76 -74.43 0.58 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.652 -0.249 . . . . 124.85 110.557 -178.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 705' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -98.93 131.78 44.75 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 122.964 0.505 . . . . 119.79 109.857 -178.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 706' ' ' VAL . . . . . . . . . . . . . 39.4 t -125.03 126.51 71.26 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 N-CA-C 107.627 -1.249 . . . . 116.89 107.627 170.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 707' ' ' LEU . . . . . . . . . . . . . 4.2 mt -116.63 129.95 56.45 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.167 0.587 . . . . 122.26 109.649 -178.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 708' ' ' ILE . . . . . . . . . . . . . 15.1 tt -122.18 130.21 74.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 109.036 -0.727 . . . . 128.75 109.036 -175.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 709' ' ' VAL . . . . . . . . . . . . . 93.3 t -126.36 112.72 23.44 Favored Pre-proline 0 C--O 1.234 0.273 0 N-CA-C 106.437 -1.69 . . . . 116.52 106.437 170.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 710' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -82.23 -13.24 10.14 Favored 'Trans proline' 0 C--O 1.239 0.574 0 CA-C-N 119.642 0.908 . . . . 121.3 114.197 -176.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 711' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -58.86 -32.02 69.08 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 118.435 0.561 . . . . 159.66 112.147 -177.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 712' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.92 5.32 18.81 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.882 0.697 . . . . 129.72 112.882 177.322 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 713' ' ' LYS . . . . . . . . . . . . . . . 57.19 56.1 5.45 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.762 0.792 . . . . 107.44 111.148 -179.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 714' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -149.86 169.07 21.98 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 108.473 -0.936 . . . . 121.12 108.473 -178.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 715' ' ' ALA . . . . . . . . . . . . . . . -155.45 162.9 40.65 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.795 -0.817 . . . . 113.13 108.795 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 716' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -126.38 118.34 24.82 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.412 -0.813 . . . . 127.74 109.411 -178.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -102.26 135.65 43.49 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.48 -0.563 . . . . 107.78 109.48 174.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 13.7 tm-20 -106.48 105.84 16.06 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.533 -1.284 . . . . 143.88 107.533 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 719' ' ' MET . . . . . . . . . . . . . 2.7 tpt -85.54 145.04 27.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.381 0.61 . . . . 132.13 110.547 -174.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 720' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -66.26 -54.43 25.02 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.343 -0.844 . . . . 132.49 111.367 -173.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -113.79 161.18 17.87 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 121.454 0.645 . . . . 126.17 109.949 -179.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 722' ' ' LYS . . . . . . . . . . . . . . . -77.48 -11.59 59.87 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.443 -0.799 . . . . 118.34 112.907 -179.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 723' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -77.47 -31.03 53.45 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 112.263 0.468 . . . . 123.07 112.263 -177.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 724' ' ' ALA . . . . . . . . . . . . . . . -63.63 -27.38 69.19 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 119.82 -0.752 . . . . 94.81 111.601 175.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 725' ' ' ILE . . . . . . . . . . . . . 47.4 mm -63.28 -52.67 55.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 121.087 0.47 . . . . 99.02 110.475 178.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 726' ' ' THR . . . . . . . . . . . . . 19.0 p -63.24 -27.74 69.56 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.225 -0.59 . . . . 109.95 111.207 178.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 727' ' ' ALA . . . . . . . . . . . . . . . -71.2 -43.37 67.52 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.893 -0.323 . . . . 106.32 111.361 177.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 728' ' ' ILE . . . . . . . . . . . . . 73.3 mt -59.58 -50.38 80.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 121.197 0.522 . . . . 97.33 109.89 174.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 729' ' ' MET . . . . . . . . . . . . . 