data_6h3x_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 6h3x _Structure_validation_residue.Date_analyzed 2019-02-22 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 ' 482' ' ' ASP . . . . . . . . . . . . . 39.7 t0 . . . . . 0 C--O 1.232 0.135 0 N-CA-C 110.005 -0.369 . . . . 135.89 110.005 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 483' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -63.53 141.29 58.82 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.241 0.543 . . . . 138.63 110.822 -174.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 484' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -64.98 140.97 58.92 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.745 -0.661 . . . . 90.0 110.328 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 485' ' ' CYS . . . . . . . . . . . . . 22.9 m -62.22 -26.24 68.26 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.951 -0.568 . . . . 83.84 111.925 -179.192 -79.775 -121.448 -87.113 104.619 2.036 102.292 -53.226 -43.502 1 1 . 1 . 001 ecloud orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 96.0 mt -78.95 -13.35 59.85 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.611 0.597 . . . . 68.84 112.611 176.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 29.6 t -81.95 -28.18 32.88 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.18 0.437 . . . . 111.75 112.18 -177.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -87.87 -176.89 5.65 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 122.33 1.062 . . . . 132.5 112.263 -163.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 489' ' ' ASP . . . . . 0.634 ' OD1' ' N ' ' A' ' 489' ' ' ASP . 1.0 OUTLIER -85.58 -177.66 6.47 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 114.868 -1.06 . . . . 166.57 112.103 -158.005 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 5.1 tt -76.57 -39.57 32.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-N 115.144 -0.934 . . . . 151.09 110.81 -174.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 491' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -86.58 102.72 14.41 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.305 -0.998 . . . . 157.45 108.305 -178.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 492' ' ' ILE . . . . . . . . . . . . . 44.6 mm -122.63 130.15 74.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 108.395 -0.965 . . . . 126.27 108.395 -176.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 493' ' ' THR . . . . . . . . . . . . . 27.3 p -73.72 155.55 38.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.388 0.613 . . . . 109.38 110.31 176.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 494' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -58.64 -28.67 65.9 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 119.844 -0.742 . . . . 111.02 111.167 171.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 66.5 tt0 -70.03 -43.8 70.55 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.758 -0.377 . . . . 116.66 111.413 -179.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -61.6 -33.32 73.71 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 120.714 -0.395 . . . . 117.6 111.611 176.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 45.6 mt -60.22 -16.86 37.16 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 112.682 0.623 . . . . 77.77 112.682 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 20.2 m170 -59.87 -26.31 65.76 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.378 -0.529 . . . . 79.04 111.832 175.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 499' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -74.74 -13.2 60.57 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.564 -0.854 . . . . 98.79 112.82 177.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 500' ' ' CYS . . . . . . . . . . . . . 7.4 m -104.88 -2.71 24.32 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 113.411 0.893 . . . . 65.74 113.411 -170.009 -43.502 -53.226 -87.113 102.292 2.036 104.619 -121.448 -79.775 1 1 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' ILE . . . . . . . . . . . . . 10.8 pt -69.25 152.17 9.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.605 0 CA-C-O 121.822 0.82 . . . . 57.52 110.425 -175.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' GLY . . . . . 0.432 ' N ' ' OE2' ' A' ' 559' ' ' GLU . . . -45.74 -53.79 8.33 Favored Glycine 0 N--CA 1.443 -0.861 0 N-CA-C 116.119 1.208 . . . . 55.53 116.119 -179.858 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 503' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -53.4 -31.75 59.07 Favored 'Trans proline' 0 N--CA 1.477 0.521 0 CA-C-N 118.099 0.95 . . . . 54.41 113.515 -179.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -82.59 -42.4 18.31 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 112.462 0.542 . . . . 99.53 112.462 -176.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 505' ' ' ILE . . . . . . . . . . . . . 3.8 pt -81.79 -16.05 12.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 O-C-N 121.688 -0.633 . . . . 68.78 112.175 -176.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 22.3 ttp -77.67 144.31 37.45 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.111 0.482 . . . . 70.64 110.88 -174.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -110.67 -138.25 7.75 Favored Glycine 0 N--CA 1.45 -0.395 0 CA-C-N 115.995 -0.548 . . . . 71.41 112.445 176.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -107.94 3.15 23.87 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.567 0.58 . . . . 96.9 112.567 177.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 28.9 p -124.32 158.32 32.89 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.386 0.675 . . . . 60.05 109.638 -174.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' CYS . . . . . . . . . . . . . 5.9 p -129.75 98.4 4.8 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 106.618 -1.623 . . . . 79.58 106.618 172.035 47.847 146.184 89.485 104.474 2.037 104.711 -63.732 -63.655 1 1 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 34.0 m -82.13 166.97 2.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.659 -0.867 . . . . 57.0 108.659 -179.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' SER . . . . . . . . . . . . . 58.9 p -68.66 160.46 30.15 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 119.386 -0.926 . . . . 60.61 109.694 173.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -65.63 -35.18 80.04 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 119.284 -0.966 . . . . 66.49 111.434 177.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -67.15 -37.04 83.12 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 119.438 -0.905 . . . . 90.39 111.184 177.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 515' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -67.61 -40.89 84.71 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 119.838 -0.745 . . . . 92.95 111.422 176.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 58.3 tp -63.23 -39.55 94.95 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 119.475 -0.89 . . . . 50.63 110.379 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -62.96 -44.74 95.21 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.154 -0.619 . . . . 52.52 111.236 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 58.0 m -64.84 -38.35 90.67 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 119.188 -1.005 . . . . 63.62 111.03 177.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -62.95 -54.23 41.76 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 120.73 0.3 . . . . 78.24 111.513 -179.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 520' ' ' LEU . . . . . . . . . . . . . 94.6 mt -66.15 -34.41 77.98 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 122.101 -0.375 . . . . 52.45 111.304 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -62.84 -46.72 86.61 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.779 -0.368 . . . . 62.68 110.501 178.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' SER . . . . . . . . . . . . . 79.3 p -65.37 -16.14 63.29 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 112.634 0.605 . . . . 65.17 112.634 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 523' ' ' LYS . . . . . . . . . . . . . 83.6 mttt -96.17 8.45 43.81 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 112.639 0.607 . . . . 69.26 112.639 174.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 524' ' ' ASN . . . . . . . . . . . . . 56.2 t30 57.33 37.58 28.14 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.453 0.701 . . . . 78.18 111.955 -177.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 525' ' ' LEU . . . . . . . . . . . . . 92.8 mt -107.21 -20.79 13.18 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 113.237 0.829 . . . . 61.35 113.237 178.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 526' ' ' VAL . . . . . . . . . . . . . 34.7 m -131.94 163.42 37.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 107.401 -1.333 . . . . 57.64 107.401 170.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 17.5 p -125.35 -178.88 4.37 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.648 -0.871 . . . . 64.51 108.648 178.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 528' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -65.84 -29.85 70.38 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.541 -0.863 . . . . 105.33 111.629 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -62.06 -17.96 59.13 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.459 0.54 . . . . 85.83 112.459 174.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -89.79 -7.6 54.03 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 113.109 0.781 . . . . 64.29 113.109 177.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 531' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -61.45 -31.9 71.87 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 119.384 -0.927 . . . . 92.67 111.918 -169.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 532' ' ' LYS . . . . . . . . . . . . . 23.4 pttm -57.95 -29.73 65.42 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.602 -0.439 . . . . 90.76 112.079 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 533' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -72.36 -7.42 49.51 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 113.055 0.761 . . . . 84.43 113.055 -179.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 534' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -101.93 10.91 39.33 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 112.968 0.729 . . . . 66.32 112.968 -177.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -77.64 153.84 81.12 Favored Pre-proline 0 C--N 1.317 -0.818 0 CA-C-N 118.133 0.424 . . . . 106.12 110.593 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 536' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -61.18 150.18 85.73 Favored 'Trans proline' 0 CA--C 1.519 -0.231 0 CA-C-O 121.697 0.624 . . . . 85.45 111.558 -177.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -168.54 150.25 4.95 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 107.534 -1.284 . . . . 102.36 107.534 -179.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 22.1 p -63.74 159.68 18.75 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.96 0.886 . . . . 89.54 110.303 175.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 8.2 t -69.42 -34.71 63.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 115.119 -0.946 . . . . 82.78 111.041 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -67.63 -39.8 84.64 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.001 -0.68 . . . . 109.81 111.084 178.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 541' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -67.12 -33.86 76.36 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.093 -0.643 . . . . 93.49 111.996 176.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -64.07 -43.78 94.41 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 119.952 -0.699 . . . . 56.88 110.74 171.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -51.36 -50.33 59.74 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.861 0.362 . . . . 63.05 111.064 173.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 544' ' ' ASN . . . . . . . . . . . . . 90.3 m-20 -67.81 -38.56 83.42 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.956 -0.698 . . . . 76.25 111.45 -176.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 545' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.59 -34.75 77.62 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.613 -0.835 . . . . 93.64 111.099 178.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 92.2 mt -72.6 -49.15 43.09 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 120.415 -0.514 . . . . 70.39 110.71 175.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -75.14 -7.73 54.6 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 113.05 0.759 . . . . 83.59 113.05 -169.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 548' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -114.15 4.75 15.69 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.379 0.536 . . . . 92.12 111.98 173.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.8 135.46 54.9 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.197 0.523 . . . . 93.71 110.961 -176.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 550' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -105.37 -0.54 26.05 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.867 -0.606 . . . . 133.66 112.557 178.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -116.78 131.9 56.83 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.368 -0.975 . . . . 106.0 108.368 176.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -69.07 -41.28 77.77 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.248 -0.581 . . . . 78.02 111.53 -176.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -61.94 -39.47 92.18 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 120.231 -0.587 . . . . 87.84 110.98 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 554' ' ' ARG . . . . . . . . . . . . . 65.6 ttt-85 -64.31 -44.66 90.9 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.728 0.299 . . . . 111.22 111.117 177.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 555' ' ' MET . . . . . . . . . . . . . 22.1 ttp -59.81 -44.38 94.04 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.02 0.438 . . . . 86.48 111.062 178.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 74.4 mt -61.91 -45.72 98.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 121.185 0.517 . . . . 67.44 110.772 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 40.9 tp -65.58 -43.64 89.14 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 119.636 -0.826 . . . . 52.86 111.349 -177.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 558' ' ' LEU . . . . . . . . . . . . . 94.7 mt -67.95 -36.49 80.19 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 120.242 -0.583 . . . . 57.13 111.293 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 559' ' ' GLU . . . . . 0.432 ' OE2' ' N ' ' A' ' 502' ' ' GLY . 11.1 tp10 -61.65 -46.7 88.64 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.07 0.462 . . . . 52.7 110.858 172.798 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 560' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -57.32 -47.45 81.51 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.083 0.468 . . . . 58.15 111.109 178.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 561' ' ' ILE . . . . . . . . . . . . . 93.2 mt -61.03 -48.68 87.97 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 CA-C-O 121.138 0.494 . . . . 45.8 110.429 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 562' ' ' LEU . . . . . . . . . . . . . 14.0 tp -57.7 -52.12 66.74 Favored 'General case' 0 C--O 1.235 0.337 0 O-C-N 122.237 -0.289 . . . . 57.22 111.566 -177.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 46.6 m-85 -82.34 -12.36 58.01 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.564 0.95 . . . . 60.13 113.564 -173.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 564' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -91.02 -22.25 20.87 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 118.884 0.766 . . . . 81.5 113.045 172.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 565' ' ' THR . . . . . . . . . . . . . 59.6 p -116.87 -15.53 10.65 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 114.98 1.474 . . . . 51.45 114.98 -172.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -96.2 107.56 19.91 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 119.826 1.194 . . . . 60.79 109.077 -176.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 76.8 m -61.03 -35.86 78.02 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.647 -0.706 . . . . 59.0 112.464 -167.728 -63.655 -63.732 89.485 104.711 2.037 104.474 146.184 47.847 1 1 . 1 . 001 ecloud orig full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -61.0 -30.86 70.54 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 118.858 -1.137 . . . . 99.95 111.766 -176.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 569' ' ' MET . . . . . . . . . . . . . 39.9 mmm -60.5 -25.56 66.18 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 119.445 -0.902 . . . . 66.52 111.816 -179.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 570' ' ' LEU . . . . . . . . . . . . . 48.9 mt -58.75 -25.92 63.47 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 120.085 -0.646 . . . . 63.97 111.952 179.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 571' ' ' SER . . . . . . . . . . . . . 20.9 m -59.42 -23.92 63.05 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.465 -0.494 . . . . 71.75 112.26 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 572' ' ' LEU . . . . . . . . . . . . . 