data_6gcr_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 6gcr _Structure_validation_residue.Date_analyzed 2019-04-26 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 ' 413' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? . . . . . 0 N--CA 1.464 0.256 0 CA-C-O 121.089 0.471 . . . . 61.789999999999999 111.12 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 55.7 t0 -106.68 113.04 26.29 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.707 -1.22 . . . . 56.289999999999999 107.707 175.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 415' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -86.27 -0.49 55.93 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 112.855 0.687 . . . . 54.299999999999997 112.855 177.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 416' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -69.25 132.05 45.86 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.2 -0.6 . . . . 45.479999999999997 109.394 174.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 417' ' ' ILE . . . . . . . . . . . . . 3.3 mm -120.92 134.57 63.91 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 N-CA-C 108.458 -0.941 . . . . 40.259999999999998 108.458 -176.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 418' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -69.27 131.15 44.42 Favored 'General case' 0 C--O 1.235 0.315 0 O-C-N 123.362 0.414 . . . . 52.600000000000001 111.023 171.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 419' ' ' ARG . . . . . 0.463 ' NH2' ' O ' ' A' ' 494' ' ' PRO . 44.6 ttm-85 -61.18 -29.5 69.84 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 119.653 -0.819 . . . . 40.490000000000002 111.583 -177.422 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 420' ' ' GLU . . . . . . . . . . . . . 53.2 mp0 -71.83 -11.55 60.86 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 119.649 -0.821 . . . . 45.469999999999999 112.104 -174.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 421' ' ' ARG . . . . . 0.654 ' NH2' ' O ' ' A' ' 806' ' ' HOH . 17.8 mtt180 -83.39 -13.03 55.77 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 119.992 -0.683 . . . . 41.219999999999999 112.356 174.211 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 9.5 mm -102.85 132.38 49.12 Favored 'Isoleucine or valine' 0 C--O 1.242 0.662 0 N-CA-C 109.245 -0.65 . . . . 42.759999999999998 109.245 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 423' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -116.42 108.99 16.72 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 106.417 -1.697 . . . . 56.829999999999998 106.417 173.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 424' ' ' LEU . . . . . . . . . . . . . 1.9 mp -78.86 134.54 36.93 Favored 'General case' 0 CA--C 1.506 -0.742 0 O-C-N 123.456 0.472 . . . . 42.359999999999999 110.454 -176.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -113.06 -140.66 7.8 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 119.413 -1.375 . . . . 40.729999999999997 111.286 179.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -73.84 151.67 40.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 122.216 1.008 . . . . 62.57 112.336 -171.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 427' ' ' CYS . . . . . . . . . . . . . 15.8 t -66.75 141.93 57.57 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.385 -0.825 . . . . 41.899999999999999 109.185 173.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 428' ' ' ILE . . . . . . . . . . . . . 9.9 pt -125.05 3.31 4.66 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.145 0 N-CA-C 112.898 0.703 . . . . 40.390000000000001 112.898 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 163.12 -175.35 39.45 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 110.219 -1.152 . . . . 39.909999999999997 110.219 176.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 430' ' ' GLU . . . . . . . . . . . . . 8.2 pm0 -133.15 149.97 52.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.391 -0.904 . . . . 60.469999999999999 109.492 -178.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 431' ' ' GLY . . . . . . . . . . . . . . . -133.14 178.44 18.19 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 110.115 -1.194 . . . . 47.07 110.115 171.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 432' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -50.12 -25.54 3.62 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 114.0 1.111 . . . . 64.939999999999998 114.0 -178.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 433' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -110.25 -19.78 12.88 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 114.153 1.168 . . . . 47.329999999999998 114.153 -172.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 434' ' ' GLY . . . . . . . . . . . . . . . 167.01 -175.19 42.28 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.329 -0.938 . . . . 48.899999999999999 111.529 -178.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 435' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -77.3 157.34 30.78 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 122.246 1.022 . . . . 52.270000000000003 110.684 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 436' ' ' VAL . . . . . . . . . . . . . 18.5 t -112.84 129.86 67.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 106.308 -1.738 . . . . 37.399999999999999 106.308 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 437' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -117.53 151.0 38.02 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.619 -0.882 . . . . 39.259999999999998 108.619 -177.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 438' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -86.57 171.45 11.03 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 116.182 -2.207 . . . . 43.969999999999999 108.239 160.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 439' ' ' GLY . . . . . . . . . . . . . . . 172.58 -172.58 45.05 Favored Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 110.398 -1.081 . . . . 39.390000000000001 110.398 -176.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 440' ' ' ILE . . . . . . . . . . . . . 5.3 mp -130.61 133.34 63.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 108.192 -1.04 . . . . 40.880000000000003 108.192 -170.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 441' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -103.88 120.25 40.61 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.181 -1.044 . . . . 43.869999999999997 108.181 170.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 442' ' ' MET . . . . . . . . . . . . . 44.8 mtm -100.38 142.68 31.53 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 124.028 0.931 . . . . 43.350000000000001 110.535 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 443' ' ' SER . . . . . . . . . . . . . 66.0 p -140.16 137.82 18.51 Favored Pre-proline 0 C--O 1.24 0.567 0 C-N-CA 119.915 -0.714 . . . . 47.520000000000003 109.637 174.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 444' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -44.08 132.13 8.61 Favored 'Trans proline' 0 C--O 1.238 0.521 0 C-N-CA 120.853 1.036 . . . . 47.57 111.646 175.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 445' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 69.76 6.99 6.0 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 126.267 1.827 . . . . 66.760000000000005 114.164 168.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 446' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -136.7 150.93 71.57 Favored Pre-proline 0 C--O 1.241 0.629 0 CA-C-N 119.328 0.967 . . . . 61.68 110.17 -172.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 447' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -64.61 151.81 84.19 Favored 'Trans proline' 0 C--O 1.234 0.316 0 CA-C-O 122.01 0.754 . . . . 50.869999999999997 112.546 -170.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -65.32 140.7 58.7 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.176 -0.92 . . . . 46.799999999999997 110.054 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 449' ' ' MET . . . . . . . . . . . . . 40.8 ttp -113.66 125.22 53.9 Favored 'General case' 0 CA--C 1.523 -0.076 0 C-N-CA 123.452 0.701 . . . . 45.630000000000003 109.748 -175.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 450' ' ' ALA . . . . . . . . . . . . . . . -75.48 135.81 40.67 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 119.047 -1.061 . . . . 37.270000000000003 109.834 178.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 451' ' ' VAL . . . . . . . . . . . . . 22.9 m -138.93 160.18 29.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-O 121.961 0.886 . . . . 33.149999999999999 109.952 -174.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 452' ' ' ALA . . . . . . . . . . . . . . . -109.81 139.98 44.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.7 -1.137 . . . . 31.739999999999998 107.969 169.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 3.2 mp -124.44 112.86 33.94 Favored 'Isoleucine or valine' 0 C--O 1.239 0.546 0 N-CA-C 108.766 -0.828 . . . . 35.350000000000001 108.766 -172.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 454' ' ' LYS . . . . . 0.486 ' NZ ' ' OE1' ' A' ' 471' ' ' GLU . 50.6 mtpt -80.63 124.54 29.07 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.213 -0.662 . . . . 35.380000000000003 109.213 169.663 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 30.8 p -105.27 159.31 15.98 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.001 -0.74 . . . . 40.729999999999997 109.001 173.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 456' ' ' CYS . . . . . 0.583 ' SG ' ' SG ' ' A' ' 459' ' ' CYS . 42.7 t -131.14 118.67 20.81 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.148 -0.933 . . . . 50.57 111.738 -179.929 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 457' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -66.64 -41.91 87.55 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 116.434 2.013 . . . . 63.299999999999997 116.434 -179.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 458' ' ' ASN . . . . . . . . . . . . . . . -101.49 21.68 13.87 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 116.779 2.14 . . . . 57.780000000000001 116.779 -176.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 459' ' ' CYS . . . . . 0.583 ' SG ' ' SG ' ' A' ' 456' ' ' CYS . 1.0 OUTLIER -63.9 -18.57 64.33 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 118.332 2.716 . . . . 56.049999999999997 118.332 -178.24 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 4.1 p -58.34 -33.12 69.18 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 118.388 -1.325 . . . . 63.409999999999997 110.993 -179.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 1.1 p -77.65 131.78 37.92 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 122.51 0.324 . . . . 59.899999999999999 110.178 177.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -64.07 -25.85 68.29 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.807 -0.633 . . . . 71.0 112.467 -172.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 463' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.67 -41.92 25.86 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 118.253 -1.379 . . . . 52.82 111.061 -176.355 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 464' ' ' VAL . . . . . . . . . . . . . 48.2 t -63.66 -44.91 98.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 C-N-CA 120.014 -0.675 . . . . 56.399999999999999 110.114 172.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -58.68 -37.82 76.87 Favored 'General case' 0 C--O 1.237 0.401 0 O-C-N 121.959 -0.463 . . . . 65.159999999999997 111.97 -177.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 466' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -74.84 -29.29 61.01 Favored 'General case' 0 C--O 1.241 0.654 0 C-N-CA 119.157 -1.017 . . . . 71.049999999999997 110.971 -178.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -69.62 -45.93 67.4 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.921 0.391 . . . . 51.969999999999999 110.676 173.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 55.1 t80 -56.33 -54.47 45.11 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 122.758 0.423 . . . . 47.200000000000003 111.47 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 44.6 mt -67.47 -23.91 65.55 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 112.6 0.593 . . . . 43.719999999999999 112.6 -176.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 470' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -63.65 -22.55 66.96 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 118.511 -1.275 . . . . 51.840000000000003 110.761 176.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 471' ' ' GLU . . . . . 0.486 ' OE1' ' NZ ' ' A' ' 454' ' ' LYS . 91.3 mt-10 -71.49 -37.74 71.25 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 118.343 -1.343 . . . . 47.729999999999997 111.849 179.39 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -61.96 -44.26 97.13 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 120.179 -0.608 . . . . 36.530000000000001 111.256 172.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 6.9 mt -62.17 -35.85 80.07 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.233 -0.587 . . . . 44.020000000000003 111.264 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 17.3 m -60.42 -47.39 86.32 Favored 'General case' 0 C--N 1.335 -0.057 0 C-N-CA 120.196 -0.602 . . . . 40.020000000000003 111.178 171.