2.0 ttp -66.01 -44.6 84.31 Favored 'General case' 0 C--O 1.237 0.42 0 O-C-N 122.164 -0.335 . . . . 107.99 111.805 -170.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -64.49 -24.86 67.76 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.332 -0.947 . . . . 118.61 111.623 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 731' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -74.72 -34.71 62.63 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.624 -0.431 . . . . 117.51 111.427 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 732' ' ' ILE . . . . . . . . . . . . . 11.0 mm -72.24 -15.59 17.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 113.074 0.768 . . . . 111.98 113.074 -175.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -71.99 -9.97 59.12 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.139 -1.024 . . . . 123.64 112.592 -179.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 30.8 p -117.76 -40.82 2.97 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 113.135 0.791 . . . . 125.41 113.135 175.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 73.3 m -133.51 128.02 19.93 Favored Pre-proline 0 C--O 1.244 0.809 0 N-CA-C 109.453 -0.573 . . . . 118.98 109.453 -176.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 736' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -74.92 140.84 26.16 Favored 'Trans proline' 0 C--N 1.331 -0.352 0 C-N-CA 120.257 0.638 . . . . 110.06 111.748 176.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 737' ' ' LEU . . . . . . . . . . . . . 20.5 mt -70.88 138.33 50.09 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.628 -0.715 . . . . 115.5 110.175 173.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 738' ' ' THR . . . . . . . . . . . . . 39.3 p -126.69 134.72 50.63 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.122 -0.49 . . . . 119.44 110.778 -176.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 17.5 tt -122.92 128.07 75.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 107.668 -1.234 . . . . 121.41 107.668 172.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp 52.36 31.86 10.2 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.049 0.452 . . . . 142.43 111.601 -172.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 741' ' ' GLY . . . . . . . . . . . . . . . 84.45 -18.92 21.61 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 115.643 1.017 . . . . 113.33 115.643 179.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 742' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -86.32 131.13 34.29 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 118.857 1.328 . . . . 117.91 109.641 177.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 59.1 p -79.53 134.7 36.5 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.503 -0.555 . . . . 133.45 109.503 175.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 744' ' ' VAL . . . . . . . . . . . . . 9.6 m -107.25 166.58 3.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.746 0.784 . . . . 104.24 109.169 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 745' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.79 128.6 55.03 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.594 -0.73 . . . . 126.97 109.894 -178.96 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 746' ' ' ILE . . . . . . . . . . . . . 53.9 mt -101.03 135.63 36.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 N-CA-C 108.981 -0.748 . . . . 112.44 108.981 -176.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 747' ' ' CYS . . . . . 0.453 ' N ' ' O ' ' A' ' 679' ' ' LEU . 73.9 m -129.53 140.53 51.21 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.239 -0.437 . . . . 121.74 110.294 -177.394 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 748' ' ' VAL . . . . . . . . . . . . . 99.2 t -103.02 150.77 38.15 Favored Pre-proline 0 C--O 1.24 0.59 0 N-CA-C 107.651 -1.24 . . . . 112.7 107.651 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 749' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo . . . . . 0 C--N 1.345 0.388 1 C-N-CA 125.927 4.418 . . . . 116.03 114.269 167.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 801' ' ' SO4 . . . . . 0.464 ' O1 ' ' N ' ' A' ' 685' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 802' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 CA--C 1.53 0.186 0 N-CA-C 111.967 0.358 . . . . 113.0 111.967 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 677' ' ' VAL . . . . . 0.478 HG22 ' HG2' ' A' ' 718' ' ' GLU . 83.8 t -115.16 137.21 49.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 N-CA-C 109.097 -0.705 . . . . 109.13 109.097 -173.696 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 678' ' ' LEU . . . . . 0.424 ' HG ' HD12 ' A' ' 725' ' ' ILE . 4.9 mt -118.11 157.41 26.94 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.157 0.503 . . . . 115.37 109.971 178.024 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 679' ' ' LEU . . . . . 0.555 HD13 ' CE2' ' A' ' 716' ' ' TYR . 7.5 tp -126.59 127.87 45.93 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.259 -1.015 . . . . 111.92 108.259 175.102 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 680' ' ' ILE . . . . . 0.533 HD11 ' HB3' ' A' ' 715' ' ' ALA . 0.2 OUTLIER -116.52 135.47 56.