82.5 mt -64.32 -19.29 65.34 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.858 -0.737 . . . . 67.01 112.456 -179.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 573' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -82.99 1.6 39.04 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.571 -0.852 . . . . 76.65 112.993 174.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 574' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -129.94 -164.59 1.43 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-O 122.068 0.937 . . . . 73.6 108.622 -175.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -102.62 -33.33 9.49 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.756 1.021 . . . . 89.52 113.756 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 576' ' ' SER . . . . . 0.521 ' N ' ' O4 ' ' A' ' 803' ' ' SO4 . 74.4 m -104.2 -176.61 3.13 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.949 0.88 . . . . 97.5 109.789 -172.582 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 577' ' ' GLY . . . . . . . . . . . . . . . 110.33 150.18 12.54 Favored Glycine 0 N--CA 1.44 -1.092 0 N-CA-C 111.056 -0.817 . . . . 88.3 111.056 -177.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 578' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -60.35 -33.19 94.58 Favored 'Trans proline' 0 C--O 1.238 0.507 0 N-CA-C 113.422 0.508 . . . . 104.6 113.422 179.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -67.06 -32.54 73.79 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.344 -0.542 . . . . 107.98 111.47 179.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 580' ' ' ASN . . . . . . . . . . . . . 27.5 m-20 -74.83 -41.72 59.37 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 120.834 -0.346 . . . . 86.0 111.263 176.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 581' ' ' VAL . . . . . . . . . . . . . 95.1 t -62.84 -25.85 39.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 C-N-CA 120.986 -0.285 . . . . 97.48 110.642 176.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -58.33 -71.64 0.11 Allowed 'General case' 0 C--O 1.238 0.461 0 O-C-N 121.772 -0.58 . . . . 88.91 111.101 177.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 583' ' ' TRP . . . . . . . . . . . . . 57.8 p-90 -64.45 -28.48 69.7 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 120.084 -0.646 . . . . 89.1 111.603 -179.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 584' ' ' ARG . . . . . 0.498 ' NH1' ' OE1' ' A' ' 686' ' ' GLN . 44.6 ttm-85 -63.58 -48.63 76.61 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 121.084 0.469 . . . . 108.42 111.118 -179.444 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 585' ' ' THR . . . . . . . . . . . . . 58.2 p -72.32 -34.15 67.88 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 122.226 -0.297 . . . . 113.98 111.429 177.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 586' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -59.86 -37.04 78.15 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 119.34 -0.944 . . . . 111.45 110.942 175.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 587' ' ' LEU . . . . . . . . . . . . . 32.1 tp -77.35 -48.68 16.7 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.938 -0.305 . . . . 91.21 111.588 -177.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 588' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -63.43 -30.6 71.7 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 119.202 -0.999 . . . . 97.79 111.449 178.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 589' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -58.26 -72.78 0.09 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.028 0.931 . . . . 121.61 111.002 -172.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 590' ' ' HIS . . . . . 0.668 ' O ' ' ND1' ' A' ' 590' ' ' HIS . 13.7 p80 -91.85 94.53 9.36 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 106.243 -1.762 . . . . 125.8 106.243 167.531 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 35.4 t30 -70.81 -175.56 1.13 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 122.037 0.922 . . . . 112.4 109.537 -170.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 592' ' ' ILE . . . . . . . . . . . . . 33.5 pt -96.05 148.19 5.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 N-CA-C 108.414 -0.958 . . . . 80.29 108.414 174.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -64.47 -26.09 68.29 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.698 -0.683 . . . . 103.44 111.95 -174.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 49.7 tp -55.31 -33.78 63.6 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.164 -0.614 . . . . 69.17 111.632 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 595' ' ' CYS . . . . . . . . . . . . . 78.4 m -83.52 -12.88 55.68 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.604 0.965 . . . . 73.07 113.604 -171.632 -63.802 -49.353 -94.116 101.314 2.03 102.248 -62.373 -63.302 1 1 . 1 . 001 ecloud orig full ' A' A ' 596' ' ' SER . . . . . . . . . . . . . 91.5 p -70.27 -45.44 66.37 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 118.798 0.727 . . . . 97.82 111.162 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 597' ' ' ARG . . . . . . . . . . . . . 60.3 mtm-85 -96.55 -11.46 25.38 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 113.341 0.867 . . . . 116.37 113.341 179.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 598' ' ' HIS . . . . . . . . . . . . . 61.5 m80 -138.06 59.84 1.64 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 122.076 0.941 . . . . 88.57 109.579 -176.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 599' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -63.93 -16.53 61.69 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 112.558 0.577 . . . . 85.73 112.558 -176.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 18.7 p90 -86.56 -5.61 59.1 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 113.513 0.931 . . . . 76.97 113.513 -175.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 601' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -65.94 150.12 49.13 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 118.764 0.711 . . . . 67.02 110.61 175.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 602' ' ' MET . . . . . . . . . . . . . 39.2 mmt -58.37 -41.52 84.96 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.491 -0.777 . . . . 67.61 111.749 -174.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 603' ' ' ILE . . . . . . . . . . . . . 5.2 tp -60.5 -37.35 74.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 119.962 -0.695 . . . . 56.72 110.108 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 74.3 m -69.98 -36.18 74.98 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 121.975 -0.453 . . . . 64.92 111.612 -179.41 -63.302 -62.373 -94.116 102.248 2.03 101.314 -49.353 -63.802 1 1 . 1 . 001 ecloud orig full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 -66.72 -38.39 86.59 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.009 -0.676 . . . . 57.77 110.663 173.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 606' ' ' CYS . . . . . . . . . . . . . 48.5 t -62.65 -45.09 94.45 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.913 0.387 . . . . 61.8 111.048 178.891 -174.449 60.259 102.128 103.33 2.045 104.891 -74.246 -68.287 1 1 . 1 . 001 ecloud orig full ' A' A ' 607' ' ' ILE . . . . . . . . . . . . . 59.2 mt -71.53 -49.73 44.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 120.573 -0.451 . . . . 68.19 110.549 -178.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 608' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -82.19 -44.35 16.51 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.086 -0.646 . . . . 89.02 112.354 -168.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 609' ' ' THR . . . . . . . . . . . . . 9.4 p -109.67 5.59 23.03 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.264 0.839 . . . . 76.64 113.264 -172.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 610' ' ' HIS . . . . . . . . . . . . . 18.7 t-160 57.22 38.56 28.83 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.424 0.631 . . . . 100.98 111.23 179.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 611' ' ' SER . . . . . . . . . . . . . 2.1 t -143.42 161.07 39.35 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.244 0.545 . . . . 87.28 109.797 -173.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 60.0 mtt 59.27 36.57 23.68 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.55 -0.75 . . . . 78.88 112.088 176.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 613' ' ' CYS . . . . . . . . . . . . . 90.7 m -83.92 -6.17 59.36 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 113.959 1.096 . . . . 63.45 113.959 -176.821 -68.287 -74.246 102.128 104.891 2.045 103.33 60.259 -174.449 1 1 . 1 . 001 ecloud orig full ' A' A ' 614' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -76.42 -30.67 57.52 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.644 -0.822 . . . . 109.38 112.087 -174.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 615' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -110.71 26.46 10.67 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 113.308 0.855 . . . . 97.26 113.308 -169.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 616' ' ' THR . . . . . . . . . . . . . 52.0 p -68.85 -20.92 64.3 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 113.157 0.799 . . . . 67.39 113.157 -169.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 617' ' ' ASP . . . . . 0.408 ' OD1' ' N ' ' A' ' 617' ' ' ASP . 19.5 p-10 -87.44 -19.78 27.55 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.644 0.609 . . . . 84.01 112.644 178.874 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 54.8 mt -74.82 118.31 20.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 109.101 -0.703 . . . . 88.28 109.101 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 619' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -105.25 98.47 8.17 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 107.507 -1.294 . . . . 100.84 107.507 179.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -68.44 116.89 9.52 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.579 -0.526 . . . . 99.64 109.579 -179.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 621' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 61.42 20.69 11.37 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 124.333 1.053 . . . . 128.21 112.6 -178.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 622' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt 60.01 40.65 18.51 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.256 0.623 . . . . 124.61 112.189 171.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 623' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -75.9 -36.61 59.41 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.788 -0.765 . . . . 109.28 111.893 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 624' ' ' ILE . . . . . . . . . . . . . 88.1 mt -67.38 -43.24 87.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 C-N-CA 119.881 -0.727 . . . . 84.69 110.434 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 625' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -64.03 -39.43 94.07 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.335 -0.546 . . . . 122.28 111.098 -179.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 92.1 m -59.0 -40.67 85.61 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.599 -0.441 . . . . 109.12 111.199 176.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -63.35 -43.87 96.47 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.852 0.358 . . . . 90.2 111.576 -176.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 628' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -74.07 -38.14 64.02 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.396 -0.522 . . . . 98.3 111.822 -169.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 629' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -71.57 -10.29 59.53 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.968 -0.693 . . . . 122.45 112.852 179.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 630' ' ' SER . . . . . . . . . . . . . 38.0 m -99.77 -14.3 18.9 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 118.539 0.609 . . . . 113.65 112.596 172.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 631' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -131.87 80.23 1.91 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.361 -1.348 . . . . 104.32 107.361 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 632' ' ' ALA . . . . . . . . . . . . . . . -68.78 -30.86 69.54 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.299 -0.56 . . . . 110.69 111.715 -178.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 633' ' ' ALA . . . . . . . . . . . . . . . -57.52 -48.17 79.99 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 120.147 -0.621 . . . . 108.59 110.943 173.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 634' ' ' ALA . . . . . . . . . . . . . . . -65.58 -30.57 71.32 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.341 -0.544 . . . . 85.92 111.622 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 635' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -65.98 -46.52 77.75 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 119.981 -0.688 . . . . 91.75 111.176 177.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 636' ' ' ARG . . . . . . . . . . . . . 67.5 mtp85 -69.6 -36.6 76.36 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 119.644 -0.823 . . . . 119.18 111.168 -179.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 637' ' ' ALA . . . . . . . . . . . . . . . -64.39 -44.72 90.44 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.598 -0.441 . . . . 90.54 111.283 177.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 638' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -72.58 -40.43 66.62 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 120.686 -0.405 . . . . 76.77 111.221 -176.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 639' ' ' LEU . . . . . . . . . . . . . 21.9 tp -60.31 -43.41 96.37 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.134 -0.626 . . . . 78.95 110.887 174.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 640' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -64.91 -40.0 94.39 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 119.685 -0.806 . . . . 103.26 111.315 177.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 18.9 m -62.28 -40.35 95.95 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.391 -0.524 . . . . 72.08 110.943 178.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 642' ' ' ILE . . . . . . . . . . . . . 25.7 mm -71.81 -42.9 69.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 C-N-CA 120.145 -0.622 . . . . 61.46 110.397 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 643' ' ' MET . . . . . . . . . . . . . 14.6 mmt -58.42 -45.34 88.65 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 121.967 -0.458 . . . . 75.12 110.76 176.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 644' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -63.92 -37.66 88.23 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.52 -0.472 . . . . 92.91 111.129 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 645' ' ' THR . . . . . . . . . . . . . 96.6 m -59.95 -47.84 84.14 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 119.899 -0.72 . . . . 62.06 110.531 175.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 646' ' ' LEU . . . . . . . . . . . . . 89.9 mt -64.67 -39.12 93.13 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.691 -0.403 . . . . 58.74 111.554 -178.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 647' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -68.13 -31.03 70.32 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.067 -0.653 . . . . 78.89 111.414 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 648' ' ' THR . . . . . . . . . . . . . 97.5 m -70.57 -41.43 72.44 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.716 -0.394 . . . . 82.73 111.1 175.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -70.3 -34.33 72.6 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.352 -0.539 . . . . 52.26 112.036 -176.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 650' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -120.31 70.13 0.88 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.11 -0.7 . . . . 51.7 109.11 -172.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 651' ' ' ARG . . . . . . . . . . . . . 48.4 mmm-85 -64.79 151.01 46.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.5 0.667 . . . . 75.04 110.486 177.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 652' ' ' GLY . . . . . . . . . . . . . . . 103.15 -135.39 12.3 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.097 -1.049 . . . . 61.39 113.652 177.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 46.7 tp -62.83 -41.93 99.53 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.592 -0.443 . . . . 58.23 111.543 -173.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 27.8 m -55.43 -45.45 76.78 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.307 -0.557 . . . . 54.95 110.8 177.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 655' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -65.77 -38.67 89.68 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 120.533 -0.467 . . . . 81.88 111.369 -179.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 656' ' ' VAL . . . . . . . . . . . . . 59.8 t -59.24 -46.65 92.09 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-O 121.197 0.522 . . . . 66.78 110.177 176.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 95.7 mt -63.49 -42.6 98.54 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 120.402 -0.519 . . . . 77.35 111.395 -179.