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 475' ' ' MET . . . . . . . . . . . . . 56.8 mmm -69.18 -26.81 65.03 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 118.594 -1.242 . . . . 38.82 111.452 179.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 476' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -60.12 -27.36 66.98 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 112.004 0.372 . . . . 48.409999999999997 112.004 179.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 477' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -67.39 -18.9 65.31 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 113.07 0.766 . . . . 59.909999999999997 113.07 -175.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 478' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -113.0 148.38 35.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 122.426 1.108 . . . . 38.670000000000002 112.717 -167.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -146.5 98.42 3.07 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 106.228 -1.768 . . . . 46.920000000000002 106.228 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 480' ' ' HIS . . . . . . . . . . . . . 61.8 t-80 -157.01 141.09 11.72 Favored Pre-proline 0 N--CA 1.442 -0.863 0 N-CA-C 108.288 -1.004 . . . . 35.5 108.288 -174.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -55.87 -35.45 93.98 Favored 'Trans proline' 0 C--O 1.237 0.471 0 N-CA-C 114.294 0.844 . . . . 33.479999999999997 114.294 -178.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 482' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -106.98 26.18 10.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 121.755 -0.591 . . . . 33.399999999999999 112.077 -169.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 483' ' ' ILE . . . . . . . . . . . . . 53.0 mt -129.59 137.77 55.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 107.45 -1.315 . . . . 30.699999999999999 107.45 167.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 5.1 m -60.1 137.2 22.84 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 C-N-CA 119.824 -0.75 . . . . 36.630000000000003 109.756 179.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 485' ' ' LYS . . . . . 0.447 ' CG ' ' O ' ' A' ' 854' ' ' HOH . 12.5 mtmm -96.32 142.37 28.53 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.958 -0.565 . . . . 48.960000000000001 110.948 179.221 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 20.5 tp -74.06 140.82 45.63 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.102 -1.073 . . . . 35.280000000000001 108.102 173.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 487' ' ' ILE . . . . . . . . . . . . . 44.2 mm -98.62 -55.83 5.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 N-CA-C 109.666 -0.494 . . . . 34.5 109.666 177.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 488' ' ' GLY . . . . . . . . . . . . . . . -171.71 -179.1 42.5 Favored Glycine 0 CA--C 1.505 -0.531 0 N-CA-C 108.585 -1.806 . . . . 32.960000000000001 108.585 178.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 35.4 m -128.77 160.15 39.72 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-O 122.241 1.019 . . . . 39.960000000000001 109.44 172.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 2.5 mt -117.24 123.13 71.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 105.447 -2.057 . . . . 40.039999999999999 105.447 167.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 1.6 p -97.91 -16.45 19.73 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 119.561 -0.856 . . . . 50.18 113.157 -173.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -82.1 134.71 35.35 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.902 -0.777 . . . . 60.299999999999997 108.902 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 493' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 -63.92 141.28 98.0 Favored Pre-proline 0 N--CA 1.451 -0.425 0 CA-C-N 115.678 -0.692 . . . . 58.939999999999998 110.211 -172.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 494' ' ' PRO . . . . . 0.463 ' O ' ' NH2' ' A' ' 419' ' ' ARG . 61.1 Cg_endo -71.07 140.12 62.52 Favored 'Cis proline' 0 C--N 1.351 0.694 0 C-N-CA 123.011 -1.662 . . . . 42.729999999999997 112.813 -4.027 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 49.2 t -79.87 137.09 22.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.64 0 N-CA-C 109.05 -0.722 . . . . 43.560000000000002 109.05 -176.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 496' ' ' TRP . . . . . . . . . . . . . 49.0 m0 -131.72 141.93 49.67 Favored 'General case' 0 C--N 1.345 0.398 0 C-N-CA 124.245 1.018 . . . . 39.57 111.08 -177.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 497' ' ' ILE . . . . . . . . . . . . . 25.7 mt -108.56 122.86 63.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 108.005 -1.109 . . . . 36.229999999999997 108.005 172.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 498' ' ' ILE . . . . . . . . . . . . . 4.9 mm -100.89 123.21 53.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 107.933 -1.136 . . . . 33.780000000000001 107.933 -177.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 499' ' ' MET . . . . . . . . . . . . . 47.8 mmm -120.7 166.78 13.23 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.19 0.519 . . . . 35.390000000000001 109.9 175.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 500' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.49 143.32 58.0 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.843 -0.617 . . . . 38.159999999999997 109.729 170.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 14.5 tp -85.17 129.5 34.79 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.06 -0.518 . . . . 31.449999999999999 110.823 171.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' CYS . . . . . . . . . . . . . 59.4 m -94.86 105.02 16.92 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 105.619 -1.993 . . . . 27.640000000000001 105.619 157.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 6.4 t -80.86 -6.99 59.33 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 113.929 1.085 . . . . 36.619999999999997 113.929 -161.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 11.4 mt -96.71 -1.65 46.08 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 119.332 0.969 . . . . 36.549999999999997 112.498 177.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . 92.31 -153.81 21.96 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 114.818 0.687 . . . . 31.489999999999998 114.818 167.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -81.14 145.01 31.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.616 0.246 . . . . 47.329999999999998 110.831 -173.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 32.6 tp -60.43 -47.84 84.34 Favored 'General case' 0 C--N 1.347 0.485 0 N-CA-C 112.434 0.531 . . . . 34.270000000000003 112.434 -173.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 508' ' ' ARG . . . . . 0.681 ' NH1' ' O ' ' A' ' 805' ' ' HOH . 35.9 mtp180 -59.8 -55.67 31.4 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 121.006 0.431 . . . . 41.799999999999997 111.025 -172.805 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' SER . . . . . . . . . . . . . 8.3 t -54.61 -44.47 73.13 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.123 -0.489 . . . . 54.469999999999999 110.596 177.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -53.52 -44.76 69.4 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.365 -0.534 . . . . 33.82 111.409 175.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 76.9 mt -69.8 -43.27 72.43 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.591 0.589 . . . . 38.219999999999999 112.591 -175.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -56.87 -46.2 81.98 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 119.652 -0.819 . . . . 45.869999999999997 111.597 179.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' VAL . . . . . . . . . . . . . 10.3 m -86.69 -19.29 8.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 C-N-CA 119.811 -0.756 . . . . 43.409999999999997 112.691 -172.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -103.05 24.88 10.12 Favored 'General case' 0 C--O 1.235 0.295 0 O-C-N 120.969 -1.082 . . . . 49.950000000000003 111.925 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.1 ttmt -57.54 -60.27 3.92 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.869 0.366 . . . . 56.799999999999997 111.552 -175.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 516' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -67.68 0.07 3.55 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 113.84 1.052 . . . . 48.780000000000001 113.84 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 73.0 m -109.62 -11.17 14.79 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 113.813 1.042 . . . . 52.560000000000002 113.813 -178.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 11.3 mt -110.55 157.12 19.99 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.793 0.806 . . . . 46.75 110.012 177.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -107.9 173.25 6.4 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.307 -0.86 . . . . 55.009999999999998 109.488 174.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 520' ' ' LEU . . . . . . . . . . . . . 37.5 tp -56.91 -33.2 66.7 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.524 -1.217 . . . . 42.579999999999998 111.788 170.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.95 -35.85 81.49 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.812 -0.755 . . . . 43.289999999999999 111.107 179.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' SER . . . . . . . . . . . . . 50.7 m -67.49 -43.66 80.41 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.252 -0.579 . . . . 43.780000000000001 110.591 -179.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 25.0 mt -63.37 -39.5 94.69 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.324 -0.55 . . . . 36.789999999999999 110.985 -177.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 524' ' ' ILE . . . . . . . . . . . . . 11.2 mt -68.89 -34.08 62.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 C-N-CA 118.125 -1.43 . . . . 37.57 110.037 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 525' ' ' LEU . . . . . . . . . . . . . 54.0 tp -54.36 -48.55 71.35 Favored 'General case' 0 C--O 1.236 0.346 0 O-C-N 121.879 -0.513 . . . . 36.170000000000002 112.169 172.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 526' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -57.2 -44.86 84.04 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 119.773 -0.771 . . . . 31.600000000000001 110.852 179.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -62.54 -43.37 98.99 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 120.489 -0.484 . . . . 32.740000000000002 110.687 -179.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -60.82 -39.82 90.45 Favored 'General case' 0 C--O 1.242 0.705 0 C-N-CA 119.947 -0.701 . . . . 41.369999999999997 111.44 175.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 529' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -68.25 -43.1 78.63 Favored 'General case' 0 C--N 1.347 0.494 0 C-N-CA 119.332 -0.947 . . . . 34.200000000000003 110.682 -178.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 530' ' ' LEU . . . . . . . . . . . . . 94.9 mt -64.74 -29.7 70.69 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 119.628 -0.829 . . . . 31.27 110.919 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 79.0 p -70.62 -40.26 73.24 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 120.413 -0.515 . . . . 36.490000000000002 111.297 -178.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 532' ' ' THR . . . . . . . . . . . . . 22.6 p -56.53 -46.05 80.82 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 120.661 -0.415 . . . . 34.909999999999997 111.101 173.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -58.33 -42.45 86.81 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.753 -0.379 . . . . 34.899999999999999 110.851 176.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 534' ' ' LEU . . . . . . . . . . . . . 30.4 mt -79.8 -34.44 39.64 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 120.05 -0.66 . . . . 37.649999999999999 112.197 -173.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 535' ' ' ALA . . . . . . . . . . . . . . . -58.84 -50.54 73.6 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.547 -0.861 . . . . 43.030000000000001 110.334 167.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 536' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -47.46 -47.46 27.12 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 120.194 -0.602 . . . . 39.140000000000001 111.248 176.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 75.0 mt -69.77 -27.27 64.78 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 119.711 -0.795 . . . . 42.75 110.927 -177.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -71.62 -34.61 69.97 Favored 'General case' 0 C--O 1.238 0.478 0 O-C-N 123.195 0.309 . . . . 50.409999999999997 110.812 176.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 54.6 p -70.64 -30.73 67.43 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 119.417 -0.913 . . . . 47.659999999999997 110.556 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 540' ' ' LYS . . . . . . . . . . . . . 4.6 tptm -80.13 3.83 19.26 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.785 0.834 . . . . 55.579999999999998 112.028 171.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 541' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 52.07 35.63 16.81 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.487 0.715 . . . . 