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 108.087 -1.079 . . . . 104.61 108.087 172.808 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 681' ' ' THR . . . . . . . . . . . . . 66.1 p -122.39 177.51 5.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.452 0.644 . . . . 105.81999999999999 109.72 -176.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 58.63 49.79 9.87 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.42 -0.809 . . . . 130.53999999999999 111.001 178.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 683' ' ' LEU . . . . . . . . . . . . . 65.5 mt -71.04 165.61 46.0 Favored Pre-proline 0 N--CA 1.451 -0.402 0 CA-C-N 115.601 -0.727 . . . . 117.59999999999999 109.753 179.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 684' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -57.98 138.15 84.5 Favored 'Trans proline' 0 C--O 1.233 0.229 0 CA-C-O 121.394 0.497 . . . . 126.06 111.498 171.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 685' ' ' GLU . . . . . . . . . . . . . . . -62.05 -23.7 66.64 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.442 -0.799 . . . . 130.46000000000001 112.213 179.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 686' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -146.3 108.46 4.41 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.555 -1.276 . . . . 147.40000000000001 107.555 174.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 687' ' ' GLY . . . . . . . . . . . . . . . 134.44 40.38 0.17 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 121.224 -0.512 . . . . 144.22999999999999 113.936 -179.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 688' ' ' CYS . . . . . . . . . . . . . 28.2 p -122.49 117.81 26.81 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 109.145 -0.687 . . . . 144.5 109.145 177.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 689' ' ' THR . . . . . . . . . . . . . 47.5 p -129.8 167.91 17.38 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.675 -0.861 . . . . 127.88 108.675 174.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -63.28 -33.67 76.01 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.896 -0.722 . . . . 122.94 110.588 173.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 691' ' ' GLU . . . . . . . . . . . . . . . -71.96 -40.68 68.5 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.942 -0.303 . . . . 126.05 111.503 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 692' ' ' ASP . . . . . 0.793 ' HB3' HD11 ' A' ' 739' ' ' ILE . 33.7 m-20 -48.0 -58.82 3.93 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.153 0.501 . . . . 126.23 111.609 175.872 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 693' ' ' VAL . . . . . . . . . . . . . 66.3 t -60.45 -37.56 75.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-N 116.016 -0.538 . . . . 113.89 110.764 -175.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 694' ' ' ARG . . . . . 0.429 ' O ' ' HG3' ' A' ' 698' ' ' GLN . . . -59.88 -52.29 66.08 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 121.962 -0.461 . . . . 116.29000000000001 110.953 178.114 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 695' ' ' LYS . . . . . . . . . . . . . . . -54.38 -41.77 69.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.959 0.409 . . . . 109.12 111.575 -175.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 696' ' ' LEU . . . . . 0.441 HD11 HD22 ' A' ' 737' ' ' LEU . 22.5 tp -64.65 -42.68 95.26 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.942 -0.303 . . . . 108.2 111.787 -177.735 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 697' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -96.13 -15.81 21.9 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 114.236 1.199 . . . . 98.069999999999993 114.236 -170.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 698' ' ' GLN . . . . . 0.429 ' HG3' ' O ' ' A' ' 694' ' ' ARG . 60.4 mt-30 -49.42 -44.0 73.18 Favored Pre-proline 0 C--O 1.245 0.819 0 N-CA-C 113.627 0.973 . . . . 130.13 113.627 179.055 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 699' ' ' PRO . . . . . 0.4 ' HD2' ' N ' ' A' ' 698' ' ' GLN . 9.4 Cg_endo -56.55 -9.42 3.78 Favored 'Trans proline' 0 C--N 1.35 0.651 0 CA-C-N 121.169 1.453 . . . . 96.530000000000001 114.777 179.561 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 700' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -97.67 -30.11 13.01 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 113.805 1.039 . . . . 98.049999999999997 113.805 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 701' ' ' GLY . . . . . . . . . . . . . . . -179.27 -172.27 43.3 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.201 -0.999 . . . . 103.59 110.892 179.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 702' ' ' LYS . . . . . . . . . . . . . . . -80.43 114.01 19.02 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.918 -0.771 . . . . 109.79000000000001 108.918 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 703' ' ' VAL . . . . . . . . . . . . . 72.3 t -99.92 122.88 52.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 107.943 -1.132 . . . . 111.73 107.943 177.