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 658' ' ' ILE . . . . . . . . . . . . . 88.4 mt -60.19 -48.67 87.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 C-N-CA 120.319 -0.552 . . . . 73.7 110.274 -179.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 659' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -61.89 -39.36 91.71 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 119.671 -0.812 . . . . 102.99 111.4 178.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 660' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -57.78 -53.37 58.92 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.228 -0.589 . . . . 93.43 110.95 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -65.15 -37.67 88.14 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.486 -0.485 . . . . 87.4 111.688 -178.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 662' ' ' ILE . . . . . . . . . . . . . 22.2 mt -61.19 -37.32 77.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 C-N-CA 120.648 -0.421 . . . . 87.55 110.54 178.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 663' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -76.64 -33.18 58.36 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 117.693 -1.603 . . . . 136.61 112.242 177.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -79.58 -0.42 33.52 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.125 0.787 . . . . 111.82 113.125 177.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 55.36 33.93 21.83 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.183 0.593 . . . . 131.8 111.694 -175.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 666' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -93.96 90.26 6.39 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 108.683 -0.858 . . . . 99.52 108.683 -175.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 667' ' ' SER . . . . . . . . . . . . . 45.3 m -76.34 -36.55 58.16 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.991 -0.549 . . . . 97.56 111.983 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -56.83 -48.54 77.8 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.508 -0.477 . . . . 101.94 110.896 175.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 669' ' ' ALA . . . . . . . . . . . . . . . -61.94 -39.77 93.23 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 120.383 -0.527 . . . . 91.2 111.201 179.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 19.0 mt -63.06 -43.28 99.04 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.166 -0.614 . . . . 75.36 111.398 179.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 671' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -65.73 -36.05 82.47 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 119.653 -0.819 . . . . 103.98 111.255 178.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 672' ' ' ALA . . . . . . . . . . . . . . . -64.77 -42.72 94.91 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.296 -0.561 . . . . 83.66 111.221 176.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 673' ' ' LEU . . . . . . . . . . . . . 65.5 tp -63.62 -45.55 89.78 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 122.115 -0.365 . . . . 70.76 111.069 178.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 674' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -60.35 -38.95 85.41 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.467 -0.493 . . . . 69.68 110.981 177.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 675' ' ' SER . . . . . . . . . . . . . 31.4 t -63.51 -42.9 98.48 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.79 -0.364 . . . . 85.55 111.256 176.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -62.61 -42.54 99.64 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.488 -0.485 . . . . 113.39 111.348 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 677' ' ' ILE . . . . . . . . . . . . . 95.3 mt -62.45 -45.71 98.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-O 121.271 0.557 . . . . 60.72 110.178 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 678' ' ' THR . . . . . . . . . . . . . 53.6 m -49.35 -43.74 44.15 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.39 -0.368 . . . . 61.14 111.875 177.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 679' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -63.15 -19.98 64.97 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.664 0.616 . . . . 89.75 112.664 -178.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 680' ' ' SER . . . . . . . . . . . . . 47.0 m -102.83 -12.74 17.35 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 113.738 1.014 . . . . 67.97 113.738 -173.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 681' ' ' VAL . . . . . . . . . . . . . 27.6 m -126.83 39.72 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 118.788 0.722 . . . . 54.55 110.09 -175.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -60.19 -19.78 55.65 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 113.251 0.834 . . . . 99.76 113.251 -174.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 82.1 m-20 -96.53 5.14 51.4 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 118.821 0.737 . . . . 89.23 112.98 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 684' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -96.87 83.35 3.39 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 106.567 -1.642 . . . . 63.75 106.567 171.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 685' ' ' TYR . . . . . . . . . . . . . 69.9 t80 -39.81 -66.8 0.27 Allowed 'General case' 0 C--O 1.242 0.666 0 C-N-CA 127.14 2.176 . . . . 77.8 113.336 178.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 686' ' ' GLN . . . . . 0.498 ' OE1' ' NH1' ' A' ' 584' ' ' ARG . 28.7 tt0 -61.34 -41.21 96.67 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.183 -0.462 . . . . 80.09 111.593 -176.965 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 687' ' ' MET . . . . . . . . . . . . . 56.5 tpp -66.92 -34.92 78.84 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 118.993 -1.083 . . . . 61.03 111.34 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 29.5 mm -58.95 -43.02 87.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 120.301 -0.56 . . . . 63.68 110.101 171.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 689' ' ' GLY . . . . . . . . . . . . . . . -58.92 -43.89 96.46 Favored Glycine 0 C--N 1.336 0.575 0 C-N-CA 119.454 -1.355 . . . . 59.67 112.892 175.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 690' ' ' ILE . . . . . . . . . . . . . 31.0 mm -65.69 -41.3 90.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 O-C-N 122.168 -0.607 . . . . 56.68 110.68 -177.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 42.2 mt -66.85 -42.73 85.25 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.398 -0.521 . . . . 56.92 111.401 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 692' ' ' LYS . . . . . . . . . . . . . 53.3 mttm -57.89 -50.52 73.05 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 120.117 -0.633 . . . . 81.44 110.871 176.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 693' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -60.29 -36.97 79.08 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.335 -0.546 . . . . 66.32 111.416 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.75 -43.91 95.03 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.395 -0.522 . . . . 62.06 111.01 179.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 695' ' ' SER . . . . . . . . . . . . . 37.9 m -63.9 -36.94 85.58 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 119.78 -0.768 . . . . 79.08 111.062 177.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 696' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -61.95 -44.46 96.73 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.252 -0.579 . . . . 92.76 111.032 177.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 18.1 mt -59.67 -35.23 74.03 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.713 -0.395 . . . . 88.35 111.344 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 698' ' ' LEU . . . . . . . . . . . . . 87.2 mt -68.89 -30.85 69.42 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.097 -0.641 . . . . 95.42 111.414 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -64.52 -40.16 95.12 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.253 -0.579 . . . . 118.63 111.045 173.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 700' ' ' ILE . . . . . . . . . . . . . 92.3 mt -64.67 96.73 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 107.555 -1.276 . . . . 112.59 107.555 172.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 701' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 -103.43 124.15 48.19 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.914 -0.772 . . . . 147.27 108.914 -173.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 C--N 1.329 -0.312 0 O-C-N 123.366 0.416 . . . . 149.9 111.145 -176.061 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 801' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 802' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 803' ' ' SO4 . . . . . 0.521 ' O4 ' ' N ' ' A' ' 576' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 804' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 805' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 806' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 807' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 901' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 902' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 903' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 904' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 905' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 906' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 907' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 909' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 910' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 911' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 912' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 913' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 914' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 915' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 916' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 917' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 918' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 919' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 920' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 921' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 922' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 923' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 924' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 925' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 926' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 927' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 928' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 929' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 930' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 931' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 932' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 933' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 934' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 935' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 936' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 937' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 938' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 939' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 940' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 482' ' ' ASP . . . . . . . . . . . . . 39.7 t0 . . . . . 0 C--O 1.232 0.135 0 N-CA-C 110.005 -0.369 . . . . 135.89 110.005 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 483' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -63.53 141.29 58.82 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.241 0.543 . . . . 138.63 110.822 -174.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 484' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -64.98 140.97 58.92 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.745 -0.661 . . . . 90.0 110.328 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 485' ' ' CYS . . . . . . . . . . . . . 22.9 m -62.22 -26.24 68.26 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.951 -0.568 . . . . 83.84 111.925 -179.192 -79.775 -121.448 -87.113 104.619 2.036 102.292 -53.226 -43.502 1 1 . 1 . 001 ecloud build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 96.0 mt -78.95 -13.35 59.85 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.611 0.597 . . . . 68.84 112.611 176.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 29.6 t -81.95 -28.18 32.88 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.18 0.437 . . . . 111.75 112.18 -177.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -87.87 -176.89 5.65 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 122.33 1.062 . . . . 132.5 112.263 -163.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 489' ' ' ASP . . . . . 0.579 ' OD1' ' N ' ' A' ' 489' ' ' ASP . 1.0 OUTLIER -85.58 -177.66 6.47 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 114.868 -1.06 . . . . 166.57 112.103 -158.005 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 5.1 tt -76.57 -39.57 32.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-N 115.144 -0.934 . . . . 151.09 110.81 -174.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 491' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -86.58 102.72 14.41 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.305 -0.998 . . . . 157.45 108.305 -178.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 492' ' ' ILE . . . . . . . . . . . . . 44.6 mm -122.63 130.15 74.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 108.395 -0.965 . . . . 126.27 108.395 -176.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 493' ' ' THR . . . . . . . . . . . . . 27.3 p -73.72 155.55 38.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.388 0.613 . . . . 109.38 110.31 176.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 494' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -58.64 -28.67 65.9 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 119.844 -0.742 . . . . 111.02 111.167 171.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 66.5 tt0 -70.03 -43.8 70.55 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.758 -0.377 . . . . 116.66 111.413 -179.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -61.6 -33.32 73.71 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 120.714 -0.395 . . . . 117.6 111.611 176.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 45.6 mt -60.22 -16.86 37.16 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 112.682 0.623 . . . . 77.77 112.682 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 20.2 m170 -59.87 -26.31 65.76 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.378 -0.529 . . . . 79.04 111.832 175.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 499' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -74.74 -13.2 60.57 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.564 -0.854 . . . . 98.79 112.82 177.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 500' ' ' CYS . . . . . . . . . . . . . 7.4 m -104.88 -2.71 24.32 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 113.411 0.893 . . . . 65.74 113.411 -170.009 -43.502 -53.226 -87.113 102.292 2.036 104.619 -121.448 -79.775 1 1 . 1 . 001 ecloud build full ' A' A ' 501' ' ' ILE . . . . . . . . . . . . . 10.8 pt -69.25 152.17 9.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.605 0 CA-C-O 121.822 0.82 . . . . 57.52 110.425 -175.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 502' ' ' GLY . . . . . . . . . . . . . . . -45.74 -53.79 8.33 Favored Glycine 0 N--CA 1.443 -0.861 0 N-CA-C 116.119 1.208 . . . . 55.53 116.119 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 503' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -53.4 -31.75 59.07 Favored 'Trans proline' 0 N--CA 1.477 0.521 0 CA-C-N 118.099 0.95 . . . . 54.41 113.515 -179.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -82.59 -42.4 18.31 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 112.462 0.542 . . . . 99.53 112.462 -176.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 505' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' A' ' 560' ' ' ARG . 3.8 pt -81.79 -16.05 12.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 O-C-N 121.688 -0.633 . . . . 68.78 112.175 -176.373 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 22.3 ttp -77.67 144.31 37.45 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.111 0.482 . . . . 70.64 110.88 -174.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -110.67 -138.25 7.75 Favored Glycine 0 N--CA 1.45 -0.395 0 CA-C-N 115.995 -0.548 . . . . 71.41 112.445 176.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -107.94 3.15 23.87 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.567 0.58 . . . . 96.9 112.567 177.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 28.9 p -124.32 158.32 32.89 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.386 0.675 . . . . 60.05 109.638 -174.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 510' ' ' CYS . . . . . . . . . . . . . 5.9 p -129.75 98.4 4.8 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 106.618 -1.623 . . . . 79.58 106.618 172.035 47.847 146.184 89.485 104.474 2.037 104.711 -63.732 -63.655 1 1 . 1 . 001 ecloud build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 34.0 m -82.13 166.97 2.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.659 -0.867 . . . . 57.0 108.659 -179.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 512' ' ' SER . . . . . . . . . . . . . 58.9 p -68.66 160.46 30.15 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 119.386 -0.926 . . . . 