60.979999999999997 111.599 -179.471 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 542' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -96.9 141.07 30.53 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.71 0.804 . . . . 45.93 109.976 174.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 53.5 t -116.06 118.16 57.87 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 N-CA-C 107.834 -1.173 . . . . 40.899999999999999 107.834 -175.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 544' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 -75.05 -55.09 6.1 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.984 -0.553 . . . . 38.390000000000001 111.346 -170.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 81.04 -5.76 1.65 Allowed 'General case' 0 C--O 1.242 0.698 0 C-N-CA 127.987 2.515 . . . . 49.810000000000002 112.611 177.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -144.92 51.53 1.23 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 119.709 1.14 . . . . 44.950000000000003 111.104 -172.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 547' ' ' ILE . . . . . . . . . . . . . 15.2 mt -81.54 133.55 29.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 107.836 -1.172 . . . . 33.310000000000002 107.836 171.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -177.06 145.73 0.48 Allowed 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 105.427 -2.064 . . . . 31.640000000000001 105.427 -175.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -56.66 -32.21 65.16 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.23 -0.988 . . . . 28.210000000000001 112.117 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 550' ' ' ARG . . . . . 0.461 ' NH1' ' O ' ' A' ' 813' ' ' HOH . 4.3 ptp85 -59.25 -18.65 39.07 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 112.723 0.638 . . . . 40.539999999999999 112.723 -179.602 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -104.13 2.86 32.4 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 123.845 0.858 . . . . 31.68 112.792 -174.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 57.5 t -97.17 141.13 16.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.619 0 C-N-CA 124.771 1.228 . . . . 26.050000000000001 108.15 177.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 31.5 mt -118.73 162.36 18.56 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.418 -0.586 . . . . 25.32 109.418 -178.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 554' ' ' VAL . . . . . . . . . . . . . 61.6 t -116.74 114.82 47.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.092 -0.707 . . . . 27.059999999999999 109.092 -174.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 11.8 t -90.96 -24.63 20.08 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.87 0.868 . . . . 40.82 112.017 178.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -170.64 160.58 7.21 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 106.914 -1.513 . . . . 29.5 106.914 -176.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 20.6 p -57.23 -18.84 17.84 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.252 -0.579 . . . . 32.649999999999999 112.032 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 40.2 p-10 -119.35 22.24 11.84 Favored 'General case' 0 C--O 1.237 0.396 0 O-C-N 121.994 -0.441 . . . . 43.509999999999998 111.886 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 559' ' ' CYS . . . . . . . . . . . . . 4.5 t -153.12 114.42 4.19 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.347 0.594 . . . . 33.829999999999998 109.66 -175.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 5.1 m -120.74 161.44 20.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 107.424 -1.324 . . . . 28.75 107.424 172.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 19.0 mttt -145.66 146.81 31.45 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.43 -0.805 . . . . 35.039999999999999 109.949 -172.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 562' ' ' LEU . . . . . . . . . . . . . 23.8 mt -64.25 127.08 29.91 Favored 'General case' 0 C--O 1.23 0.07 0 N-CA-C 109.244 -0.65 . . . . 31.530000000000001 109.244 167.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 563' ' ' GLY . . . . . . . . . . . . . . . -70.87 -166.97 6.97 Favored Glycine 0 N--CA 1.443 -0.869 0 CA-C-O 123.505 1.614 . . . . 31.780000000000001 114.225 178.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 564' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -65.32 125.1 24.03 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 113.96 -1.12 . . . . 37.390000000000001 109.279 -176.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -57.74 -34.57 69.66 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.966 -0.561 . . . . 39.719999999999999 111.955 -176.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 566' ' ' GLY . . . . . . . . . . . . . . . -73.02 -37.86 56.02 Favored Glycine 0 C--N 1.336 0.572 0 C-N-CA 120.376 -0.916 . . . . 39.259999999999998 112.65 -178.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 567' ' ' LEU . . . . . . . . . . . . . 51.7 mt -70.48 -13.29 62.06 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.416 0.525 . . . . 38.630000000000003 112.416 176.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 69.1 m -81.35 -16.94 50.83 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 113.091 0.774 . . . . 40.280000000000001 113.091 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 569' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 . . . . . 0 C--N 1.323 -0.554 0 C-N-CA 118.856 -1.138 . . . . 55.770000000000003 109.739 -175.654 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 584' ' ' LEU . . . . . . . . . . . . . 8.2 mt . . . . . 0 C--O 1.241 0.606 0 CA-C-O 121.187 0.518 . . . . 54.130000000000003 112.257 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -77.73 61.32 7.5 Favored 'Trans proline' 0 C--N 1.332 -0.299 0 C-N-CA 120.431 0.754 . . . . 41.420000000000002 111.44 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 586' ' ' ILE . . . . . . . . . . . . . 44.2 mm -49.75 -48.69 21.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.361 -0.836 . . . . 39.140000000000001 111.109 -168.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 587' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -67.52 -6.96 22.16 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 119.269 -0.972 . . . . 43.020000000000003 113.522 -172.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 588' ' ' TRP . . . . . . . . . . . . . 19.3 m-90 -104.67 -12.84 16.18 Favored 'General case' 0 C--O 1.241 0.656 0 N-CA-C 113.988 1.107 . . . . 31.559999999999999 113.988 175.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 589' ' ' MET . . . . . . . . . . . . . 78.2 mtp -88.38 144.92 26.09 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 114.303 1.223 . . . . 40.140000000000001 114.303 -163.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 590' ' ' ALA . . . . . . . . . . . . . . . -60.2 157.07 35.3 Favored Pre-proline 0 C--O 1.237 0.431 0 CA-C-N 115.283 -0.871 . . . . 38.030000000000001 110.681 174.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 591' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -60.15 -43.73 33.72 Favored 'Trans proline' 0 C--O 1.241 0.664 0 N-CA-C 113.385 0.494 . . . . 40.18 113.385 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 592' ' ' GLU . . . . . 0.534 ' OE1' ' NH1' ' A' ' 666' ' ' ARG . 24.9 pm0 -62.84 -29.07 70.46 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 118.109 0.413 . . . . 42.079999999999998 111.58 177.643 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 593' ' ' SER . . . . . . . . . . . . . 2.2 m -67.29 -37.52 83.53 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.441 0.162 . . . . 39.369999999999997 111.057 176.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 594' ' ' ILE . . . . . . . . . . . . . 75.8 mt -80.83 -45.23 21.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-O 120.906 0.384 . . . . 43.450000000000003 110.79 -175.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 595' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -74.35 -32.35 62.76 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 113.988 1.106 . . . . 44.729999999999997 113.988 -177.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 596' ' ' PHE . . . . . 0.443 ' O ' ' O ' ' A' ' 801' ' ' HOH . 10.8 m-85 -133.98 6.37 3.65 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 119.056 0.844 . . . . 45.469999999999999 113.183 -168.844 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 597' ' ' ARG . . . . . . . . . . . . . . . 48.96 36.69 8.81 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 118.503 0.592 . . . . 42.780000000000001 111.993 -173.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 598' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -90.41 133.57 34.92 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.111 -0.699 . . . . 46.990000000000002 109.111 174.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 599' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -137.76 108.13 6.49 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 107.764 -1.199 . . . . 43.299999999999997 107.764 -172.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 600' ' ' THR . . . . . . . . . . . . . 28.0 p -134.74 178.51 6.95 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.444 -0.946 . . . . 42.899999999999999 108.444 -171.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 601' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -64.16 -34.51 78.24 Favored 'General case' 0 CA--C 1.511 -0.528 0 C-N-CA 118.325 -1.35 . . . . 46.159999999999997 110.78 175.346 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 602' ' ' ALA . . . . . . . . . . . . . . . -62.55 -36.42 82.57 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 121.072 -0.251 . . . . 36.859999999999999 111.548 175.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 603' ' ' SER . . . . . . . . . . . . . 99.6 p -74.44 -30.51 61.92 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.083 -1.047 . . . . 36.920000000000002 110.308 -179.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 604' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -58.63 -39.95 81.97 Favored 'General case' 0 C--O 1.242 0.673 0 O-C-N 123.346 0.404 . . . . 36.859999999999999 111.13 169.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 605' ' ' VAL . . . . . . . . . . . . . 42.7 t -60.9 -37.67 77.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 CA-C-O 120.75 0.31 . . . . 34.57 111.079 179.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 606' ' ' TRP . . . . . 0.426 ' CZ3' ' O ' ' A' ' 659' ' ' TRP . 7.6 t-105 -62.77 -60.05 4.03 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 121.655 -0.653 . . . . 36.740000000000002 110.215 176.611 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 30.3 mtp -40.56 -49.91 2.96 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 113.444 0.905 . . . . 36.75 113.444 172.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 608' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -58.97 -33.9 71.18 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 122.094 -0.379 . . . . 32.979999999999997 111.883 -179.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 609' ' ' GLY . . . . . . . . . . . . . . . -68.27 -34.73 81.09 Favored Glycine 0 C--N 1.334 0.428 0 C-N-CA 119.817 -1.182 . . . . 31.609999999999999 111.608 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 610' ' ' VAL . . . . . . . . . . . . . 87.8 t -68.24 -44.55 83.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-O 121.198 0.523 . . . . 30.100000000000001 110.211 175.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 46.8 t -56.28 -45.97 79.92 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.201 0.524 . . . . 30.649999999999999 111.752 171.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 2.2 ttm -61.55 -37.66 84.59 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 118.424 -1.31 . . . . 53.93 111.547 178.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 613' ' ' TRP . . . . . . . . . . . . . 90.9 t90 -61.17 -50.45 73.08 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.199 -0.6 . . . . 32.780000000000001 110.089 175.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 614' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -47.85 -37.25 13.46 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 112.555 0.576 . . . . 34.149999999999999 112.555 177.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 615' ' ' ILE . . . . . . . . . . . . . 76.7 mt -77.83 -41.73 28.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 C-N-CA 118.99 -1.084 . . . . 36.049999999999997 110.495 -172.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 616' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.66 -21.1 66.2 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 120.206 -0.598 . . . . 43.859999999999999 111.285 173.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 617' ' ' MET . . . . . . . . . . . . . 77.7 mmm -94.39 5.55 51.45 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 124.766 1.226 . . . . 37.670000000000002 112.858 176.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 618' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 62.78 38.84 11.41 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.619 0.723 . . . . 44.130000000000003 111.383 171.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 619' ' ' GLY . . . . . . . . . . . . . . . 88.39 16.0 59.5 Favored Glycine 0 N--CA 1.443 -0.873 0 N-CA-C 116.224 1.25 . . . . 