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 704' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -97.76 -74.43 0.58 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.652 -0.249 . . . . 124.84999999999999 110.557 -178.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 705' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -98.93 131.78 44.75 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 122.964 0.505 . . . . 119.79000000000001 109.857 -178.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 706' ' ' VAL . . . . . . . . . . . . . 39.4 t -125.03 126.51 71.26 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 N-CA-C 107.627 -1.249 . . . . 116.89 107.627 170.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 707' ' ' LEU . . . . . 0.41 HD23 ' HA ' ' A' ' 707' ' ' LEU . 4.2 mt -116.63 129.95 56.45 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.167 0.587 . . . . 122.26000000000001 109.649 -178.825 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 708' ' ' ILE . . . . . . . . . . . . . 15.1 tt -122.18 130.21 74.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 109.036 -0.727 . . . . 128.75 109.036 -175.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 709' ' ' VAL . . . . . . . . . . . . . 93.3 t -126.36 112.72 23.44 Favored Pre-proline 0 C--O 1.234 0.273 0 N-CA-C 106.437 -1.69 . . . . 116.52 106.437 170.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 710' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -82.23 -13.24 10.14 Favored 'Trans proline' 0 C--O 1.239 0.574 0 CA-C-N 119.642 0.908 . . . . 121.3 114.197 -176.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 711' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -58.86 -32.02 69.08 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 118.435 0.561 . . . . 159.66 112.147 -177.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 712' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.92 5.32 18.81 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.882 0.697 . . . . 129.72 112.882 177.322 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 713' ' ' LYS . . . . . . . . . . . . . . . 57.19 56.1 5.45 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.762 0.792 . . . . 107.44 111.148 -179.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 714' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -149.86 169.07 21.98 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 108.473 -0.936 . . . . 121.12 108.473 -178.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 715' ' ' ALA . . . . . 0.533 ' HB3' HD11 ' A' ' 680' ' ' ILE . . . -155.45 162.9 40.65 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.795 -0.817 . . . . 113.13 108.795 179.011 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 716' ' ' TYR . . . . . 0.555 ' CE2' HD13 ' A' ' 679' ' ' LEU . 34.4 m-85 -126.38 118.34 24.82 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.412 -0.813 . . . . 127.73999999999999 109.411 -178.486 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -102.26 135.65 43.49 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.48 -0.563 . . . . 107.78 109.48 174.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 718' ' ' GLU . . . . . 0.478 ' HG2' HG22 ' A' ' 677' ' ' VAL . 13.7 tm-20 -106.48 105.84 16.06 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.533 -1.284 . . . . 143.88 107.533 179.387 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 719' ' ' MET . . . . . 0.405 ' HG2' ' HB3' ' A' ' 724' ' ' ALA . 2.7 tpt -85.54 145.04 27.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.381 0.61 . . . . 132.13 110.547 -174.848 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 720' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -66.26 -54.43 25.02 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.343 -0.844 . . . . 132.49000000000001 111.367 -173.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -113.79 161.18 17.87 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 121.454 0.645 . . . . 126.17 109.949 -179.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 722' ' ' LYS . . . . . . . . . . . . . . . -77.48 -11.59 59.87 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.443 -0.799 . . . . 118.34 112.907 -179.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 723' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -77.47 -31.03 53.45 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 112.263 0.468 . . . . 123.06999999999999 112.263 -177.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 724' ' ' ALA . . . . . 0.48 ' O ' HG13 ' A' ' 728' ' ' ILE . . . -63.63 -27.38 69.19 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 119.82 -0.752 . . . . 94.810000000000002 111.601 175.076 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 725' ' ' ILE . . . . . 0.424 HD12 ' HG ' ' A' ' 678' ' ' LEU . 47.4 mm -63.28 -52.67 55.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 121.087 0.47 . . . . 99.019999999999996 110.475 178.19 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 726' ' ' THR . . . . . . . . . . . . . 19.0 p -63.24 -27.74 69.56 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.225 -0.59 . . . . 109.95 111.207 178.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 727' ' ' ALA . . . . . . . . . . . . . . . -71.2 -43.37 67.52 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.893 -0.323 . . . . 