60.61 109.694 173.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -65.63 -35.18 80.04 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 119.284 -0.966 . . . . 66.49 111.434 177.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 514' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -67.15 -37.04 83.12 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 119.438 -0.905 . . . . 90.39 111.184 177.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 515' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -67.61 -40.89 84.71 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 119.838 -0.745 . . . . 92.95 111.422 176.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 58.3 tp -63.23 -39.55 94.95 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 119.475 -0.89 . . . . 50.63 110.379 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -62.96 -44.74 95.21 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.154 -0.619 . . . . 52.52 111.236 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 58.0 m -64.84 -38.35 90.67 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 119.188 -1.005 . . . . 63.62 111.03 177.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -62.95 -54.23 41.76 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 120.73 0.3 . . . . 78.24 111.513 -179.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 520' ' ' LEU . . . . . . . . . . . . . 94.6 mt -66.15 -34.41 77.98 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 122.101 -0.375 . . . . 52.45 111.304 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -62.84 -46.72 86.61 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.779 -0.368 . . . . 62.68 110.501 178.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 522' ' ' SER . . . . . . . . . . . . . 79.3 p -65.37 -16.14 63.29 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 112.634 0.605 . . . . 65.17 112.634 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 523' ' ' LYS . . . . . . . . . . . . . 83.6 mttt -96.17 8.45 43.81 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 112.639 0.607 . . . . 69.26 112.639 174.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 524' ' ' ASN . . . . . . . . . . . . . 56.2 t30 57.33 37.58 28.14 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.453 0.701 . . . . 78.18 111.955 -177.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 525' ' ' LEU . . . . . . . . . . . . . 92.8 mt -107.21 -20.79 13.18 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 113.237 0.829 . . . . 61.35 113.237 178.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 526' ' ' VAL . . . . . . . . . . . . . 34.7 m -131.94 163.42 37.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 107.401 -1.333 . . . . 57.64 107.401 170.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 17.5 p -125.35 -178.88 4.37 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.648 -0.871 . . . . 64.51 108.648 178.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 528' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -65.84 -29.85 70.38 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.541 -0.863 . . . . 105.33 111.629 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -62.06 -17.96 59.13 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.459 0.54 . . . . 85.83 112.459 174.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -89.79 -7.6 54.03 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 113.109 0.781 . . . . 64.29 113.109 177.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 531' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -61.45 -31.9 71.87 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 119.384 -0.927 . . . . 92.67 111.918 -169.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 532' ' ' LYS . . . . . . . . . . . . . 23.4 pttm -57.95 -29.73 65.42 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.602 -0.439 . . . . 90.76 112.079 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 533' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -72.36 -7.42 49.51 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 113.055 0.761 . . . . 84.43 113.055 -179.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 534' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -101.93 10.91 39.33 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 112.968 0.729 . . . . 66.32 112.968 -177.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -77.64 153.84 81.12 Favored Pre-proline 0 C--N 1.317 -0.818 0 CA-C-N 118.133 0.424 . . . . 106.12 110.593 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 536' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -61.18 150.18 85.73 Favored 'Trans proline' 0 CA--C 1.519 -0.231 0 CA-C-O 121.697 0.624 . . . . 85.45 111.558 -177.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -168.54 150.25 4.95 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 107.534 -1.284 . . . . 102.36 107.534 -179.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 22.1 p -63.74 159.68 18.75 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.96 0.886 . . . . 89.54 110.303 175.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 539' ' ' VAL . . . . . 0.459 HG12 ' CZ ' ' A' ' 543' ' ' PHE . 8.2 t -69.42 -34.71 63.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 115.119 -0.946 . . . . 82.78 111.041 -177.578 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -67.63 -39.8 84.64 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.001 -0.68 . . . . 109.81 111.084 178.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 541' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -67.12 -33.86 76.36 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.093 -0.643 . . . . 93.49 111.996 176.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -64.07 -43.78 94.41 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 119.952 -0.699 . . . . 56.88 110.74 171.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 543' ' ' PHE . . . . . 0.459 ' CZ ' HG12 ' A' ' 539' ' ' VAL . 21.9 m-30 -51.36 -50.33 59.74 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.861 0.362 . . . . 63.05 111.064 173.724 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 544' ' ' ASN . . . . . . . . . . . . . 90.3 m-20 -67.81 -38.56 83.42 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.956 -0.698 . . . . 76.25 111.45 -176.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 545' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.59 -34.75 77.62 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.613 -0.835 . . . . 93.64 111.099 178.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 92.2 mt -72.6 -49.15 43.09 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 120.415 -0.514 . . . . 70.39 110.71 175.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -75.14 -7.73 54.6 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 113.05 0.759 . . . . 83.59 113.05 -169.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 548' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -114.15 4.75 15.69 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.379 0.536 . . . . 92.12 111.98 173.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.8 135.46 54.9 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.197 0.523 . . . . 93.71 110.961 -176.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 550' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -105.37 -0.54 26.05 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.867 -0.606 . . . . 133.66 112.557 178.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -116.78 131.9 56.83 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.368 -0.975 . . . . 106.0 108.368 176.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -69.07 -41.28 77.77 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.248 -0.581 . . . . 78.02 111.53 -176.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -61.94 -39.47 92.18 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 120.231 -0.587 . . . . 87.84 110.98 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 554' ' ' ARG . . . . . . . . . . . . . 65.6 ttt-85 -64.31 -44.66 90.9 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.728 0.299 . . . . 111.22 111.117 177.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 555' ' ' MET . . . . . . . . . . . . . 22.1 ttp -59.81 -44.38 94.04 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.02 0.438 . . . . 86.48 111.062 178.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 74.4 mt -61.91 -45.72 98.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 121.185 0.517 . . . . 67.44 110.772 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 40.9 tp -65.58 -43.64 89.14 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 119.636 -0.826 . . . . 52.86 111.349 -177.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 558' ' ' LEU . . . . . . . . . . . . . 94.7 mt -67.95 -36.49 80.19 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 120.242 -0.583 . . . . 57.13 111.293 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 559' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -61.65 -46.7 88.64 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.07 0.462 . . . . 52.7 110.858 172.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 560' ' ' ARG . . . . . 0.428 ' HA ' HD12 ' A' ' 505' ' ' ILE . 5.1 tpt180 -57.32 -47.45 81.51 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.083 0.468 . . . . 58.15 111.109 178.87 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 561' ' ' ILE . . . . . . . . . . . . . 93.2 mt -61.03 -48.68 87.97 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 CA-C-O 121.138 0.494 . . . . 45.8 110.429 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 562' ' ' LEU . . . . . . . . . . . . . 14.0 tp -57.7 -52.12 66.74 Favored 'General case' 0 C--O 1.235 0.337 0 O-C-N 122.237 -0.289 . . . . 57.22 111.566 -177.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 46.6 m-85 -82.34 -12.36 58.01 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.564 0.95 . . . . 60.13 113.564 -173.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 564' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -91.02 -22.25 20.87 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 118.884 0.766 . . . . 81.5 113.045 172.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 565' ' ' THR . . . . . . . . . . . . . 59.6 p -116.87 -15.53 10.65 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 114.98 1.474 . . . . 51.45 114.98 -172.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -96.2 107.56 19.91 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 119.826 1.194 . . . . 60.79 109.077 -176.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 76.8 m -61.03 -35.86 78.02 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.647 -0.706 . . . . 59.0 112.464 -167.728 -63.655 -63.732 89.485 104.711 2.037 104.474 146.184 47.847 1 1 . 1 . 001 ecloud build full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -61.0 -30.86 70.54 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 118.858 -1.137 . . . . 99.95 111.766 -176.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 569' ' ' MET . . . . . . . . . . . . . 39.9 mmm -60.5 -25.56 66.18 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 119.445 -0.902 . . . . 66.52 111.816 -179.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 570' ' ' LEU . . . . . . . . . . . . . 48.9 mt -58.75 -25.92 63.47 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 120.085 -0.646 . . . . 63.97 111.952 179.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 571' ' ' SER . . . . . . . . . . . . . 20.9 m -59.42 -23.92 63.05 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.465 -0.494 . . . . 71.75 112.26 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 572' ' ' LEU . . . . . . . . . . . . . 82.5 mt -64.32 -19.29 65.34 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.858 -0.737 . . . . 67.01 112.456 -179.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 573' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -82.99 1.6 39.04 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.571 -0.852 . . . . 76.65 112.993 174.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 574' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -129.94 -164.59 1.43 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-O 122.068 0.937 . . . . 73.6 108.622 -175.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -102.62 -33.33 9.49 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.756 1.021 . . . . 89.52 113.756 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 576' ' ' SER . . . . . 0.701 ' HB2' ' O4 ' ' A' ' 803' ' ' SO4 . 74.4 m -104.2 -176.61 3.13 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.949 0.88 . . . . 97.5 109.789 -172.582 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 577' ' ' GLY . . . . . . . . . . . . . . . 110.33 150.18 12.54 Favored Glycine 0 N--CA 1.44 -1.092 0 N-CA-C 111.056 -0.817 . . . . 88.3 111.056 -177.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 578' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -60.35 -33.19 94.58 Favored 'Trans proline' 0 C--O 1.238 0.507 0 N-CA-C 113.422 0.508 . . . . 104.6 113.422 179.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -67.06 -32.54 73.79 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.344 -0.542 . . . . 107.98 111.47 179.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 580' ' ' ASN . . . . . 0.468 ' O ' ' HB2' ' A' ' 584' ' ' ARG . 27.5 m-20 -74.83 -41.72 59.37 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 120.834 -0.346 . . . . 86.0 111.263 176.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 581' ' ' VAL . . . . . . . . . . . . . 95.1 t -62.84 -25.85 39.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 C-N-CA 120.986 -0.285 . . . . 97.48 110.642 176.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -58.33 -71.64 0.11 Allowed 'General case' 0 C--O 1.238 0.461 0 O-C-N 121.772 -0.58 . . . . 88.91 111.101 177.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 583' ' ' TRP . . . . . . . . . . . . . 57.8 p-90 -64.45 -28.48 69.7 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 120.084 -0.646 . . . . 89.1 111.603 -179.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 584' ' ' ARG . . . . . 0.498 ' NH1' ' OE1' ' A' ' 686' ' ' GLN . 44.6 ttm-85 -63.58 -48.63 76.61 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 121.084 0.469 . . . . 108.42 111.118 -179.444 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 585' ' ' THR . . . . . 0.724 ' O ' ' HB2' ' A' ' 589' ' ' ASN . 58.2 p -72.32 -34.15 67.88 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 122.226 -0.297 . . . . 113.98 111.429 177.37 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 586' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -59.86 -37.04 78.15 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 119.34 -0.944 . . . . 111.45 110.942 175.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 587' ' ' LEU . . . . . . . . . . . . . 32.1 tp -77.35 -48.68 16.7 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.938 -0.305 . . . . 91.21 111.588 -177.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 588' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -63.43 -30.6 71.7 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 119.202 -0.999 . . . . 97.79 111.449 178.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 589' ' ' ASN . . . . . 0.724 ' HB2' ' O ' ' A' ' 585' ' ' THR . 8.8 t30 -58.26 -72.78 0.09 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.028 0.931 . . . . 121.61 111.002 -172.641 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 590' ' ' HIS . . . . . 0.668 ' O ' ' ND1' ' A' ' 590' ' ' HIS . 13.7 p80 -91.85 94.53 9.36 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 106.243 -1.762 . . . . 125.8 106.243 167.531 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 35.4 t30 -70.81 -175.56 1.13 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 122.037 0.922 . . . . 112.4 109.537 -170.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 592' ' ' ILE . . . . . 0.436 ' HB ' ' CG ' ' A' ' 638' ' ' ASP . 33.5 pt -96.05 148.19 5.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 N-CA-C 108.414 -0.958 . . . . 80.29 108.414 174.535 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -64.47 -26.09 68.29 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.698 -0.683 . . . . 103.44 111.95 -174.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 49.7 tp -55.31 -33.78 63.6 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.164 -0.614 . . . . 69.17 111.632 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 595' ' ' CYS . . . . . . . . . . . . . 78.4 m -83.52 -12.88 55.68 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.604 0.965 . . . . 73.07 113.604 -171.632 -63.802 -49.353 -94.116 101.314 2.03 102.248 -62.373 -63.302 1 1 . 1 . 001 ecloud build full ' A' A ' 596' ' ' SER . . . . . . . . . . . . . 91.5 p -70.27 -45.44 66.37 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 118.798 0.727 . . . . 97.82 111.162 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 597' ' ' ARG . . . . . . . . . . . . . 60.3 mtm-85 -96.55 -11.46 25.38 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 113.341 0.867 . . . . 116.37 113.341 179.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 598' ' ' HIS . . . . . . . . . . . . . 61.5 m80 -138.06 59.84 1.64 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 122.076 0.941 . . . . 88.57 109.579 -176.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 599' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -63.93 -16.53 61.69 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 112.558 0.577 . . . . 85.73 112.558 -176.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 18.7 p90 -86.56 -5.61 59.1 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 113.513 0.931 . . . . 76.97 113.513 -175.