36.689999999999998 116.224 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 620' ' ' VAL . . . . . . . . . . . . . 61.2 t -75.37 143.69 12.96 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.196 0 CA-C-N 118.788 1.294 . . . . 36.909999999999997 108.508 170.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 621' ' ' LYS . . . . . . . . . . . . . 74.3 mttt -83.65 144.92 46.41 Favored Pre-proline 0 C--O 1.237 0.421 0 C-N-CA 122.977 0.511 . . . . 50.32 110.928 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 622' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -69.08 144.49 57.86 Favored 'Trans proline' 0 C--O 1.237 0.434 0 CA-C-O 121.536 0.557 . . . . 32.759999999999998 110.988 174.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 623' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 55.2 42.94 30.07 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 122.175 0.988 . . . . 42.740000000000002 111.783 172.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 624' ' ' GLN . . . . . 0.456 ' O ' ' O ' ' A' ' 802' ' ' HOH . 9.6 tt0 -56.22 131.32 47.58 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 114.985 -1.007 . . . . 49.369999999999997 109.195 172.416 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 625' ' ' GLY . . . . . . . . . . . . . . . 82.95 -17.16 23.61 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 115.552 0.981 . . . . 52.960000000000001 115.552 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 626' ' ' VAL . . . . . . . . . . . . . 93.1 t -82.16 146.71 6.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 118.449 1.124 . . . . 49.829999999999998 108.743 174.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 6.7 tttt -81.13 153.35 27.32 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.856 -0.424 . . . . 56.770000000000003 109.856 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 628' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -65.74 -38.47 89.22 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 112.354 0.502 . . . . 49.390000000000001 112.354 -175.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -73.85 -14.63 61.11 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.84 0.681 . . . . 56.990000000000002 112.84 -175.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 630' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -93.95 -12.14 29.43 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 124.401 1.081 . . . . 53.920000000000002 113.509 176.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 631' ' ' VAL . . . . . . . . . . . . . 13.3 t -63.61 -45.52 97.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-N 118.621 0.646 . . . . 47.810000000000002 110.261 -175.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 632' ' ' ILE . . . . . . . . . . . . . 6.8 tp -59.21 -35.04 55.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.819 -0.352 . . . . 48.479999999999997 110.581 -176.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 633' ' ' GLY . . . . . . . . . . . . . . . -67.51 -48.72 55.56 Favored Glycine 0 C--N 1.335 0.499 0 C-N-CA 119.962 -1.113 . . . . 50.469999999999999 112.447 177.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 12.3 mtt180 -59.23 -33.47 71.04 Favored 'General case' 0 C--O 1.241 0.637 0 O-C-N 122.401 -0.47 . . . . 58.450000000000003 111.969 177.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 635' ' ' ILE . . . . . . . . . . . . . 7.7 mt -78.25 -37.91 22.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 C-N-CA 120.863 -0.335 . . . . 46.100000000000001 110.601 179.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 636' ' ' GLU . . . . . 0.422 ' OE1' ' OH ' ' A' ' 661' ' ' TYR . 43.9 mm-40 -61.07 -38.45 86.28 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 122.036 -0.415 . . . . 60.270000000000003 111.231 174.878 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -69.6 -19.39 63.65 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 112.664 0.616 . . . . 64.879999999999995 112.664 178.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 638' ' ' GLY . . . . . . . . . . . . . . . 111.04 -6.32 29.01 Favored Glycine 0 C--O 1.237 0.322 0 CA-C-O 118.904 -0.942 . . . . 50.289999999999999 114.39 176.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 639' ' ' GLU . . . . . . . . . . . . . 69.8 tt0 -52.32 142.94 15.92 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 119.155 1.478 . . . . 53.850000000000001 110.391 171.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 640' ' ' ARG . . . . . . . . . . . . . 85.8 mmt-85 -144.47 153.73 42.19 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 108.152 -1.055 . . . . 43.460000000000001 108.152 178.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 641' ' ' LEU . . . . . 0.474 ' O ' ' OH ' ' A' ' 652' ' ' TYR . 38.9 mt -52.83 134.97 46.91 Favored Pre-proline 0 C--O 1.244 0.773 0 O-C-N 124.076 0.86 . . . . 33.740000000000002 109.978 177.893 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 642' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -76.09 169.8 21.34 Favored 'Trans proline' 0 C--N 1.324 -0.744 0 CA-C-O 122.312 0.88 . . . . 41.07 111.387 -173.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 643' ' ' MET . . . . . . . . . . . . . 10.7 ttp -69.25 125.82 92.25 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 114.622 -1.172 . . . . 42.969999999999999 109.485 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -69.52 141.27 45.74 Favored 'Trans proline' 0 C--O 1.244 0.811 0 C-N-CA 120.459 0.772 . . . . 43.219999999999999 110.898 -178.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 645' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -49.65 125.39 14.06 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 120.199 0.599 . . . . 53.060000000000002 111.258 173.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 646' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 69.68 31.22 3.66 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.932 0.893 . . . . 62.990000000000002 112.342 175.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 647' ' ' CYS . . . . . . . . . . . . . 1.3 t -102.26 129.71 25.66 Favored Pre-proline 0 C--N 1.292 -1.918 0 N-CA-C 108.817 -0.808 . . . . 48.829999999999998 108.817 167.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 648' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -61.75 149.7 88.92 Favored 'Trans proline' 0 C--O 1.249 1.074 0 C-N-CA 121.161 1.24 . . . . 50.520000000000003 110.714 -176.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 649' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -62.47 -36.73 64.13 Favored 'Trans proline' 0 C--O 1.237 0.443 0 CA-C-N 118.122 0.365 . . . . 50.25 112.798 179.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 650' ' ' THR . . . . . . . . . . . . . 3.2 t -63.53 -29.7 70.93 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 119.678 -0.809 . . . . 55.920000000000002 111.434 179.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 651' ' ' LEU . . . . . . . . . . . . . 30.2 tp -74.4 -45.01 49.51 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.404 -0.518 . . . . 49.579999999999998 111.265 176.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 652' ' ' TYR . . . . . 0.474 ' OH ' ' O ' ' A' ' 641' ' ' LEU . 58.1 t80 -63.35 -45.52 90.83 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 120.54 -0.464 . . . . 46.140000000000001 110.607 177.744 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 653' ' ' SER . . . . . . . . . . . . . 12.6 t -45.27 -48.69 12.88 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 120.849 0.357 . . . . 52.640000000000001 110.696 169.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 654' ' ' LEU . . . . . . . . . . . . . 30.3 tp -56.32 -48.33 76.94 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.719 0.295 . . . . 47.100000000000001 111.102 177.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 655' ' ' MET . . . . . . . . . . . . . 8.0 mtp -57.82 -55.47 34.49 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.892 -0.323 . . . . 38.450000000000003 111.606 179.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 656' ' ' THR . . . . . . . . . . . . . 29.8 p -54.87 -24.33 22.73 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 119.864 -0.735 . . . . 40.609999999999999 111.807 -177.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 657' ' ' LYS . . . . . 0.469 ' NZ ' ' O ' ' A' ' 814' ' ' HOH . 22.6 mttp -76.17 -29.1 57.6 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 119.572 -0.851 . . . . 47.799999999999997 111.781 176.896 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 658' ' ' CYS . . . . . 0.481 ' O ' ' CD ' ' A' ' 666' ' ' ARG . 21.4 m -68.94 -21.34 64.2 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 112.022 0.379 . . . . 42.689999999999998 112.022 170.401 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 659' ' ' TRP . . . . . 0.426 ' O ' ' CZ3' ' A' ' 606' ' ' TRP . 27.2 m0 -95.53 12.55 29.12 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.898 1.073 . . . . 40.369999999999997 113.898 -177.665 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 660' ' ' ALA . . . . . 0.73 ' O ' ' NH2' ' A' ' 666' ' ' ARG . . . -60.65 135.94 57.91 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 107.869 -1.16 . . . . 42.490000000000002 107.869 179.398 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 661' ' ' TYR . . . . . 0.422 ' OH ' ' OE1' ' A' ' 636' ' ' GLU . 40.4 t80 -62.6 -39.74 94.7 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 109.7 -0.482 . . . . 46.469999999999999 109.7 -179.683 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 662' ' ' ASP . . . . . . . . . . . . . 45.9 t0 -78.79 122.16 84.36 Favored Pre-proline 0 N--CA 1.447 -0.608 0 N-CA-C 106.486 -1.672 . . . . 55.509999999999998 106.486 179.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 663' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -62.87 -31.37 77.72 Favored 'Trans proline' 0 C--N 1.385 2.479 0 C-N-CA 114.393 -3.271 . . . . 47.579999999999998 112.129 -179.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 9.2 m -61.71 -23.33 66.05 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.759 0.652 . . . . 50.899999999999999 112.759 -175.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 665' ' ' ARG . . . . . . . . . . . . . 57.6 mtp180 -99.44 15.8 25.24 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 113.092 0.775 . . . . 69.739999999999995 113.092 -177.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 666' ' ' ARG . . . . . 0.73 ' NH2' ' O ' ' A' ' 660' ' ' ALA . 45.1 mtm-85 -96.77 134.95 22.48 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 108.886 -0.783 . . . . 46.649999999999999 108.886 176.919 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 667' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -52.99 159.68 5.02 Favored 'Trans proline' 0 C--N 1.332 -0.319 0 CA-C-O 122.253 0.855 . . . . 39.770000000000003 111.728 179.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 668' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 -91.07 157.21 17.37 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 119.59 -0.844 . . . . 62.909999999999997 109.301 168.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 669' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -58.53 -30.48 67.13 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 118.987 -1.085 . . . . 43.329999999999998 111.363 -175.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 6.6 t -66.11 -34.69 78.63 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 120.048 -0.661 . . . . 52.359999999999999 111.073 178.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 671' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.4 -37.55 68.66 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 119.793 -0.763 . . . . 59.240000000000002 110.207 177.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 33.1 mt -63.08 -44.5 95.59 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 116.324 -0.398 . . . . 45.719999999999999 110.881 179.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 673' ' ' LYS . . . . . 0.72 ' NZ ' ' O ' ' A' ' 803' ' ' HOH . 26.2 ttpt -57.76 -45.67 85.6 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 120.533 -0.467 . . . . 42.899999999999999 111.31 177.871 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 674' ' ' ALA . . . . . . . . . . . . . . . -65.75 -42.21 91.21 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.169 -1.012 . . . . 48.829999999999998 110.967 -178.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 675' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -68.15 -44.32 76.27 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 119.501 -0.88 . . . . 57.289999999999999 111.382 -178.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 60.0 mt -62.06 -32.3 72.82 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 120.354 -0.538 . . . . 43.390000000000001 111.711 177.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 677' ' ' SER . . . . . . . . . . . . . 8.6 t -63.6 -42.68 98.23 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 120.454 -0.499 . . . . 48.140000000000001 110.741 178.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 678' ' ' THR . . . . . . . . . . . . . 91.9 m -63.45 -47.66 80.95 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 111.854 0.316 . . . . 50.079999999999998 111.854 173.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 73.1 mt -60.65 -33.57 55.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 C-N-CA 120.483 -0.487 . . . . 49.93 111.412 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 680' ' ' LEU . . . . . . . . . . . . . 