106.31999999999999 111.361 177.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 728' ' ' ILE . . . . . 0.583 ' O ' HG12 ' A' ' 732' ' ' ILE . 73.3 mt -59.58 -50.38 80.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 121.197 0.522 . . . . 97.329999999999998 109.89 174.618 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 729' ' ' MET . . . . . . . . . . . . . 2.0 ttp -66.01 -44.6 84.31 Favored 'General case' 0 C--O 1.237 0.42 0 O-C-N 122.164 -0.335 . . . . 107.98999999999999 111.805 -170.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -64.49 -24.86 67.76 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.332 -0.947 . . . . 118.61 111.623 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 731' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -74.72 -34.71 62.63 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.624 -0.431 . . . . 117.51000000000001 111.427 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 732' ' ' ILE . . . . . 0.583 HG12 ' O ' ' A' ' 728' ' ' ILE . 11.0 mm -72.24 -15.59 17.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 113.074 0.768 . . . . 111.98 113.074 -175.73 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 733' ' ' GLU . . . . . 0.428 ' HG3' HG23 ' A' ' 734' ' ' THR . 3.3 pt-20 -71.99 -9.97 59.12 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.139 -1.024 . . . . 123.64 112.592 -179.4 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 734' ' ' THR . . . . . 0.428 HG23 ' HG3' ' A' ' 733' ' ' GLU . 30.8 p -117.76 -40.82 2.97 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 113.135 0.791 . . . . 125.41 113.135 175.363 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 73.3 m -133.51 128.02 19.93 Favored Pre-proline 0 C--O 1.244 0.809 0 N-CA-C 109.453 -0.573 . . . . 118.98 109.453 -176.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 736' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -74.92 140.84 26.16 Favored 'Trans proline' 0 C--N 1.331 -0.352 0 C-N-CA 120.257 0.638 . . . . 110.06 111.748 176.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 737' ' ' LEU . . . . . 0.441 HD22 HD11 ' A' ' 696' ' ' LEU . 20.5 mt -70.88 138.33 50.09 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.628 -0.715 . . . . 115.5 110.175 173.805 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 738' ' ' THR . . . . . . . . . . . . . 39.3 p -126.69 134.72 50.63 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.122 -0.49 . . . . 119.44 110.778 -176.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 739' ' ' ILE . . . . . 0.793 HD11 ' HB3' ' A' ' 692' ' ' ASP . 17.5 tt -122.92 128.07 75.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 107.668 -1.234 . . . . 121.41 107.668 172.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp 52.36 31.86 10.2 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.049 0.452 . . . . 142.43000000000001 111.601 -172.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 741' ' ' GLY . . . . . . . . . . . . . . . 84.45 -18.92 21.61 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 115.643 1.017 . . . . 113.33 115.643 179.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 742' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -86.32 131.13 34.29 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 118.857 1.328 . . . . 117.91 109.641 177.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 59.1 p -79.53 134.7 36.5 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.503 -0.555 . . . . 133.44999999999999 109.503 175.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 744' ' ' VAL . . . . . . . . . . . . . 9.6 m -107.25 166.58 3.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.746 0.784 . . . . 104.23999999999999 109.169 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 745' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.79 128.6 55.03 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.594 -0.73 . . . . 126.97 109.894 -178.96 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 746' ' ' ILE . . . . . . . . . . . . . 53.9 mt -101.03 135.63 36.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 N-CA-C 108.981 -0.748 . . . . 112.44 108.981 -176.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 747' ' ' CYS . . . . . . . . . . . . . 73.9 m -129.53 140.53 51.21 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.239 -0.437 . . . . 121.73999999999999 110.294 -177.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 748' ' ' VAL . . . . . . . . . . . . . 99.2 t -103.02 150.77 38.15 Favored Pre-proline 0 C--O 1.24 0.59 0 N-CA-C 107.651 -1.24 . . . . 112.7 107.651 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 749' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo . . . . . 0 C--N 1.345 0.388 1 C-N-CA 125.927 4.418 . . . . 116.03 114.269 167.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 801' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 802' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 CA--C 1.53 0.186 0 N-CA-C 111.967 0.358 . . . . 113.0 111.967 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 677' ' ' VAL . . . . . 0.478 HG22 ' HG2' ' A' ' 718' ' ' GLU . 83.8 t -115.16 137.21 49.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 N-CA-C 109.097 -0.705 . . . . 