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 601' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -65.94 150.12 49.13 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 118.764 0.711 . . . . 67.02 110.61 175.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 602' ' ' MET . . . . . . . . . . . . . 39.2 mmt -58.37 -41.52 84.96 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.491 -0.777 . . . . 67.61 111.749 -174.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 603' ' ' ILE . . . . . . . . . . . . . 5.2 tp -60.5 -37.35 74.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 119.962 -0.695 . . . . 56.72 110.108 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 74.3 m -69.98 -36.18 74.98 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 121.975 -0.453 . . . . 64.92 111.612 -179.41 -63.302 -62.373 -94.116 102.248 2.03 101.314 -49.353 -63.802 1 1 . 1 . 001 ecloud build full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 -66.72 -38.39 86.59 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.009 -0.676 . . . . 57.77 110.663 173.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 606' ' ' CYS . . . . . . . . . . . . . 48.5 t -62.65 -45.09 94.45 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.913 0.387 . . . . 61.8 111.048 178.891 -174.449 60.259 102.128 103.33 2.045 104.891 -74.246 -68.287 1 1 . 1 . 001 ecloud build full ' A' A ' 607' ' ' ILE . . . . . . . . . . . . . 59.2 mt -71.53 -49.73 44.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 120.573 -0.451 . . . . 68.19 110.549 -178.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 608' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -82.19 -44.35 16.51 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.086 -0.646 . . . . 89.02 112.354 -168.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 609' ' ' THR . . . . . . . . . . . . . 9.4 p -109.67 5.59 23.03 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.264 0.839 . . . . 76.64 113.264 -172.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 610' ' ' HIS . . . . . . . . . . . . . 18.7 t-160 57.22 38.56 28.83 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.424 0.631 . . . . 100.98 111.23 179.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 611' ' ' SER . . . . . . . . . . . . . 2.1 t -143.42 161.07 39.35 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.244 0.545 . . . . 87.28 109.797 -173.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 60.0 mtt 59.27 36.57 23.68 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.55 -0.75 . . . . 78.88 112.088 176.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 613' ' ' CYS . . . . . . . . . . . . . 90.7 m -83.92 -6.17 59.36 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 113.959 1.096 . . . . 63.45 113.959 -176.821 -68.287 -74.246 102.128 104.891 2.045 103.33 60.259 -174.449 1 1 . 1 . 001 ecloud build full ' A' A ' 614' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -76.42 -30.67 57.52 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.644 -0.822 . . . . 109.38 112.087 -174.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 615' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -110.71 26.46 10.67 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 113.308 0.855 . . . . 97.26 113.308 -169.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 616' ' ' THR . . . . . . . . . . . . . 52.0 p -68.85 -20.92 64.3 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 113.157 0.799 . . . . 67.39 113.157 -169.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 19.5 p-10 -87.44 -19.78 27.55 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.644 0.609 . . . . 84.01 112.644 178.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 54.8 mt -74.82 118.31 20.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 109.101 -0.703 . . . . 88.28 109.101 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 619' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -105.25 98.47 8.17 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 107.507 -1.294 . . . . 100.84 107.507 179.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -68.44 116.89 9.52 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.579 -0.526 . . . . 99.64 109.579 -179.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 621' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 61.42 20.69 11.37 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 124.333 1.053 . . . . 128.21 112.6 -178.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 622' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt 60.01 40.65 18.51 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.256 0.623 . . . . 124.61 112.189 171.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 623' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -75.9 -36.61 59.41 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.788 -0.765 . . . . 109.28 111.893 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 624' ' ' ILE . . . . . . . . . . . . . 88.1 mt -67.38 -43.24 87.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 C-N-CA 119.881 -0.727 . . . . 84.69 110.434 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 625' ' ' GLU . . . . . 0.471 ' HG2' ' HE3' ' A' ' 629' ' ' LYS . 80.3 tt0 -64.03 -39.43 94.07 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.335 -0.546 . . . . 122.28 111.098 -179.326 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 92.1 m -59.0 -40.67 85.61 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.599 -0.441 . . . . 109.12 111.199 176.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -63.35 -43.87 96.47 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.852 0.358 . . . . 90.2 111.576 -176.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 628' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -74.07 -38.14 64.02 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.396 -0.522 . . . . 98.3 111.822 -169.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 629' ' ' LYS . . . . . 0.471 ' HE3' ' HG2' ' A' ' 625' ' ' GLU . 16.9 ptpt -71.57 -10.29 59.53 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.968 -0.693 . . . . 122.45 112.852 179.343 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 630' ' ' SER . . . . . . . . . . . . . 38.0 m -99.77 -14.3 18.9 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 118.539 0.609 . . . . 113.65 112.596 172.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 631' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -131.87 80.23 1.91 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.361 -1.348 . . . . 104.32 107.361 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 632' ' ' ALA . . . . . . . . . . . . . . . -68.78 -30.86 69.54 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.299 -0.56 . . . . 110.69 111.715 -178.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 633' ' ' ALA . . . . . . . . . . . . . . . -57.52 -48.17 79.99 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 120.147 -0.621 . . . . 108.59 110.943 173.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 634' ' ' ALA . . . . . . . . . . . . . . . -65.58 -30.57 71.32 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.341 -0.544 . . . . 85.92 111.622 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 635' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -65.98 -46.52 77.75 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 119.981 -0.688 . . . . 91.75 111.176 177.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 636' ' ' ARG . . . . . . . . . . . . . 67.5 mtp85 -69.6 -36.6 76.36 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 119.644 -0.823 . . . . 119.18 111.168 -179.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 637' ' ' ALA . . . . . . . . . . . . . . . -64.39 -44.72 90.44 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.598 -0.441 . . . . 90.54 111.283 177.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 638' ' ' ASP . . . . . 0.436 ' CG ' ' HB ' ' A' ' 592' ' ' ILE . 64.1 m-20 -72.58 -40.43 66.62 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 120.686 -0.405 . . . . 76.77 111.221 -176.993 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 639' ' ' LEU . . . . . . . . . . . . . 21.9 tp -60.31 -43.41 96.37 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.134 -0.626 . . . . 78.95 110.887 174.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 640' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -64.91 -40.0 94.39 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 119.685 -0.806 . . . . 103.26 111.315 177.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 18.9 m -62.28 -40.35 95.95 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.391 -0.524 . . . . 72.08 110.943 178.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 642' ' ' ILE . . . . . . . . . . . . . 25.7 mm -71.81 -42.9 69.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 C-N-CA 120.145 -0.622 . . . . 61.46 110.397 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 643' ' ' MET . . . . . . . . . . . . . 14.6 mmt -58.42 -45.34 88.65 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 121.967 -0.458 . . . . 75.12 110.76 176.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 644' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -63.92 -37.66 88.23 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.52 -0.472 . . . . 92.91 111.129 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 645' ' ' THR . . . . . . . . . . . . . 96.6 m -59.95 -47.84 84.14 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 119.899 -0.72 . . . . 62.06 110.531 175.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 646' ' ' LEU . . . . . . . . . . . . . 89.9 mt -64.67 -39.12 93.13 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.691 -0.403 . . . . 58.74 111.554 -178.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 647' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -68.13 -31.03 70.32 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.067 -0.653 . . . . 78.89 111.414 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 648' ' ' THR . . . . . . . . . . . . . 97.5 m -70.57 -41.43 72.44 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.716 -0.394 . . . . 82.73 111.1 175.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -70.3 -34.33 72.6 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.352 -0.539 . . . . 52.26 112.036 -176.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 650' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -120.31 70.13 0.88 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.11 -0.7 . . . . 51.7 109.11 -172.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 651' ' ' ARG . . . . . . . . . . . . . 48.4 mmm-85 -64.79 151.01 46.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.5 0.667 . . . . 75.04 110.486 177.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 652' ' ' GLY . . . . . . . . . . . . . . . 103.15 -135.39 12.3 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.097 -1.049 . . . . 61.39 113.652 177.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 46.7 tp -62.83 -41.93 99.53 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.592 -0.443 . . . . 58.23 111.543 -173.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 27.8 m -55.43 -45.45 76.78 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.307 -0.557 . . . . 54.95 110.8 177.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 655' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -65.77 -38.67 89.68 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 120.533 -0.467 . . . . 81.88 111.369 -179.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 656' ' ' VAL . . . . . . . . . . . . . 59.8 t -59.24 -46.65 92.09 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-O 121.197 0.522 . . . . 66.78 110.177 176.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 95.7 mt -63.49 -42.6 98.54 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 120.402 -0.519 . . . . 77.35 111.395 -179.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 658' ' ' ILE . . . . . . . . . . . . . 88.4 mt -60.19 -48.67 87.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 C-N-CA 120.319 -0.552 . . . . 73.7 110.274 -179.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 659' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -61.89 -39.36 91.71 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 119.671 -0.812 . . . . 102.99 111.4 178.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 660' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -57.78 -53.37 58.92 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.228 -0.589 . . . . 93.43 110.95 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -65.15 -37.67 88.14 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.486 -0.485 . . . . 87.4 111.688 -178.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 662' ' ' ILE . . . . . . . . . . . . . 22.2 mt -61.19 -37.32 77.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 C-N-CA 120.648 -0.421 . . . . 87.55 110.54 178.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 663' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -76.64 -33.18 58.36 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 117.693 -1.603 . . . . 136.61 112.242 177.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -79.58 -0.42 33.52 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.125 0.787 . . . . 111.82 113.125 177.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 55.36 33.93 21.83 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.183 0.593 . . . . 131.8 111.694 -175.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 666' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -93.96 90.26 6.39 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 108.683 -0.858 . . . . 99.52 108.683 -175.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 667' ' ' SER . . . . . . . . . . . . . 45.3 m -76.34 -36.55 58.16 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.991 -0.549 . . . . 97.56 111.983 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -56.83 -48.54 77.8 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.508 -0.477 . . . . 101.94 110.896 175.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 669' ' ' ALA . . . . . . . . . . . . . . . -61.94 -39.77 93.23 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 120.383 -0.527 . . . . 91.2 111.201 179.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 19.0 mt -63.06 -43.28 99.04 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.166 -0.614 . . . . 75.36 111.398 179.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 671' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -65.73 -36.05 82.47 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 119.653 -0.819 . . . . 103.98 111.255 178.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 672' ' ' ALA . . . . . . . . . . . . . . . -64.77 -42.72 94.91 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.296 -0.561 . . . . 83.66 111.221 176.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 673' ' ' LEU . . . . . . . . . . . . . 65.5 tp -63.62 -45.55 89.78 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 122.115 -0.365 . . . . 70.76 111.069 178.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 674' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -60.35 -38.95 85.41 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.467 -0.493 . . . . 69.68 110.981 177.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 675' ' ' SER . . . . . . . . . . . . . 31.4 t -63.51 -42.9 98.48 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.79 -0.364 . . . . 85.55 111.256 176.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -62.61 -42.54 99.64 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.488 -0.485 . . . . 113.39 111.348 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 677' ' ' ILE . . . . . . . . . . . . . 95.3 mt -62.45 -45.71 98.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-O 121.271 0.557 . . . . 60.72 110.178 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 678' ' ' THR . . . . . . . . . . . . . 53.6 m -49.35 -43.74 44.15 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.39 -0.368 . . . . 61.14 111.875 177.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 679' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -63.15 -19.98 64.97 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.664 0.616 . . . . 89.75 112.664 -178.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 680' ' ' SER . . . . . . . . . . . . . 47.0 m -102.83 -12.74 17.35 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 113.738 1.014 . . . . 67.97 113.738 -173.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 681' ' ' VAL . . . . . . . . . . . . . 27.6 m -126.83 39.72 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 118.788 0.722 . . . . 54.55 110.09 -175.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -60.19 -19.78 55.65 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 113.251 0.834 . . . . 99.76 113.251 -174.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 82.1 m-20 -96.53 5.14 51.4 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 118.821 0.737 . . . . 89.23 112.98 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 684' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -96.87 83.35 3.39 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 106.567 -1.642 . . . . 63.75 106.567 171.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 685' ' ' TYR . . . . . . . . . . . . . 69.9 t80 -39.81 -66.8 0.27 Allowed 'General case' 0 C--O 1.242 0.666 0 C-N-CA 127.14 2.176 . . . . 77.8 113.336 178.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 686' ' ' GLN . . . . . 0.498 ' OE1' ' NH1' ' A' ' 584' ' ' ARG . 28.7 tt0 -61.34 -41.21 96.67 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.183 -0.462 . . . . 80.09 111.593 -176.965 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 687' ' ' MET . . . . . . . . . . . . . 56.5 tpp -66.92 -34.92 78.84 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 118.993 -1.083 . . . . 