6.9 tt -70.28 -51.92 26.83 Favored 'General case' 0 C--O 1.24 0.603 0 O-C-N 121.614 -0.678 . . . . 47.380000000000003 111.072 176.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -47.42 -47.52 26.66 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.92 0.39 . . . . 66.269999999999996 111.325 179.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -63.96 -39.16 93.51 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.201 0.445 . . . . 65.019999999999996 112.201 -179.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 683' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -78.56 -26.4 45.58 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 119.372 -0.931 . . . . 54.979999999999997 111.628 -172.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 684' ' ' LYS . . . . . . . . . . . . . 7.3 ttpt . . . . . 0 CA--C 1.543 0.71 0 CA-C-O 122.469 1.128 . . . . 66.189999999999998 113.808 -170.662 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 701' ' ' EUW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 801' ' ' HOH . . . . . 0.443 ' O ' ' O ' ' A' ' 596' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 802' ' ' HOH . . . . . 0.456 ' O ' ' O ' ' A' ' 624' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 803' ' ' HOH . . . . . 0.72 ' O ' ' NZ ' ' A' ' 673' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 804' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 805' ' ' HOH . . . . . 0.681 ' O ' ' NH1' ' A' ' 508' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 806' ' ' HOH . . . . . 0.654 ' O ' ' NH2' ' A' ' 421' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 807' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 808' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 809' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 810' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 811' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 812' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 813' ' ' HOH . . . . . 0.461 ' O ' ' NH1' ' A' ' 550' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 814' ' ' HOH . . . . . 0.469 ' O ' ' NZ ' ' A' ' 657' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 815' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 816' ' ' HOH . . . . . 0.426 ' O ' ' NE ' ' A' ' 508' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 817' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 818' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 819' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 820' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 821' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 822' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 823' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 824' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 825' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 826' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 827' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 828' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 829' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 830' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 831' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 832' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 833' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 834' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 835' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 836' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 837' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 838' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 839' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 840' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 841' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 842' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 843' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 844' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 845' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 846' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 847' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 848' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 849' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 850' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 851' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 852' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 853' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 854' ' ' HOH . . . . . 0.447 ' O ' ' CG ' ' A' ' 485' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 855' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 856' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 857' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 858' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 859' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 860' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 861' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 862' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 863' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 864' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 865' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 866' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 413' ' ' ARG . . . . . 0.688 ' HA ' ' HE ' ' A' ' 413' ' ' ARG . 1.1 mmp_? . . . . . 0 N--CA 1.464 0.256 0 CA-C-O 121.089 0.471 . . . . 61.79 111.12 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 55.7 t0 -106.68 113.04 26.29 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.707 -1.22 . . . . 56.29 107.707 175.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 415' ' ' TYR . . . . . 0.41 ' CE2' ' HD2' ' A' ' 476' ' ' ARG . 78.8 m-85 -86.27 -0.49 55.93 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 112.855 0.687 . . . . 54.3 112.855 177.071 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 416' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -69.25 132.05 45.86 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.2 -0.6 . . . . 45.48 109.394 174.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 417' ' ' ILE . . . . . . . . . . . . . 3.3 mm -120.92 134.57 63.91 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 N-CA-C 108.458 -0.941 . . . . 40.26 108.458 -176.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 418' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -69.27 131.15 44.42 Favored 'General case' 0 C--O 1.235 0.315 0 O-C-N 123.362 0.414 . . . . 52.6 111.023 171.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 419' ' ' ARG . . . . . . . . . . . . . 44.6 ttm-85 -61.18 -29.5 69.84 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 119.653 -0.819 . . . . 40.49 111.583 -177.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 420' ' ' GLU . . . . . . . . . . . . . 53.2 mp0 -71.83 -11.55 60.86 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 119.649 -0.821 . . . . 45.47 112.104 -174.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 421' ' ' ARG . . . . . 0.632 ' NH2' ' O ' ' A' ' 806' ' ' HOH . 17.8 mtt180 -83.39 -13.03 55.77 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 119.992 -0.683 . . . . 41.22 112.356 174.211 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 9.5 mm -102.85 132.38 49.12 Favored 'Isoleucine or valine' 0 C--O 1.242 0.662 0 N-CA-C 109.245 -0.65 . . . . 42.76 109.245 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 423' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -116.42 108.99 16.72 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 106.417 -1.697 . . . . 56.83 106.417 173.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 424' ' ' LEU . . . . . . . . . . . . . 1.9 mp -78.86 134.54 36.93 Favored 'General case' 0 CA--C 1.506 -0.742 0 O-C-N 123.456 0.472 . . . . 42.36 110.454 -176.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -113.06 -140.66 7.8 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 119.413 -1.375 . . . . 40.73 111.286 179.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -73.84 151.67 40.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 122.216 1.008 . . . . 62.57 112.336 -171.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 427' ' ' CYS . . . . . . . . . . . . . 15.8 t -66.75 141.93 57.57 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.385 -0.825 . . . . 41.9 109.185 173.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 428' ' ' ILE . . . . . . . . . . . . . 9.9 pt -125.05 3.31 4.66 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.145 0 N-CA-C 112.898 0.703 . . . . 40.39 112.898 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 163.12 -175.35 39.45 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 110.219 -1.152 . . . . 39.91 110.219 176.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 430' ' ' GLU . . . . . . . . . . . . . 8.2 pm0 -133.15 149.97 52.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.391 -0.904 . . . . 60.47 109.492 -178.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 431' ' ' GLY . . . . . . . . . . . . . . . -133.14 178.44 18.19 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 110.115 -1.194 . . . . 47.07 110.115 171.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 432' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -50.12 -25.54 3.62 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 114.0 1.111 . . . . 64.94 114.0 -178.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 433' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -110.25 -19.78 12.88 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 114.153 1.168 . . . . 47.33 114.153 -172.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 434' ' ' GLY . . . . . 0.716 ' HA2' ' HD2' ' A' ' 457' ' ' LYS . . . 167.01 -175.19 42.28 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.329 -0.938 . . . . 48.9 111.529 -178.182 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 435' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -77.3 157.34 30.78 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 122.246 1.022 . . . . 52.27 110.684 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 436' ' ' VAL . . . . . . . . . . . . . 18.5 t -112.84 129.86 67.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 106.308 -1.738 . . . . 37.4 106.308 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 437' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -117.53 151.0 38.02 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.619 -0.882 . . . . 39.26 108.619 -177.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 438' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -86.57 171.45 11.03 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 116.182 -2.207 . . . . 43.97 108.239 160.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 439' ' ' GLY . . . . . . . . . . . . . . . 172.58 -172.58 45.05 Favored Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 110.398 -1.081 . . . . 39.39 110.398 -176.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 440' ' ' ILE . . . . . 0.444 ' CG2' ' HB1' ' A' ' 448' ' ' ALA . 5.3 mp -130.61 133.34 63.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 108.192 -1.04 . . . . 40.88 108.192 -170.363 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 441' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -103.88 120.25 40.61 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.181 -1.044 . . . . 43.87 108.181 170.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 442' ' ' MET . . . . . . . . . . . . . 44.8 mtm -100.38 142.68 31.53 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 124.028 0.931 . . . . 43.35 110.535 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 443' ' ' SER . . . . . . . . . . . . . 66.0 p -140.16 137.82 18.51 Favored Pre-proline 0 C--O 1.24 0.567 0 C-N-CA 119.915 -0.714 . . . . 47.52 109.637 174.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 444' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -44.08 132.13 8.61 Favored 'Trans proline' 0 C--O 1.238 0.521 0 C-N-CA 120.853 1.036 . . . . 47.57 111.646 175.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 445' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 69.76 6.99 6.0 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 126.267 1.827 . . . . 66.76 114.164 168.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 446' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -136.7 150.93 71.57 Favored Pre-proline 0 C--O 1.241 0.629 0 CA-C-N 119.328 0.967 . . . . 61.68 110.17 -172.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 447' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -64.61 151.81 84.19 Favored 'Trans proline' 0 C--O 1.234 0.316 0 CA-C-O 122.01 0.754 . . . . 50.87 112.546 -170.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 448' ' ' ALA . . . . . 0.444 ' HB1' ' CG2' ' A' ' 440' ' ' ILE . . . -65.32 140.7 58.7 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.176 -0.92 . . . . 46.8 110.054 177.31 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 449' ' ' MET . . . . . . . . . . . . . 40.8 ttp -113.66 125.22 53.9 Favored 'General case' 0 CA--C 1.523 -0.076 0 C-N-CA 123.452 0.701 . . . . 45.63 109.748 -175.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 450' ' ' ALA . . . . . . . . . . . . . . . -75.48 135.81 40.67 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 119.047 -1.061 . . . . 37.27 109.834 178.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 451' ' ' VAL . . . . . . . . . . . . . 22.9 m -138.93 160.18 29.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-O 121.961 0.886 . . . . 33.15 109.952 -174.