109.13 109.097 -173.696 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.424 ' HG ' HD12 ' A' ' 725' ' ' ILE . 4.9 mt -118.11 157.41 26.94 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.157 0.503 . . . . 115.37 109.971 178.024 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 679' ' ' LEU . . . . . 0.555 HD13 ' CE2' ' A' ' 716' ' ' TYR . 7.5 tp -126.59 127.87 45.93 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.259 -1.015 . . . . 111.92 108.259 175.102 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 680' ' ' ILE . . . . . 0.533 HD11 ' HB3' ' A' ' 715' ' ' ALA . 0.2 OUTLIER -116.52 135.47 56.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 108.087 -1.079 . . . . 104.61 108.087 172.808 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 681' ' ' THR . . . . . . . . . . . . . 66.1 p -122.39 177.51 5.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.452 0.644 . . . . 105.82 109.72 -176.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 58.63 49.79 9.87 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.42 -0.809 . . . . 130.54 111.001 178.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 683' ' ' LEU . . . . . . . . . . . . . 65.5 mt -71.04 165.61 46.0 Favored Pre-proline 0 N--CA 1.451 -0.402 0 CA-C-N 115.601 -0.727 . . . . 117.6 109.753 179.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 684' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -57.98 138.15 84.5 Favored 'Trans proline' 0 C--O 1.233 0.229 0 CA-C-O 121.394 0.497 . . . . 126.06 111.498 171.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 685' ' ' GLU . . . . . . . . . . . . . . . -62.05 -23.7 66.64 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.442 -0.799 . . . . 130.46 112.213 179.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 686' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -146.3 108.46 4.41 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.555 -1.276 . . . . 147.4 107.555 174.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 687' ' ' GLY . . . . . . . . . . . . . . . 134.44 40.38 0.17 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 121.224 -0.512 . . . . 144.23 113.936 -179.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 688' ' ' CYS . . . . . . . . . . . . . 28.2 p -122.49 117.81 26.81 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 109.145 -0.687 . . . . 144.5 109.145 177.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 689' ' ' THR . . . . . . . . . . . . . 47.5 p -129.8 167.91 17.38 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.675 -0.861 . . . . 127.88 108.675 174.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -63.28 -33.67 76.01 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.896 -0.722 . . . . 122.94 110.588 173.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 691' ' ' GLU . . . . . . . . . . . . . . . -71.96 -40.68 68.5 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.942 -0.303 . . . . 126.05 111.503 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 692' ' ' ASP . . . . . 0.793 ' HB3' HD11 ' A' ' 739' ' ' ILE . 33.7 m-20 -48.0 -58.82 3.93 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.153 0.501 . . . . 126.23 111.609 175.872 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 693' ' ' VAL . . . . . . . . . . . . . 66.3 t -60.45 -37.56 75.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-N 116.016 -0.538 . . . . 113.89 110.764 -175.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 694' ' ' ARG . . . . . 0.429 ' O ' ' HG3' ' A' ' 698' ' ' GLN . . . -59.88 -52.29 66.08 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 121.962 -0.461 . . . . 116.29 110.953 178.114 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 695' ' ' LYS . . . . . . . . . . . . . . . -54.38 -41.77 69.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.959 0.409 . . . . 109.12 111.575 -175.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.441 HD11 HD22 ' A' ' 737' ' ' LEU . 22.5 tp -64.65 -42.68 95.26 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.942 -0.303 . . . . 108.2 111.787 -177.735 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 697' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -96.13 -15.81 21.9 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 114.236 1.199 . . . . 98.07 114.236 -170.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 698' ' ' GLN . . . . . 0.429 ' HG3' ' O ' ' A' ' 694' ' ' ARG . 60.4 mt-30 -49.42 -44.0 73.18 Favored Pre-proline 0 C--O 1.245 0.819 0 N-CA-C 113.627 0.973 . . . . 130.13 113.627 179.055 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 699' ' ' PRO . . . . . 0.4 ' HD2' ' N ' ' A' ' 698' ' ' GLN . 9.4 Cg_endo -56.55 -9.42 3.78 Favored 'Trans proline' 0 C--N 1.35 0.651 0 CA-C-N 121.169 1.453 . . . . 96.53 114.777 179.561 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 700' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -97.67 -30.11 13.01 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 113.805 1.039 . . . . 98.05 113.805 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 701' ' ' GLY . . . . . . . . . . . . . . . -179.27 -172.27 43.3 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.201 -0.999 . . . . 103.59 110.892 179.