61.03 111.34 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 29.5 mm -58.95 -43.02 87.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 120.301 -0.56 . . . . 63.68 110.101 171.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 689' ' ' GLY . . . . . . . . . . . . . . . -58.92 -43.89 96.46 Favored Glycine 0 C--N 1.336 0.575 0 C-N-CA 119.454 -1.355 . . . . 59.67 112.892 175.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 690' ' ' ILE . . . . . . . . . . . . . 31.0 mm -65.69 -41.3 90.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 O-C-N 122.168 -0.607 . . . . 56.68 110.68 -177.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 42.2 mt -66.85 -42.73 85.25 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.398 -0.521 . . . . 56.92 111.401 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 692' ' ' LYS . . . . . . . . . . . . . 53.3 mttm -57.89 -50.52 73.05 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 120.117 -0.633 . . . . 81.44 110.871 176.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 693' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -60.29 -36.97 79.08 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.335 -0.546 . . . . 66.32 111.416 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.75 -43.91 95.03 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.395 -0.522 . . . . 62.06 111.01 179.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 695' ' ' SER . . . . . . . . . . . . . 37.9 m -63.9 -36.94 85.58 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 119.78 -0.768 . . . . 79.08 111.062 177.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 696' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -61.95 -44.46 96.73 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.252 -0.579 . . . . 92.76 111.032 177.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 18.1 mt -59.67 -35.23 74.03 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.713 -0.395 . . . . 88.35 111.344 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 698' ' ' LEU . . . . . . . . . . . . . 87.2 mt -68.89 -30.85 69.42 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.097 -0.641 . . . . 95.42 111.414 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -64.52 -40.16 95.12 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.253 -0.579 . . . . 118.63 111.045 173.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 700' ' ' ILE . . . . . . . . . . . . . 92.3 mt -64.67 96.73 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 107.555 -1.276 . . . . 112.59 107.555 172.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 701' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 -103.43 124.15 48.19 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.914 -0.772 . . . . 147.27 108.914 -173.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 C--N 1.329 -0.312 0 O-C-N 123.366 0.416 . . . . 149.9 111.145 -176.061 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 801' ' ' NAG . . . . . 0.6 ' H3 ' ' H83' ' A' ' 801' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 802' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 803' ' ' SO4 . . . . . 0.701 ' O4 ' ' HB2' ' A' ' 576' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 804' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 805' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 806' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 807' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 901' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 902' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 903' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 904' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 905' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 906' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 907' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 909' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 910' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 911' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 912' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 913' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 914' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 915' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 916' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 917' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 918' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 919' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 920' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 921' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 922' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 923' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 924' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 925' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 926' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 927' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 928' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 929' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 930' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 931' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 932' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 933' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 934' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 935' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 936' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 937' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 938' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 939' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 940' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 482' ' ' ASP . . . . . . . . . . . . . 39.7 t0 . . . . . 0 C--O 1.232 0.135 0 N-CA-C 110.005 -0.369 . . . . 135.89 110.005 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 483' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -63.53 141.29 58.82 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.241 0.543 . . . . 138.63 110.822 -174.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 484' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -64.98 140.97 58.92 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.745 -0.661 . . . . 90.0 110.328 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 485' ' ' CYS . . . . . . . . . . . . . 22.9 m -62.22 -26.24 68.26 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.951 -0.568 . . . . 83.84 111.925 -179.192 -79.775 -121.448 -87.113 104.619 2.036 102.292 -53.226 -43.502 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 96.0 mt -78.95 -13.35 59.85 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.611 0.597 . . . . 68.84 112.611 176.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 487' ' ' SER . . . . . . . . . . . . . 29.6 t -81.95 -28.18 32.88 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.18 0.437 . . . . 111.75 112.18 -177.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -87.87 -176.89 5.65 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 122.33 1.062 . . . . 132.5 112.263 -163.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 489' ' ' ASP . . . . . 0.579 ' OD1' ' N ' ' A' ' 489' ' ' ASP . 1.0 OUTLIER -85.58 -177.66 6.47 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 114.868 -1.06 . . . . 166.57 112.103 -158.005 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 5.1 tt -76.57 -39.57 32.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-N 115.144 -0.934 . . . . 151.09 110.81 -174.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 491' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -86.58 102.72 14.41 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.305 -0.998 . . . . 157.45 108.305 -178.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 492' ' ' ILE . . . . . . . . . . . . . 44.6 mm -122.63 130.15 74.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 108.395 -0.965 . . . . 126.27 108.395 -176.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 493' ' ' THR . . . . . . . . . . . . . 27.3 p -73.72 155.55 38.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.388 0.613 . . . . 109.38 110.31 176.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 494' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -58.64 -28.67 65.9 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 119.844 -0.742 . . . . 111.02 111.167 171.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 66.5 tt0 -70.03 -43.8 70.55 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.758 -0.377 . . . . 116.66 111.413 -179.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -61.6 -33.32 73.71 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 120.714 -0.395 . . . . 117.6 111.611 176.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 45.6 mt -60.22 -16.86 37.16 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 112.682 0.623 . . . . 77.77 112.682 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 498' ' ' HIS . . . . . . . . . . . . . 20.2 m170 -59.87 -26.31 65.76 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.378 -0.529 . . . . 79.04 111.832 175.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 499' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -74.74 -13.2 60.57 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.564 -0.854 . . . . 98.79 112.82 177.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 500' ' ' CYS . . . . . . . . . . . . . 7.4 m -104.88 -2.71 24.32 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 113.411 0.893 . . . . 65.74 113.411 -170.009 -43.502 -53.226 -87.113 102.292 2.036 104.619 -121.448 -79.775 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' ILE . . . . . . . . . . . . . 10.8 pt -69.25 152.17 9.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.605 0 CA-C-O 121.822 0.82 . . . . 57.52 110.425 -175.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' GLY . . . . . . . . . . . . . . . -45.74 -53.79 8.33 Favored Glycine 0 N--CA 1.443 -0.861 0 N-CA-C 116.119 1.208 . . . . 55.53 116.119 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 503' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -53.4 -31.75 59.07 Favored 'Trans proline' 0 N--CA 1.477 0.521 0 CA-C-N 118.099 0.95 . . . . 54.41 113.515 -179.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -82.59 -42.4 18.31 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 112.462 0.542 . . . . 99.53 112.462 -176.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 505' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' A' ' 560' ' ' ARG . 3.8 pt -81.79 -16.05 12.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 O-C-N 121.688 -0.633 . . . . 68.78 112.175 -176.373 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 22.3 ttp -77.67 144.31 37.45 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.111 0.482 . . . . 70.64 110.88 -174.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -110.67 -138.25 7.75 Favored Glycine 0 N--CA 1.45 -0.395 0 CA-C-N 115.995 -0.548 . . . . 71.41 112.445 176.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -107.94 3.15 23.87 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.567 0.58 . . . . 96.9 112.567 177.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 28.9 p -124.32 158.32 32.89 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.386 0.675 . . . . 60.05 109.638 -174.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' CYS . . . . . . . . . . . . . 5.9 p -129.75 98.4 4.8 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 106.618 -1.623 . . . . 79.58 106.618 172.035 47.847 146.184 89.485 104.474 2.037 104.711 -63.732 -63.655 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 34.0 m -82.13 166.97 2.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.659 -0.867 . . . . 57.0 108.659 -179.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' SER . . . . . . . . . . . . . 58.9 p -68.66 160.46 30.15 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 119.386 -0.926 . . . . 60.61 109.694 173.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -65.63 -35.18 80.04 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 119.284 -0.966 . . . . 66.49 111.434 177.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -67.15 -37.04 83.12 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 119.438 -0.905 . . . . 90.39 111.184 177.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 515' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -67.61 -40.89 84.71 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 119.838 -0.745 . . . . 92.95 111.422 176.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 58.3 tp -63.23 -39.55 94.95 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 119.475 -0.89 . . . . 50.63 110.379 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -62.96 -44.74 95.21 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.154 -0.619 . . . . 52.52 111.236 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 58.0 m -64.84 -38.35 90.67 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 119.188 -1.005 . . . . 63.62 111.03 177.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -62.95 -54.23 41.76 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 120.73 0.3 . . . . 78.24 111.513 -179.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 520' ' ' LEU . . . . . . . . . . . . . 94.6 mt -66.15 -34.41 77.98 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 122.101 -0.375 . . . . 52.45 111.304 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -62.84 -46.72 86.61 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.779 -0.368 . . . . 62.68 110.501 178.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' SER . . . . . . . . . . . . . 79.3 p -65.37 -16.14 63.29 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 112.634 0.605 . . . . 65.17 112.634 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 523' ' ' LYS . . . . . . . . . . . . . 83.6 mttt -96.17 8.45 43.81 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 112.639 0.607 . . . . 69.26 112.639 174.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 524' ' ' ASN . . . . . . . . . . . . . 56.2 t30 57.33 37.58 28.14 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.453 0.701 . . . . 78.18 111.955 -177.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 525' ' ' LEU . . . . . . . . . . . . . 92.8 mt -107.21 -20.79 13.18 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 113.237 0.829 . . . . 61.35 113.237 178.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 526' ' ' VAL . . . . . . . . . . . . . 34.7 m -131.94 163.42 37.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 107.401 -1.333 . . . . 57.64 107.401 170.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 527' ' ' THR . . . . . . . . . . . . . 17.5 p -125.35 -178.88 4.37 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.648 -0.871 . . . . 64.51 108.648 178.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 528' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -65.84 -29.85 70.38 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.541 -0.863 . . . . 105.33 111.629 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -62.06 -17.96 59.13 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.459 0.54 . . . . 85.83 112.459 174.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -89.79 -7.6 54.03 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 113.109 0.781 . . . . 64.29 113.109 177.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 531' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -61.45 -31.9 71.87 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 119.384 -0.927 . . . . 92.67 111.918 -169.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 532' ' ' LYS . . . . . . . . . . . . . 23.4 pttm -57.95 -29.73 65.42 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.602 -0.439 . . . . 90.76 112.079 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 533' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -72.36 -7.42 49.51 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 113.055 0.761 . . . . 84.43 113.055 -179.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 534' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -101.93 10.91 39.33 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 112.968 0.729 . . . . 66.32 112.968 -177.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -77.64 153.84 81.12 Favored Pre-proline 0 C--N 1.317 -0.818 0 CA-C-N 118.133 0.424 . . . . 106.12 110.593 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 536' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -61.18 150.18 85.73 Favored 'Trans proline' 0 CA--C 1.519 -0.231 0 CA-C-O 121.697 0.624 . . . . 85.45 111.558 -177.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -168.54 150.25 4.95 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 107.534 -1.284 . . . . 102.36 107.534 -179.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 22.1 p -63.74 159.68 18.75 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.96 0.886 . . . . 89.54 110.303 175.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.459 HG12 ' CZ ' ' A' ' 543' ' ' PHE . 8.2 t -69.42 -34.71 63.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 115.119 -0.946 . . . . 82.78 111.041 -177.578 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -67.63 -39.8 84.64 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.001 -0.68 . . . . 109.81 111.084 178.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 541' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -67.12 -33.86 76.36 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.093 -0.643 . . . . 93.49 111.996 176.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -64.07 -43.78 94.41 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 119.952 -0.699 . . . . 56.88 110.74 171.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.459 ' CZ ' HG12 ' A' ' 539' ' ' VAL . 21.9 m-30 -51.36 -50.33 59.74 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.861 0.362 . . . . 