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 452' ' ' ALA . . . . . . . . . . . . . . . -109.81 139.98 44.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.7 -1.137 . . . . 31.74 107.969 169.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 453' ' ' ILE . . . . . 0.409 HG23 HD13 ' A' ' 498' ' ' ILE . 3.2 mp -124.44 112.86 33.94 Favored 'Isoleucine or valine' 0 C--O 1.239 0.546 0 N-CA-C 108.766 -0.828 . . . . 35.35 108.766 -172.605 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 50.6 mtpt -80.63 124.54 29.07 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.213 -0.662 . . . . 35.38 109.213 169.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 30.8 p -105.27 159.31 15.98 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.001 -0.74 . . . . 40.73 109.001 173.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 456' ' ' CYS . . . . . 0.547 ' SG ' ' SG ' ' A' ' 459' ' ' CYS . 42.7 t -131.14 118.67 20.81 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.148 -0.933 . . . . 50.57 111.738 -179.929 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 457' ' ' LYS . . . . . 0.716 ' HD2' ' HA2' ' A' ' 434' ' ' GLY . 3.3 mtpt -66.64 -41.91 87.55 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 116.434 2.013 . . . . 63.3 116.434 -179.856 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 458' ' ' ASN . . . . . . . . . . . . . . . -101.49 21.68 13.87 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 116.779 2.14 . . . . 57.78 116.779 -176.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 459' ' ' CYS . . . . . 0.547 ' SG ' ' SG ' ' A' ' 456' ' ' CYS . 1.0 OUTLIER -63.9 -18.57 64.33 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 118.332 2.716 . . . . 56.05 118.332 -178.24 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 460' ' ' THR . . . . . 0.479 HG22 HD22 ' A' ' 493' ' ' ASN . 4.1 p -58.34 -33.12 69.18 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 118.388 -1.325 . . . . 63.41 110.993 -179.797 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 1.1 p -77.65 131.78 37.92 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 122.51 0.324 . . . . 59.9 110.178 177.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -64.07 -25.85 68.29 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.807 -0.633 . . . . 71.0 112.467 -172.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 463' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.67 -41.92 25.86 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 118.253 -1.379 . . . . 52.82 111.061 -176.355 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 464' ' ' VAL . . . . . . . . . . . . . 48.2 t -63.66 -44.91 98.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 C-N-CA 120.014 -0.675 . . . . 56.4 110.114 172.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -58.68 -37.82 76.87 Favored 'General case' 0 C--O 1.237 0.401 0 O-C-N 121.959 -0.463 . . . . 65.16 111.97 -177.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 466' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -74.84 -29.29 61.01 Favored 'General case' 0 C--O 1.241 0.654 0 C-N-CA 119.157 -1.017 . . . . 71.05 110.971 -178.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -69.62 -45.93 67.4 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.921 0.391 . . . . 51.97 110.676 173.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 55.1 t80 -56.33 -54.47 45.11 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 122.758 0.423 . . . . 47.2 111.47 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 44.6 mt -67.47 -23.91 65.55 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 112.6 0.593 . . . . 43.72 112.6 -176.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 470' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -63.65 -22.55 66.96 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 118.511 -1.275 . . . . 51.84 110.761 176.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 471' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -71.49 -37.74 71.25 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 118.343 -1.343 . . . . 47.73 111.849 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -61.96 -44.26 97.13 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 120.179 -0.608 . . . . 36.53 111.256 172.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 6.9 mt -62.17 -35.85 80.07 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.233 -0.587 . . . . 44.02 111.264 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 17.3 m -60.42 -47.39 86.32 Favored 'General case' 0 C--N 1.335 -0.057 0 C-N-CA 120.196 -0.602 . . . . 40.02 111.178 171.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 475' ' ' MET . . . . . . . . . . . . . 56.8 mmm -69.18 -26.81 65.03 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 118.594 -1.242 . . . . 38.82 111.452 179.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 476' ' ' ARG . . . . . 0.41 ' HD2' ' CE2' ' A' ' 415' ' ' TYR . 12.8 ttp180 -60.12 -27.36 66.98 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 112.004 0.372 . . . . 48.41 112.004 179.299 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 477' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -67.39 -18.9 65.31 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 113.07 0.766 . . . . 59.91 113.07 -175.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 478' ' ' PHE . . . . . 0.629 ' HE1' ' HG2' ' A' ' 540' ' ' LYS . 55.7 m-85 -113.0 148.38 35.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 122.426 1.108 . . . . 38.67 112.717 -167.108 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -146.5 98.42 3.07 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 106.228 -1.768 . . . . 46.92 106.228 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 480' ' ' HIS . . . . . . . . . . . . . 61.8 t-80 -157.01 141.09 11.72 Favored Pre-proline 0 N--CA 1.442 -0.863 0 N-CA-C 108.288 -1.004 . . . . 35.5 108.288 -174.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -55.87 -35.45 93.98 Favored 'Trans proline' 0 C--O 1.237 0.471 0 N-CA-C 114.294 0.844 . . . . 33.48 114.294 -178.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 482' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -106.98 26.18 10.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 121.755 -0.591 . . . . 33.4 112.077 -169.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 483' ' ' ILE . . . . . . . . . . . . . 53.0 mt -129.59 137.77 55.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 107.45 -1.315 . . . . 30.7 107.45 167.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 5.1 m -60.1 137.2 22.84 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 C-N-CA 119.824 -0.75 . . . . 36.63 109.756 179.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 485' ' ' LYS . . . . . 0.823 ' HG3' ' O ' ' A' ' 854' ' ' HOH . 12.5 mtmm -96.32 142.37 28.53 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.958 -0.565 . . . . 48.96 110.948 179.221 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 20.5 tp -74.06 140.82 45.63 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.102 -1.073 . . . . 35.28 108.102 173.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 487' ' ' ILE . . . . . . . . . . . . . 44.2 mm -98.62 -55.83 5.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 N-CA-C 109.666 -0.494 . . . . 34.5 109.666 177.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 488' ' ' GLY . . . . . . . . . . . . . . . -171.71 -179.1 42.5 Favored Glycine 0 CA--C 1.505 -0.531 0 N-CA-C 108.585 -1.806 . . . . 32.96 108.585 178.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 35.4 m -128.77 160.15 39.72 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-O 122.241 1.019 . . . . 39.96 109.44 172.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 2.5 mt -117.24 123.13 71.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 105.447 -2.057 . . . . 40.04 105.447 167.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 1.6 p -97.91 -16.45 19.73 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 119.561 -0.856 . . . . 50.18 113.157 -173.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -82.1 134.71 35.35 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.902 -0.777 . . . . 60.3 108.902 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 493' ' ' ASN . . . . . 0.479 HD22 HG22 ' A' ' 460' ' ' THR . 8.3 m-20 -63.92 141.28 98.0 Favored Pre-proline 0 N--CA 1.451 -0.425 0 CA-C-N 115.678 -0.692 . . . . 58.94 110.211 -172.096 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 494' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.07 140.12 62.52 Favored 'Cis proline' 0 C--N 1.351 0.694 0 C-N-CA 123.011 -1.662 . . . . 42.73 112.813 -4.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 49.2 t -79.87 137.09 22.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.64 0 N-CA-C 109.05 -0.722 . . . . 43.56 109.05 -176.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 496' ' ' TRP . . . . . . . . . . . . . 49.0 m0 -131.72 141.93 49.67 Favored 'General case' 0 C--N 1.345 0.398 0 C-N-CA 124.245 1.018 . . . . 39.57 111.08 -177.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 497' ' ' ILE . . . . . . . . . . . . . 25.7 mt -108.56 122.86 63.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 108.005 -1.109 . . . . 36.23 108.005 172.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 498' ' ' ILE . . . . . 0.409 HD13 HG23 ' A' ' 453' ' ' ILE . 4.9 mm -100.89 123.21 53.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 107.933 -1.136 . . . . 33.78 107.933 -177.509 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 499' ' ' MET . . . . . . . . . . . . . 47.8 mmm -120.7 166.78 13.23 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.19 0.519 . . . . 35.39 109.9 175.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 500' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.49 143.32 58.0 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.843 -0.617 . . . . 38.16 109.729 170.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 14.5 tp -85.17 129.5 34.79 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.06 -0.518 . . . . 31.45 110.823 171.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 502' ' ' CYS . . . . . . . . . . . . . 59.4 m -94.86 105.02 16.92 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 105.619 -1.993 . . . . 27.64 105.619 157.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 6.4 t -80.86 -6.99 59.33 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 113.929 1.085 . . . . 36.62 113.929 -161.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 11.4 mt -96.71 -1.65 46.08 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 119.332 0.969 . . . . 36.55 112.498 177.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . 92.31 -153.81 21.96 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 114.818 0.687 . . . . 31.49 114.818 167.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -81.14 145.01 31.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.616 0.246 . . . . 47.33 110.831 -173.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 507' ' ' LEU . . . . . 0.416 HD22 HG11 ' A' ' 552' ' ' VAL . 32.6 tp -60.43 -47.84 84.34 Favored 'General case' 0 C--N 1.347 0.485 0 N-CA-C 112.434 0.531 . . . . 34.27 112.434 -173.009 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 35.9 mtp180 -59.8 -55.67 31.4 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 121.006 0.431 . . . . 41.8 111.025 -172.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 509' ' ' SER . . . . . . . . . . . . . 8.3 t -54.61 -44.47 73.13 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.123 -0.489 . . . . 54.47 110.596 177.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 510' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -53.52 -44.76 69.4 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.365 -0.534 . . . . 33.82 111.409 175.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 76.9 mt -69.8 -43.27 72.43 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.591 0.589 . . . . 38.22 112.591 -175.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 512' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -56.87 -46.2 81.98 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 119.652 -0.819 . . . . 45.87 111.597 179.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 513' ' ' VAL . . . . . . . . . . . . . 10.3 m -86.69 -19.29 8.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 C-N-CA 119.811 -0.756 . . . . 43.41 112.691 -172.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -103.05 24.88 10.12 Favored 'General case' 0 C--O 1.235 0.295 0 O-C-N 120.969 -1.082 . . . . 49.95 111.925 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 515' ' ' LYS . . . . . 0.416 ' HB2' ' HE3' ' A' ' 515' ' ' LYS . 20.1 ttmt -57.54 -60.27 3.92 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.869 0.366 . . . . 56.8 111.552 -175.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 516' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -67.68 0.07 3.55 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 113.84 1.052 . . . . 48.78 113.84 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 73.0 m -109.62 -11.17 14.79 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 113.813 1.042 . . . . 52.56 113.813 -178.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 11.3 mt -110.55 157.12 19.99 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.793 0.806 . . . . 46.75 110.012 177.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -107.9 173.25 6.4 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.307 -0.86 . . . . 55.01 109.488 174.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 520' ' ' LEU . . . . . . . . . . . . . 