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 702' ' ' LYS . . . . . . . . . . . . . . . -80.43 114.01 19.02 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.918 -0.771 . . . . 109.79 108.918 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 703' ' ' VAL . . . . . . . . . . . . . 72.3 t -99.92 122.88 52.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 107.943 -1.132 . . . . 111.73 107.943 177.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 704' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -97.76 -74.43 0.58 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.652 -0.249 . . . . 124.85 110.557 -178.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 705' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -98.93 131.78 44.75 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 122.964 0.505 . . . . 119.79 109.857 -178.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 706' ' ' VAL . . . . . . . . . . . . . 39.4 t -125.03 126.51 71.26 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 N-CA-C 107.627 -1.249 . . . . 116.89 107.627 170.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 707' ' ' LEU . . . . . 0.41 HD23 ' HA ' ' A' ' 707' ' ' LEU . 4.2 mt -116.63 129.95 56.45 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 123.167 0.587 . . . . 122.26 109.649 -178.825 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 708' ' ' ILE . . . . . . . . . . . . . 15.1 tt -122.18 130.21 74.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 109.036 -0.727 . . . . 128.75 109.036 -175.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 709' ' ' VAL . . . . . . . . . . . . . 93.3 t -126.36 112.72 23.44 Favored Pre-proline 0 C--O 1.234 0.273 0 N-CA-C 106.437 -1.69 . . . . 116.52 106.437 170.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 710' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -82.23 -13.24 10.14 Favored 'Trans proline' 0 C--O 1.239 0.574 0 CA-C-N 119.642 0.908 . . . . 121.3 114.197 -176.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 711' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -58.86 -32.02 69.08 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 118.435 0.561 . . . . 159.66 112.147 -177.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 712' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.92 5.32 18.81 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.882 0.697 . . . . 129.72 112.882 177.322 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 713' ' ' LYS . . . . . . . . . . . . . . . 57.19 56.1 5.45 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.762 0.792 . . . . 107.44 111.148 -179.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 714' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -149.86 169.07 21.98 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 108.473 -0.936 . . . . 121.12 108.473 -178.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 715' ' ' ALA . . . . . 0.533 ' HB3' HD11 ' A' ' 680' ' ' ILE . . . -155.45 162.9 40.65 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.795 -0.817 . . . . 113.13 108.795 179.011 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 716' ' ' TYR . . . . . 0.555 ' CE2' HD13 ' A' ' 679' ' ' LEU . 34.4 m-85 -126.38 118.34 24.82 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.412 -0.813 . . . . 127.74 109.411 -178.486 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -102.26 135.65 43.49 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.48 -0.563 . . . . 107.78 109.48 174.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.478 ' HG2' HG22 ' A' ' 677' ' ' VAL . 13.7 tm-20 -106.48 105.84 16.06 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.533 -1.284 . . . . 143.88 107.533 179.387 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 719' ' ' MET . . . . . 0.405 ' HG2' ' HB3' ' A' ' 724' ' ' ALA . 2.7 tpt -85.54 145.04 27.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.381 0.61 . . . . 132.13 110.547 -174.848 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 720' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -66.26 -54.43 25.02 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.343 -0.844 . . . . 132.49 111.367 -173.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -113.79 161.18 17.87 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 121.454 0.645 . . . . 126.17 109.949 -179.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 722' ' ' LYS . . . . . . . . . . . . . . . -77.48 -11.59 59.87 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.443 -0.799 . . . . 118.34 112.907 -179.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 723' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -77.47 -31.03 53.45 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 112.263 0.468 . . . . 123.07 112.263 -177.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 724' ' ' ALA . . . . . 0.48 ' O ' HG13 ' A' ' 728' ' ' ILE . . . -63.63 -27.38 69.19 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 119.82 -0.752 . . . . 94.81 111.601 175.076 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 725' ' ' ILE . . . . . 0.424 HD12 ' HG ' ' A' ' 678' ' ' LEU . 47.4 mm -63.28 -52.67 55.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 121.087 0.47 . . . . 