63.05 111.064 173.724 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 544' ' ' ASN . . . . . . . . . . . . . 90.3 m-20 -67.81 -38.56 83.42 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.956 -0.698 . . . . 76.25 111.45 -176.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 545' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.59 -34.75 77.62 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.613 -0.835 . . . . 93.64 111.099 178.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 546' ' ' ILE . . . . . . . . . . . . . 92.2 mt -72.6 -49.15 43.09 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 120.415 -0.514 . . . . 70.39 110.71 175.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -75.14 -7.73 54.6 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 113.05 0.759 . . . . 83.59 113.05 -169.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 548' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -114.15 4.75 15.69 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.379 0.536 . . . . 92.12 111.98 173.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -65.8 135.46 54.9 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.197 0.523 . . . . 93.71 110.961 -176.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 550' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -105.37 -0.54 26.05 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.867 -0.606 . . . . 133.66 112.557 178.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 551' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -116.78 131.9 56.83 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.368 -0.975 . . . . 106.0 108.368 176.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 552' ' ' ALA . . . . . . . . . . . . . . . -69.07 -41.28 77.77 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.248 -0.581 . . . . 78.02 111.53 -176.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -61.94 -39.47 92.18 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 120.231 -0.587 . . . . 87.84 110.98 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 554' ' ' ARG . . . . . . . . . . . . . 65.6 ttt-85 -64.31 -44.66 90.9 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.728 0.299 . . . . 111.22 111.117 177.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 555' ' ' MET . . . . . . . . . . . . . 22.1 ttp -59.81 -44.38 94.04 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.02 0.438 . . . . 86.48 111.062 178.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 74.4 mt -61.91 -45.72 98.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 121.185 0.517 . . . . 67.44 110.772 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 40.9 tp -65.58 -43.64 89.14 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 119.636 -0.826 . . . . 52.86 111.349 -177.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 558' ' ' LEU . . . . . . . . . . . . . 94.7 mt -67.95 -36.49 80.19 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 120.242 -0.583 . . . . 57.13 111.293 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 559' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -61.65 -46.7 88.64 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.07 0.462 . . . . 52.7 110.858 172.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 560' ' ' ARG . . . . . 0.428 ' HA ' HD12 ' A' ' 505' ' ' ILE . 5.1 tpt180 -57.32 -47.45 81.51 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.083 0.468 . . . . 58.15 111.109 178.87 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 561' ' ' ILE . . . . . . . . . . . . . 93.2 mt -61.03 -48.68 87.97 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 CA-C-O 121.138 0.494 . . . . 45.8 110.429 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 562' ' ' LEU . . . . . . . . . . . . . 14.0 tp -57.7 -52.12 66.74 Favored 'General case' 0 C--O 1.235 0.337 0 O-C-N 122.237 -0.289 . . . . 57.22 111.566 -177.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 46.6 m-85 -82.34 -12.36 58.01 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.564 0.95 . . . . 60.13 113.564 -173.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 564' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -91.02 -22.25 20.87 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 118.884 0.766 . . . . 81.5 113.045 172.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 565' ' ' THR . . . . . . . . . . . . . 59.6 p -116.87 -15.53 10.65 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 114.98 1.474 . . . . 51.45 114.98 -172.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -96.2 107.56 19.91 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 119.826 1.194 . . . . 60.79 109.077 -176.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . 76.8 m -61.03 -35.86 78.02 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.647 -0.706 . . . . 59.0 112.464 -167.728 -63.655 -63.732 89.485 104.711 2.037 104.474 146.184 47.847 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 568' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -61.0 -30.86 70.54 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 118.858 -1.137 . . . . 99.95 111.766 -176.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 569' ' ' MET . . . . . . . . . . . . . 39.9 mmm -60.5 -25.56 66.18 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 119.445 -0.902 . . . . 66.52 111.816 -179.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 570' ' ' LEU . . . . . . . . . . . . . 48.9 mt -58.75 -25.92 63.47 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 120.085 -0.646 . . . . 63.97 111.952 179.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 571' ' ' SER . . . . . . . . . . . . . 20.9 m -59.42 -23.92 63.05 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.465 -0.494 . . . . 71.75 112.26 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 572' ' ' LEU . . . . . . . . . . . . . 82.5 mt -64.32 -19.29 65.34 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.858 -0.737 . . . . 67.01 112.456 -179.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 573' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -82.99 1.6 39.04 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.571 -0.852 . . . . 76.65 112.993 174.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 574' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -129.94 -164.59 1.43 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-O 122.068 0.937 . . . . 73.6 108.622 -175.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -102.62 -33.33 9.49 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.756 1.021 . . . . 89.52 113.756 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 576' ' ' SER . . . . . 0.701 ' HB2' ' O4 ' ' A' ' 803' ' ' SO4 . 74.4 m -104.2 -176.61 3.13 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.949 0.88 . . . . 97.5 109.789 -172.582 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 577' ' ' GLY . . . . . . . . . . . . . . . 110.33 150.18 12.54 Favored Glycine 0 N--CA 1.44 -1.092 0 N-CA-C 111.056 -0.817 . . . . 88.3 111.056 -177.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 578' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -60.35 -33.19 94.58 Favored 'Trans proline' 0 C--O 1.238 0.507 0 N-CA-C 113.422 0.508 . . . . 104.6 113.422 179.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -67.06 -32.54 73.79 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.344 -0.542 . . . . 107.98 111.47 179.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 580' ' ' ASN . . . . . 0.468 ' O ' ' HB2' ' A' ' 584' ' ' ARG . 27.5 m-20 -74.83 -41.72 59.37 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 120.834 -0.346 . . . . 86.0 111.263 176.924 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 581' ' ' VAL . . . . . . . . . . . . . 95.1 t -62.84 -25.85 39.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 C-N-CA 120.986 -0.285 . . . . 97.48 110.642 176.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -58.33 -71.64 0.11 Allowed 'General case' 0 C--O 1.238 0.461 0 O-C-N 121.772 -0.58 . . . . 88.91 111.101 177.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 583' ' ' TRP . . . . . . . . . . . . . 57.8 p-90 -64.45 -28.48 69.7 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 120.084 -0.646 . . . . 89.1 111.603 -179.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 584' ' ' ARG . . . . . 0.498 ' NH1' ' OE1' ' A' ' 686' ' ' GLN . 44.6 ttm-85 -63.58 -48.63 76.61 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 121.084 0.469 . . . . 108.42 111.118 -179.444 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 585' ' ' THR . . . . . 0.724 ' O ' ' HB2' ' A' ' 589' ' ' ASN . 58.2 p -72.32 -34.15 67.88 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 122.226 -0.297 . . . . 113.98 111.429 177.37 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 586' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -59.86 -37.04 78.15 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 119.34 -0.944 . . . . 111.45 110.942 175.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 587' ' ' LEU . . . . . . . . . . . . . 32.1 tp -77.35 -48.68 16.7 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.938 -0.305 . . . . 91.21 111.588 -177.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 588' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -63.43 -30.6 71.7 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 119.202 -0.999 . . . . 97.79 111.449 178.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 589' ' ' ASN . . . . . 0.724 ' HB2' ' O ' ' A' ' 585' ' ' THR . 8.8 t30 -58.26 -72.78 0.09 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.028 0.931 . . . . 121.61 111.002 -172.641 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 590' ' ' HIS . . . . . 0.668 ' O ' ' ND1' ' A' ' 590' ' ' HIS . 13.7 p80 -91.85 94.53 9.36 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 106.243 -1.762 . . . . 125.8 106.243 167.531 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 591' ' ' ASN . . . . . . . . . . . . . 35.4 t30 -70.81 -175.56 1.13 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 122.037 0.922 . . . . 112.4 109.537 -170.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 592' ' ' ILE . . . . . 0.436 ' HB ' ' CG ' ' A' ' 638' ' ' ASP . 33.5 pt -96.05 148.19 5.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 N-CA-C 108.414 -0.958 . . . . 80.29 108.414 174.535 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -64.47 -26.09 68.29 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.698 -0.683 . . . . 103.44 111.95 -174.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 49.7 tp -55.31 -33.78 63.6 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.164 -0.614 . . . . 69.17 111.632 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 595' ' ' CYS . . . . . . . . . . . . . 78.4 m -83.52 -12.88 55.68 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.604 0.965 . . . . 73.07 113.604 -171.632 -63.802 -49.353 -94.116 101.314 2.03 102.248 -62.373 -63.302 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 596' ' ' SER . . . . . . . . . . . . . 91.5 p -70.27 -45.44 66.37 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 118.798 0.727 . . . . 97.82 111.162 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 597' ' ' ARG . . . . . . . . . . . . . 60.3 mtm-85 -96.55 -11.46 25.38 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 113.341 0.867 . . . . 116.37 113.341 179.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 598' ' ' HIS . . . . . . . . . . . . . 61.5 m80 -138.06 59.84 1.64 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 122.076 0.941 . . . . 88.57 109.579 -176.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 599' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -63.93 -16.53 61.69 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 112.558 0.577 . . . . 85.73 112.558 -176.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 600' ' ' TYR . . . . . . . . . . . . . 18.7 p90 -86.56 -5.61 59.1 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 113.513 0.931 . . . . 76.97 113.513 -175.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 601' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -65.94 150.12 49.13 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 118.764 0.711 . . . . 67.02 110.61 175.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 602' ' ' MET . . . . . . . . . . . . . 39.2 mmt -58.37 -41.52 84.96 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.491 -0.777 . . . . 67.61 111.749 -174.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 603' ' ' ILE . . . . . . . . . . . . . 5.2 tp -60.5 -37.35 74.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 119.962 -0.695 . . . . 56.72 110.108 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 74.3 m -69.98 -36.18 74.98 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 121.975 -0.453 . . . . 64.92 111.612 -179.41 -63.302 -62.373 -94.116 102.248 2.03 101.314 -49.353 -63.802 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 605' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 -66.72 -38.39 86.59 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.009 -0.676 . . . . 57.77 110.663 173.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 606' ' ' CYS . . . . . . . . . . . . . 48.5 t -62.65 -45.09 94.45 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.913 0.387 . . . . 61.8 111.048 178.891 -174.449 60.259 102.128 103.33 2.045 104.891 -74.246 -68.287 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 607' ' ' ILE . . . . . . . . . . . . . 59.2 mt -71.53 -49.73 44.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 120.573 -0.451 . . . . 68.19 110.549 -178.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 608' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -82.19 -44.35 16.51 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.086 -0.646 . . . . 89.02 112.354 -168.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 609' ' ' THR . . . . . . . . . . . . . 9.4 p -109.67 5.59 23.03 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.264 0.839 . . . . 76.64 113.264 -172.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 610' ' ' HIS . . . . . . . . . . . . . 18.7 t-160 57.22 38.56 28.83 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.424 0.631 . . . . 100.98 111.23 179.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 611' ' ' SER . . . . . . . . . . . . . 2.1 t -143.42 161.07 39.35 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.244 0.545 . . . . 87.28 109.797 -173.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 60.0 mtt 59.27 36.57 23.68 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.55 -0.75 . . . . 78.88 112.088 176.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 613' ' ' CYS . . . . . . . . . . . . . 90.7 m -83.92 -6.17 59.36 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 113.959 1.096 . . . . 63.45 113.959 -176.821 -68.287 -74.246 102.128 104.891 2.045 103.33 60.259 -174.449 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 614' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -76.42 -30.67 57.52 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.644 -0.822 . . . . 109.38 112.087 -174.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 615' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -110.71 26.46 10.67 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 113.308 0.855 . . . . 97.26 113.308 -169.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 616' ' ' THR . . . . . . . . . . . . . 52.0 p -68.85 -20.92 64.3 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 113.157 0.799 . . . . 67.39 113.157 -169.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 19.5 p-10 -87.44 -19.78 27.55 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.644 0.609 . . . . 84.01 112.644 178.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 54.8 mt -74.82 118.31 20.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 109.101 -0.703 . . . . 88.28 109.101 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 619' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -105.25 98.47 8.17 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 107.507 -1.294 . . . . 100.84 107.507 179.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -68.44 116.89 9.52 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.579 -0.526 . . . . 99.64 109.579 -179.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 621' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 61.42 20.69 11.37 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 124.333 1.053 . . . . 128.21 112.6 -178.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 622' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt 60.01 40.65 18.51 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.256 0.623 . . . . 124.61 112.189 171.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 623' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -75.9 -36.61 59.41 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.788 -0.765 . . . . 109.28 111.893 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 624' ' ' ILE . . . . . . . . . . . . . 88.1 mt -67.38 -43.24 87.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 C-N-CA 119.881 -0.727 . . . . 84.69 110.434 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 625' ' ' GLU . . . . . 0.471 ' HG2' ' HE3' ' A' ' 629' ' ' LYS . 80.3 tt0 -64.03 -39.43 94.07 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.335 -0.546 . . . . 122.28 111.098 -179.326 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 92.1 m -59.0 -40.67 85.61 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.599 -0.441 . . . . 109.12 111.199 176.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -63.35 -43.87 96.47 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.852 0.358 . . . . 90.2 111.576 -176.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 628' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -74.07 -38.14 64.02 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.396 -0.522 . . . . 