37.5 tp -56.91 -33.2 66.7 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.524 -1.217 . . . . 42.58 111.788 170.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.95 -35.85 81.49 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.812 -0.755 . . . . 43.29 111.107 179.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 522' ' ' SER . . . . . . . . . . . . . 50.7 m -67.49 -43.66 80.41 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.252 -0.579 . . . . 43.78 110.591 -179.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 25.0 mt -63.37 -39.5 94.69 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.324 -0.55 . . . . 36.79 110.985 -177.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 524' ' ' ILE . . . . . . . . . . . . . 11.2 mt -68.89 -34.08 62.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 C-N-CA 118.125 -1.43 . . . . 37.57 110.037 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 525' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 529' ' ' GLN . 54.0 tp -54.36 -48.55 71.35 Favored 'General case' 0 C--O 1.236 0.346 0 O-C-N 121.879 -0.513 . . . . 36.17 112.169 172.218 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 526' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -57.2 -44.86 84.04 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 119.773 -0.771 . . . . 31.6 110.852 179.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -62.54 -43.37 98.99 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 120.489 -0.484 . . . . 32.74 110.687 -179.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 528' ' ' TYR . . . . . 0.461 ' O ' HG23 ' A' ' 532' ' ' THR . 64.3 t80 -60.82 -39.82 90.45 Favored 'General case' 0 C--O 1.242 0.705 0 C-N-CA 119.947 -0.701 . . . . 41.37 111.44 175.462 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 529' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' A' ' 525' ' ' LEU . 89.5 mt-30 -68.25 -43.1 78.63 Favored 'General case' 0 C--N 1.347 0.494 0 C-N-CA 119.332 -0.947 . . . . 34.2 110.682 -178.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 530' ' ' LEU . . . . . . . . . . . . . 94.9 mt -64.74 -29.7 70.69 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 119.628 -0.829 . . . . 31.27 110.919 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 79.0 p -70.62 -40.26 73.24 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 120.413 -0.515 . . . . 36.49 111.297 -178.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 532' ' ' THR . . . . . 0.618 HG22 ' HD3' ' A' ' 673' ' ' LYS . 22.6 p -56.53 -46.05 80.82 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 120.661 -0.415 . . . . 34.91 111.101 173.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -58.33 -42.45 86.81 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.753 -0.379 . . . . 34.9 110.851 176.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 534' ' ' LEU . . . . . . . . . . . . . 30.4 mt -79.8 -34.44 39.64 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 120.05 -0.66 . . . . 37.65 112.197 -173.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 535' ' ' ALA . . . . . . . . . . . . . . . -58.84 -50.54 73.6 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.547 -0.861 . . . . 43.03 110.334 167.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 536' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -47.46 -47.46 27.12 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 120.194 -0.602 . . . . 39.14 111.248 176.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 75.0 mt -69.77 -27.27 64.78 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 119.711 -0.795 . . . . 42.75 110.927 -177.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -71.62 -34.61 69.97 Favored 'General case' 0 C--O 1.238 0.478 0 O-C-N 123.195 0.309 . . . . 50.41 110.812 176.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 54.6 p -70.64 -30.73 67.43 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 119.417 -0.913 . . . . 47.66 110.556 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 540' ' ' LYS . . . . . 0.629 ' HG2' ' HE1' ' A' ' 478' ' ' PHE . 4.6 tptm -80.13 3.83 19.26 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.785 0.834 . . . . 55.58 112.028 171.899 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 541' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 52.07 35.63 16.81 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.487 0.715 . . . . 60.98 111.599 -179.471 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 542' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -96.9 141.07 30.53 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.71 0.804 . . . . 45.93 109.976 174.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 543' ' ' VAL . . . . . 0.482 HG12 ' HG3' ' A' ' 545' ' ' ARG . 53.5 t -116.06 118.16 57.87 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 N-CA-C 107.834 -1.173 . . . . 40.9 107.834 -175.256 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 544' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 -75.05 -55.09 6.1 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.984 -0.553 . . . . 38.39 111.346 -170.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 545' ' ' ARG . . . . . 0.482 ' HG3' HG12 ' A' ' 543' ' ' VAL . 10.1 mtp85 81.04 -5.76 1.65 Allowed 'General case' 0 C--O 1.242 0.698 0 C-N-CA 127.987 2.515 . . . . 49.81 112.611 177.823 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -144.92 51.53 1.23 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 119.709 1.14 . . . . 44.95 111.104 -172.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 547' ' ' ILE . . . . . . . . . . . . . 15.2 mt -81.54 133.55 29.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 107.836 -1.172 . . . . 33.31 107.836 171.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -177.06 145.73 0.48 Allowed 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 105.427 -2.064 . . . . 31.64 105.427 -175.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -56.66 -32.21 65.16 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.23 -0.988 . . . . 28.21 112.117 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 550' ' ' ARG . . . . . 0.434 ' NH1' ' O ' ' A' ' 813' ' ' HOH . 4.3 ptp85 -59.25 -18.65 39.07 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 112.723 0.638 . . . . 40.54 112.723 -179.602 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -104.13 2.86 32.4 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 123.845 0.858 . . . . 31.68 112.792 -174.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 552' ' ' VAL . . . . . 0.416 HG11 HD22 ' A' ' 507' ' ' LEU . 57.5 t -97.17 141.13 16.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.619 0 C-N-CA 124.771 1.228 . . . . 26.05 108.15 177.662 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 31.5 mt -118.73 162.36 18.56 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.418 -0.586 . . . . 25.32 109.418 -178.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 554' ' ' VAL . . . . . . . . . . . . . 61.6 t -116.74 114.82 47.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.092 -0.707 . . . . 27.06 109.092 -174.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 11.8 t -90.96 -24.63 20.08 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.87 0.868 . . . . 40.82 112.017 178.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -170.64 160.58 7.21 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 106.914 -1.513 . . . . 29.5 106.914 -176.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 20.6 p -57.23 -18.84 17.84 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.252 -0.579 . . . . 32.65 112.032 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 40.2 p-10 -119.35 22.24 11.84 Favored 'General case' 0 C--O 1.237 0.396 0 O-C-N 121.994 -0.441 . . . . 43.51 111.886 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 559' ' ' CYS . . . . . . . . . . . . . 4.5 t -153.12 114.42 4.19 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.347 0.594 . . . . 33.83 109.66 -175.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 5.1 m -120.74 161.44 20.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 107.424 -1.324 . . . . 28.75 107.424 172.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 19.0 mttt -145.66 146.81 31.45 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.43 -0.805 . . . . 35.04 109.949 -172.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 562' ' ' LEU . . . . . . . . . . . . . 23.8 mt -64.25 127.08 29.91 Favored 'General case' 0 C--O 1.23 0.07 0 N-CA-C 109.244 -0.65 . . . . 31.53 109.244 167.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 563' ' ' GLY . . . . . . . . . . . . . . . -70.87 -166.97 6.97 Favored Glycine 0 N--CA 1.443 -0.869 0 CA-C-O 123.505 1.614 . . . . 31.78 114.225 178.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 564' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -65.32 125.1 24.03 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 113.96 -1.12 . . . . 37.39 109.279 -176.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -57.74 -34.57 69.66 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.966 -0.561 . . . . 39.72 111.955 -176.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 566' ' ' GLY . . . . . . . . . . . . . . . -73.02 -37.86 56.02 Favored Glycine 0 C--N 1.336 0.572 0 C-N-CA 120.376 -0.916 . . . . 39.26 112.65 -178.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 567' ' ' LEU . . . . . . . . . . . . . 51.7 mt -70.48 -13.29 62.06 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.416 0.525 . . . . 38.63 112.416 176.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 69.1 m -81.35 -16.94 50.83 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 113.091 0.774 . . . . 40.28 113.091 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 569' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 . . . . . 0 C--N 1.323 -0.554 0 C-N-CA 118.856 -1.138 . . . . 55.77 109.739 -175.654 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 584' ' ' LEU . . . . . . . . . . . . . 8.2 mt . . . . . 0 C--O 1.241 0.606 0 CA-C-O 121.187 0.518 . . . . 54.13 112.257 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -77.73 61.32 7.5 Favored 'Trans proline' 0 C--N 1.332 -0.299 0 C-N-CA 120.431 0.754 . . . . 41.42 111.44 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 586' ' ' ILE . . . . . . . . . . . . . 44.2 mm -49.75 -48.69 21.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.361 -0.836 . . . . 39.14 111.109 -168.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 587' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -67.52 -6.96 22.16 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 119.269 -0.972 . . . . 43.02 113.522 -172.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 588' ' ' TRP . . . . . . . . . . . . . 19.3 m-90 -104.67 -12.84 16.18 Favored 'General case' 0 C--O 1.241 0.656 0 N-CA-C 113.988 1.107 . . . . 31.56 113.988 175.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 589' ' ' MET . . . . . . . . . . . . . 78.2 mtp -88.38 144.92 26.09 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 114.303 1.223 . . . . 40.14 114.303 -163.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 590' ' ' ALA . . . . . . . . . . . . . . . -60.2 157.07 35.3 Favored Pre-proline 0 C--O 1.237 0.431 0 CA-C-N 115.283 -0.871 . . . . 38.03 110.681 174.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 591' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -60.15 -43.73 33.72 Favored 'Trans proline' 0 C--O 1.241 0.664 0 N-CA-C 113.385 0.494 . . . . 40.18 113.385 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 592' ' ' GLU . . . . . 0.534 ' OE1' ' NH1' ' A' ' 666' ' ' ARG . 24.9 pm0 -62.84 -29.07 70.46 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 118.109 0.413 . . . . 42.08 111.58 177.643 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 593' ' ' SER . . . . . . . . . . . . . 2.2 m -67.29 -37.52 83.53 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.441 0.162 . . . . 39.37 111.057 176.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 594' ' ' ILE . . . . . . . . . . . . . 75.8 mt -80.83 -45.23 21.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-O 120.906 0.384 . . . . 43.45 110.79 -175.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 595' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -74.35 -32.35 62.76 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 113.988 1.106 . . . . 44.73 113.988 -177.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 596' ' ' PHE . . . . . 0.443 ' O ' ' O ' ' A' ' 801' ' ' HOH . 10.8 m-85 -133.98 6.37 3.65 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 119.056 0.844 . . . . 45.47 113.183 -168.844 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 597' ' ' ARG . . . . . . . . . . . . . . . 48.96 36.69 8.81 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 118.503 0.592 . . . . 42.78 111.993 -173.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 598' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -90.41 133.57 34.92 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.111 -0.699 . . . . 46.99 109.111 174.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 599' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -137.76 108.13 6.49 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 107.764 -1.199 . . . . 43.3 107.764 -172.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 600' ' ' THR . . . . . . . . . . . . . 28.0 p -134.74 178.51 6.95 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.444 -0.946 . . . . 42.9 108.444 -171.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 601' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -64.16 -34.51 78.24 Favored 'General case' 0 CA--C 1.511 -0.528 0 C-N-CA 118.325 -1.35 . . . . 