99.02 110.475 178.19 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 726' ' ' THR . . . . . . . . . . . . . 19.0 p -63.24 -27.74 69.56 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.225 -0.59 . . . . 109.95 111.207 178.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 727' ' ' ALA . . . . . . . . . . . . . . . -71.2 -43.37 67.52 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.893 -0.323 . . . . 106.32 111.361 177.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 728' ' ' ILE . . . . . 0.583 ' O ' HG12 ' A' ' 732' ' ' ILE . 73.3 mt -59.58 -50.38 80.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 121.197 0.522 . . . . 97.33 109.89 174.618 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 729' ' ' MET . . . . . . . . . . . . . 2.0 ttp -66.01 -44.6 84.31 Favored 'General case' 0 C--O 1.237 0.42 0 O-C-N 122.164 -0.335 . . . . 107.99 111.805 -170.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -64.49 -24.86 67.76 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.332 -0.947 . . . . 118.61 111.623 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 731' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -74.72 -34.71 62.63 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.624 -0.431 . . . . 117.51 111.427 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 732' ' ' ILE . . . . . 0.583 HG12 ' O ' ' A' ' 728' ' ' ILE . 11.0 mm -72.24 -15.59 17.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 113.074 0.768 . . . . 111.98 113.074 -175.73 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 733' ' ' GLU . . . . . 0.428 ' HG3' HG23 ' A' ' 734' ' ' THR . 3.3 pt-20 -71.99 -9.97 59.12 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.139 -1.024 . . . . 123.64 112.592 -179.4 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 734' ' ' THR . . . . . 0.428 HG23 ' HG3' ' A' ' 733' ' ' GLU . 30.8 p -117.76 -40.82 2.97 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 113.135 0.791 . . . . 125.41 113.135 175.363 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 73.3 m -133.51 128.02 19.93 Favored Pre-proline 0 C--O 1.244 0.809 0 N-CA-C 109.453 -0.573 . . . . 118.98 109.453 -176.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 736' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -74.92 140.84 26.16 Favored 'Trans proline' 0 C--N 1.331 -0.352 0 C-N-CA 120.257 0.638 . . . . 110.06 111.748 176.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 737' ' ' LEU . . . . . 0.441 HD22 HD11 ' A' ' 696' ' ' LEU . 20.5 mt -70.88 138.33 50.09 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.628 -0.715 . . . . 115.5 110.175 173.805 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 738' ' ' THR . . . . . . . . . . . . . 39.3 p -126.69 134.72 50.63 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.122 -0.49 . . . . 119.44 110.778 -176.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 739' ' ' ILE . . . . . 0.793 HD11 ' HB3' ' A' ' 692' ' ' ASP . 17.5 tt -122.92 128.07 75.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 107.668 -1.234 . . . . 121.41 107.668 172.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp 52.36 31.86 10.2 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.049 0.452 . . . . 142.43 111.601 -172.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 741' ' ' GLY . . . . . . . . . . . . . . . 84.45 -18.92 21.61 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 115.643 1.017 . . . . 113.33 115.643 179.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 742' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -86.32 131.13 34.29 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 118.857 1.328 . . . . 117.91 109.641 177.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 59.1 p -79.53 134.7 36.5 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.503 -0.555 . . . . 133.45 109.503 175.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 744' ' ' VAL . . . . . . . . . . . . . 9.6 m -107.25 166.58 3.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.746 0.784 . . . . 104.24 109.169 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 745' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.79 128.6 55.03 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.594 -0.73 . . . . 126.97 109.894 -178.96 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 746' ' ' ILE . . . . . . . . . . . . . 53.9 mt -101.03 135.63 36.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 N-CA-C 108.981 -0.748 . . . . 112.44 108.981 -176.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 747' ' ' CYS . . . . . . . . . . . . . 73.9 m -129.53 140.53 51.21 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.239 -0.437 . . . . 121.74 110.294 -177.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 748' ' ' VAL . . . . . . . . . . . . . 99.2 t -103.02 150.77 38.15 Favored Pre-proline 0 C--O 1.24 0.59 0 N-CA-C 107.651 -1.24 . . . . 112.7 107.651 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 749' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo . . . . . 0 C--N 1.345 0.388 1 C-N-CA 125.927 4.418 . . . . 116.03 114.269 167.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 801' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 802' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_