98.3 111.822 -169.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 629' ' ' LYS . . . . . 0.471 ' HE3' ' HG2' ' A' ' 625' ' ' GLU . 16.9 ptpt -71.57 -10.29 59.53 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.968 -0.693 . . . . 122.45 112.852 179.343 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 630' ' ' SER . . . . . . . . . . . . . 38.0 m -99.77 -14.3 18.9 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 118.539 0.609 . . . . 113.65 112.596 172.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 631' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -131.87 80.23 1.91 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.361 -1.348 . . . . 104.32 107.361 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 632' ' ' ALA . . . . . . . . . . . . . . . -68.78 -30.86 69.54 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.299 -0.56 . . . . 110.69 111.715 -178.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 633' ' ' ALA . . . . . . . . . . . . . . . -57.52 -48.17 79.99 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 120.147 -0.621 . . . . 108.59 110.943 173.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 634' ' ' ALA . . . . . . . . . . . . . . . -65.58 -30.57 71.32 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.341 -0.544 . . . . 85.92 111.622 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 635' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -65.98 -46.52 77.75 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 119.981 -0.688 . . . . 91.75 111.176 177.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 636' ' ' ARG . . . . . . . . . . . . . 67.5 mtp85 -69.6 -36.6 76.36 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 119.644 -0.823 . . . . 119.18 111.168 -179.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 637' ' ' ALA . . . . . . . . . . . . . . . -64.39 -44.72 90.44 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.598 -0.441 . . . . 90.54 111.283 177.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 638' ' ' ASP . . . . . 0.436 ' CG ' ' HB ' ' A' ' 592' ' ' ILE . 64.1 m-20 -72.58 -40.43 66.62 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 120.686 -0.405 . . . . 76.77 111.221 -176.993 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 639' ' ' LEU . . . . . . . . . . . . . 21.9 tp -60.31 -43.41 96.37 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.134 -0.626 . . . . 78.95 110.887 174.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 640' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -64.91 -40.0 94.39 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 119.685 -0.806 . . . . 103.26 111.315 177.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 18.9 m -62.28 -40.35 95.95 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.391 -0.524 . . . . 72.08 110.943 178.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 642' ' ' ILE . . . . . . . . . . . . . 25.7 mm -71.81 -42.9 69.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 C-N-CA 120.145 -0.622 . . . . 61.46 110.397 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 643' ' ' MET . . . . . . . . . . . . . 14.6 mmt -58.42 -45.34 88.65 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 121.967 -0.458 . . . . 75.12 110.76 176.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 644' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -63.92 -37.66 88.23 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.52 -0.472 . . . . 92.91 111.129 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 645' ' ' THR . . . . . . . . . . . . . 96.6 m -59.95 -47.84 84.14 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 119.899 -0.72 . . . . 62.06 110.531 175.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 646' ' ' LEU . . . . . . . . . . . . . 89.9 mt -64.67 -39.12 93.13 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.691 -0.403 . . . . 58.74 111.554 -178.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 647' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -68.13 -31.03 70.32 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.067 -0.653 . . . . 78.89 111.414 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 648' ' ' THR . . . . . . . . . . . . . 97.5 m -70.57 -41.43 72.44 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.716 -0.394 . . . . 82.73 111.1 175.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -70.3 -34.33 72.6 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.352 -0.539 . . . . 52.26 112.036 -176.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 650' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -120.31 70.13 0.88 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.11 -0.7 . . . . 51.7 109.11 -172.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 651' ' ' ARG . . . . . . . . . . . . . 48.4 mmm-85 -64.79 151.01 46.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.5 0.667 . . . . 75.04 110.486 177.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 652' ' ' GLY . . . . . . . . . . . . . . . 103.15 -135.39 12.3 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.097 -1.049 . . . . 61.39 113.652 177.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 46.7 tp -62.83 -41.93 99.53 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.592 -0.443 . . . . 58.23 111.543 -173.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 27.8 m -55.43 -45.45 76.78 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.307 -0.557 . . . . 54.95 110.8 177.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 655' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -65.77 -38.67 89.68 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 120.533 -0.467 . . . . 81.88 111.369 -179.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 656' ' ' VAL . . . . . . . . . . . . . 59.8 t -59.24 -46.65 92.09 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-O 121.197 0.522 . . . . 66.78 110.177 176.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 95.7 mt -63.49 -42.6 98.54 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 120.402 -0.519 . . . . 77.35 111.395 -179.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 658' ' ' ILE . . . . . . . . . . . . . 88.4 mt -60.19 -48.67 87.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 C-N-CA 120.319 -0.552 . . . . 73.7 110.274 -179.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 659' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -61.89 -39.36 91.71 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 119.671 -0.812 . . . . 102.99 111.4 178.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 660' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -57.78 -53.37 58.92 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.228 -0.589 . . . . 93.43 110.95 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -65.15 -37.67 88.14 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.486 -0.485 . . . . 87.4 111.688 -178.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 662' ' ' ILE . . . . . . . . . . . . . 22.2 mt -61.19 -37.32 77.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 C-N-CA 120.648 -0.421 . . . . 87.55 110.54 178.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 663' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -76.64 -33.18 58.36 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 117.693 -1.603 . . . . 136.61 112.242 177.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -79.58 -0.42 33.52 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.125 0.787 . . . . 111.82 113.125 177.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 55.36 33.93 21.83 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.183 0.593 . . . . 131.8 111.694 -175.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 666' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -93.96 90.26 6.39 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 108.683 -0.858 . . . . 99.52 108.683 -175.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 667' ' ' SER . . . . . . . . . . . . . 45.3 m -76.34 -36.55 58.16 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.991 -0.549 . . . . 97.56 111.983 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -56.83 -48.54 77.8 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.508 -0.477 . . . . 101.94 110.896 175.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 669' ' ' ALA . . . . . . . . . . . . . . . -61.94 -39.77 93.23 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 120.383 -0.527 . . . . 91.2 111.201 179.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 19.0 mt -63.06 -43.28 99.04 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.166 -0.614 . . . . 75.36 111.398 179.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 671' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -65.73 -36.05 82.47 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 119.653 -0.819 . . . . 103.98 111.255 178.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 672' ' ' ALA . . . . . . . . . . . . . . . -64.77 -42.72 94.91 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.296 -0.561 . . . . 83.66 111.221 176.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 673' ' ' LEU . . . . . . . . . . . . . 65.5 tp -63.62 -45.55 89.78 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 122.115 -0.365 . . . . 70.76 111.069 178.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 674' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -60.35 -38.95 85.41 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.467 -0.493 . . . . 69.68 110.981 177.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 675' ' ' SER . . . . . . . . . . . . . 31.4 t -63.51 -42.9 98.48 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.79 -0.364 . . . . 85.55 111.256 176.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -62.61 -42.54 99.64 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.488 -0.485 . . . . 113.39 111.348 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 677' ' ' ILE . . . . . . . . . . . . . 95.3 mt -62.45 -45.71 98.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-O 121.271 0.557 . . . . 60.72 110.178 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 678' ' ' THR . . . . . . . . . . . . . 53.6 m -49.35 -43.74 44.15 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.39 -0.368 . . . . 61.14 111.875 177.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 679' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -63.15 -19.98 64.97 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.664 0.616 . . . . 89.75 112.664 -178.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 680' ' ' SER . . . . . . . . . . . . . 47.0 m -102.83 -12.74 17.35 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 113.738 1.014 . . . . 67.97 113.738 -173.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 681' ' ' VAL . . . . . . . . . . . . . 27.6 m -126.83 39.72 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 118.788 0.722 . . . . 54.55 110.09 -175.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -60.19 -19.78 55.65 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 113.251 0.834 . . . . 99.76 113.251 -174.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 82.1 m-20 -96.53 5.14 51.4 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 118.821 0.737 . . . . 89.23 112.98 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 684' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -96.87 83.35 3.39 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 106.567 -1.642 . . . . 63.75 106.567 171.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 685' ' ' TYR . . . . . . . . . . . . . 69.9 t80 -39.81 -66.8 0.27 Allowed 'General case' 0 C--O 1.242 0.666 0 C-N-CA 127.14 2.176 . . . . 77.8 113.336 178.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 686' ' ' GLN . . . . . 0.498 ' OE1' ' NH1' ' A' ' 584' ' ' ARG . 28.7 tt0 -61.34 -41.21 96.67 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.183 -0.462 . . . . 80.09 111.593 -176.965 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 687' ' ' MET . . . . . . . . . . . . . 56.5 tpp -66.92 -34.92 78.84 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 118.993 -1.083 . . . . 61.03 111.34 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 29.5 mm -58.95 -43.02 87.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 120.301 -0.56 . . . . 63.68 110.101 171.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 689' ' ' GLY . . . . . . . . . . . . . . . -58.92 -43.89 96.46 Favored Glycine 0 C--N 1.336 0.575 0 C-N-CA 119.454 -1.355 . . . . 59.67 112.892 175.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 690' ' ' ILE . . . . . . . . . . . . . 31.0 mm -65.69 -41.3 90.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 O-C-N 122.168 -0.607 . . . . 56.68 110.68 -177.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 42.2 mt -66.85 -42.73 85.25 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.398 -0.521 . . . . 56.92 111.401 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 692' ' ' LYS . . . . . . . . . . . . . 53.3 mttm -57.89 -50.52 73.05 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 120.117 -0.633 . . . . 81.44 110.871 176.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 693' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -60.29 -36.97 79.08 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.335 -0.546 . . . . 66.32 111.416 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.75 -43.91 95.03 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.395 -0.522 . . . . 62.06 111.01 179.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 695' ' ' SER . . . . . . . . . . . . . 37.9 m -63.9 -36.94 85.58 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 119.78 -0.768 . . . . 79.08 111.062 177.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 696' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -61.95 -44.46 96.73 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.252 -0.579 . . . . 92.76 111.032 177.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 18.1 mt -59.67 -35.23 74.03 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.713 -0.395 . . . . 88.35 111.344 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 698' ' ' LEU . . . . . . . . . . . . . 87.2 mt -68.89 -30.85 69.42 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.097 -0.641 . . . . 95.42 111.414 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -64.52 -40.16 95.12 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.253 -0.579 . . . . 118.63 111.045 173.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 700' ' ' ILE . . . . . . . . . . . . . 92.3 mt -64.67 96.73 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 107.555 -1.276 . . . . 112.59 107.555 172.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 701' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 -103.43 124.15 48.19 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.914 -0.772 . . . . 147.27 108.914 -173.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 C--N 1.329 -0.312 0 O-C-N 123.366 0.416 . . . . 149.9 111.145 -176.061 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 801' ' ' NAG . . . . . 0.6 ' H3 ' ' H83' ' A' ' 801' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 802' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 803' ' ' SO4 . . . . . 0.701 ' O4 ' ' HB2' ' A' ' 576' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 804' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 805' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 806' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 807' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 901' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 902' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 903' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 904' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 905' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 906' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 907' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 909' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 910' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 911' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 912' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 913' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 914' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 915' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 916' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 917' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 918' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 919' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 920' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 921' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 922' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 923' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 924' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 925' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 926' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 927' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 928' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 929' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 930' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 931' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 932' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 933' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 934' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 935' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 936' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 937' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 938' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 939' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 940' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_