46.16 110.78 175.346 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 602' ' ' ALA . . . . . . . . . . . . . . . -62.55 -36.42 82.57 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 121.072 -0.251 . . . . 36.86 111.548 175.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 603' ' ' SER . . . . . . . . . . . . . 99.6 p -74.44 -30.51 61.92 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.083 -1.047 . . . . 36.92 110.308 -179.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 604' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -58.63 -39.95 81.97 Favored 'General case' 0 C--O 1.242 0.673 0 O-C-N 123.346 0.404 . . . . 36.86 111.13 169.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 605' ' ' VAL . . . . . . . . . . . . . 42.7 t -60.9 -37.67 77.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 CA-C-O 120.75 0.31 . . . . 34.57 111.079 179.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 606' ' ' TRP . . . . . 0.426 ' CZ3' ' O ' ' A' ' 659' ' ' TRP . 7.6 t-105 -62.77 -60.05 4.03 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 121.655 -0.653 . . . . 36.74 110.215 176.611 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 30.3 mtp -40.56 -49.91 2.96 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 113.444 0.905 . . . . 36.75 113.444 172.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 608' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -58.97 -33.9 71.18 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 122.094 -0.379 . . . . 32.98 111.883 -179.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 609' ' ' GLY . . . . . . . . . . . . . . . -68.27 -34.73 81.09 Favored Glycine 0 C--N 1.334 0.428 0 C-N-CA 119.817 -1.182 . . . . 31.61 111.608 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 610' ' ' VAL . . . . . . . . . . . . . 87.8 t -68.24 -44.55 83.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-O 121.198 0.523 . . . . 30.1 110.211 175.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 46.8 t -56.28 -45.97 79.92 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.201 0.524 . . . . 30.65 111.752 171.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 612' ' ' MET . . . . . 0.412 ' HE2' ' HB2' ' A' ' 612' ' ' MET . 2.2 ttm -61.55 -37.66 84.59 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 118.424 -1.31 . . . . 53.93 111.547 178.557 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 613' ' ' TRP . . . . . . . . . . . . . 90.9 t90 -61.17 -50.45 73.08 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.199 -0.6 . . . . 32.78 110.089 175.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 614' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -47.85 -37.25 13.46 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 112.555 0.576 . . . . 34.15 112.555 177.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 615' ' ' ILE . . . . . . . . . . . . . 76.7 mt -77.83 -41.73 28.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 C-N-CA 118.99 -1.084 . . . . 36.05 110.495 -172.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 616' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.66 -21.1 66.2 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 120.206 -0.598 . . . . 43.86 111.285 173.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 617' ' ' MET . . . . . 0.402 ' O ' HG23 ' A' ' 620' ' ' VAL . 77.7 mmm -94.39 5.55 51.45 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 124.766 1.226 . . . . 37.67 112.858 176.416 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 618' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 62.78 38.84 11.41 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.619 0.723 . . . . 44.13 111.383 171.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 619' ' ' GLY . . . . . . . . . . . . . . . 88.39 16.0 59.5 Favored Glycine 0 N--CA 1.443 -0.873 0 N-CA-C 116.224 1.25 . . . . 36.69 116.224 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 620' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 617' ' ' MET . 61.2 t -75.37 143.69 12.96 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.196 0 CA-C-N 118.788 1.294 . . . . 36.91 108.508 170.689 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 621' ' ' LYS . . . . . . . . . . . . . 74.3 mttt -83.65 144.92 46.41 Favored Pre-proline 0 C--O 1.237 0.421 0 C-N-CA 122.977 0.511 . . . . 50.32 110.928 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 622' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -69.08 144.49 57.86 Favored 'Trans proline' 0 C--O 1.237 0.434 0 CA-C-O 121.536 0.557 . . . . 32.76 110.988 174.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 623' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 55.2 42.94 30.07 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 122.175 0.988 . . . . 42.74 111.783 172.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 624' ' ' GLN . . . . . 0.456 ' O ' ' O ' ' A' ' 802' ' ' HOH . 9.6 tt0 -56.22 131.32 47.58 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 114.985 -1.007 . . . . 49.37 109.195 172.416 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 625' ' ' GLY . . . . . . . . . . . . . . . 82.95 -17.16 23.61 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 115.552 0.981 . . . . 52.96 115.552 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 626' ' ' VAL . . . . . . . . . . . . . 93.1 t -82.16 146.71 6.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 118.449 1.124 . . . . 49.83 108.743 174.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 6.7 tttt -81.13 153.35 27.32 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.856 -0.424 . . . . 56.77 109.856 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 628' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -65.74 -38.47 89.22 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 112.354 0.502 . . . . 49.39 112.354 -175.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -73.85 -14.63 61.11 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.84 0.681 . . . . 56.99 112.84 -175.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 630' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -93.95 -12.14 29.43 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 124.401 1.081 . . . . 53.92 113.509 176.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 631' ' ' VAL . . . . . . . . . . . . . 13.3 t -63.61 -45.52 97.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-N 118.621 0.646 . . . . 47.81 110.261 -175.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 632' ' ' ILE . . . . . . . . . . . . . 6.8 tp -59.21 -35.04 55.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.819 -0.352 . . . . 48.48 110.581 -176.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 633' ' ' GLY . . . . . . . . . . . . . . . -67.51 -48.72 55.56 Favored Glycine 0 C--N 1.335 0.499 0 C-N-CA 119.962 -1.113 . . . . 50.47 112.447 177.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 12.3 mtt180 -59.23 -33.47 71.04 Favored 'General case' 0 C--O 1.241 0.637 0 O-C-N 122.401 -0.47 . . . . 58.45 111.969 177.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 635' ' ' ILE . . . . . . . . . . . . . 7.7 mt -78.25 -37.91 22.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 C-N-CA 120.863 -0.335 . . . . 46.1 110.601 179.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -61.07 -38.45 86.28 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 122.036 -0.415 . . . . 60.27 111.231 174.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -69.6 -19.39 63.65 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 112.664 0.616 . . . . 64.88 112.664 178.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 638' ' ' GLY . . . . . . . . . . . . . . . 111.04 -6.32 29.01 Favored Glycine 0 C--O 1.237 0.322 0 CA-C-O 118.904 -0.942 . . . . 50.29 114.39 176.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 639' ' ' GLU . . . . . . . . . . . . . 69.8 tt0 -52.32 142.94 15.92 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 119.155 1.478 . . . . 53.85 110.391 171.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 640' ' ' ARG . . . . . . . . . . . . . 85.8 mmt-85 -144.47 153.73 42.19 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 108.152 -1.055 . . . . 43.46 108.152 178.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 641' ' ' LEU . . . . . . . . . . . . . 38.9 mt -52.83 134.97 46.91 Favored Pre-proline 0 C--O 1.244 0.773 0 O-C-N 124.076 0.86 . . . . 33.74 109.978 177.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 642' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -76.09 169.8 21.34 Favored 'Trans proline' 0 C--N 1.324 -0.744 0 CA-C-O 122.312 0.88 . . . . 41.07 111.387 -173.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 643' ' ' MET . . . . . . . . . . . . . 10.7 ttp -69.25 125.82 92.25 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 114.622 -1.172 . . . . 42.97 109.485 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -69.52 141.27 45.74 Favored 'Trans proline' 0 C--O 1.244 0.811 0 C-N-CA 120.459 0.772 . . . . 43.22 110.898 -178.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 645' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -49.65 125.39 14.06 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 120.199 0.599 . . . . 53.06 111.258 173.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 646' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 69.68 31.22 3.66 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.932 0.893 . . . . 62.99 112.342 175.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 647' ' ' CYS . . . . . . . . . . . . . 1.3 t -102.26 129.71 25.66 Favored Pre-proline 0 C--N 1.292 -1.918 0 N-CA-C 108.817 -0.808 . . . . 48.83 108.817 167.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 648' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -61.75 149.7 88.92 Favored 'Trans proline' 0 C--O 1.249 1.074 0 C-N-CA 121.161 1.24 . . . . 50.52 110.714 -176.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 649' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -62.47 -36.73 64.13 Favored 'Trans proline' 0 C--O 1.237 0.443 0 CA-C-N 118.122 0.365 . . . . 50.25 112.798 179.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 650' ' ' THR . . . . . . . . . . . . . 3.2 t -63.53 -29.7 70.93 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 119.678 -0.809 . . . . 55.92 111.434 179.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 651' ' ' LEU . . . . . . . . . . . . . 30.2 tp -74.4 -45.01 49.51 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.404 -0.518 . . . . 49.58 111.265 176.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 652' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -63.35 -45.52 90.83 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 120.54 -0.464 . . . . 46.14 110.607 177.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 653' ' ' SER . . . . . . . . . . . . . 12.6 t -45.27 -48.69 12.88 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 120.849 0.357 . . . . 52.64 110.696 169.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 654' ' ' LEU . . . . . . . . . . . . . 30.3 tp -56.32 -48.33 76.94 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.719 0.295 . . . . 47.1 111.102 177.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 655' ' ' MET . . . . . . . . . . . . . 8.0 mtp -57.82 -55.47 34.49 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.892 -0.323 . . . . 38.45 111.606 179.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 656' ' ' THR . . . . . . . . . . . . . 29.8 p -54.87 -24.33 22.73 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 119.864 -0.735 . . . . 40.61 111.807 -177.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 657' ' ' LYS . . . . . 0.469 ' NZ ' ' O ' ' A' ' 814' ' ' HOH . 22.6 mttp -76.17 -29.1 57.6 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 119.572 -0.851 . . . . 47.8 111.781 176.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 658' ' ' CYS . . . . . 0.535 ' O ' ' HD3' ' A' ' 666' ' ' ARG . 21.4 m -68.94 -21.34 64.2 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 112.022 0.379 . . . . 42.69 112.022 170.401 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 659' ' ' TRP . . . . . 0.426 ' O ' ' CZ3' ' A' ' 606' ' ' TRP . 27.2 m0 -95.53 12.55 29.12 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.898 1.073 . . . . 40.37 113.898 -177.665 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 660' ' ' ALA . . . . . 0.73 ' O ' ' NH2' ' A' ' 666' ' ' ARG . . . -60.65 135.94 57.91 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 107.869 -1.16 . . . . 42.49 107.869 179.398 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -62.6 -39.74 94.7 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 109.7 -0.482 . . . . 46.47 109.7 -179.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 662' ' ' ASP . . . . . . . . . . . . . 45.9 t0 -78.79 122.16 84.36 Favored Pre-proline 0 N--CA 1.447 -0.608 0 N-CA-C 106.486 -1.672 . . . . 55.51 106.486 179.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 663' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -62.87 -31.37 77.72 Favored 'Trans proline' 0 C--N 1.385 2.479 0 C-N-CA 114.393 -3.271 . . . . 47.58 112.129 -179.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 9.2 m -61.71 -23.33 66.05 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.759 0.652 . . . . 50.9 112.759 -175.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 665' ' ' ARG . . . . . . . . . . . . . 57.6 mtp180 -99.44 15.8 25.24 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 113.092 0.775 . . . . 69.74 113.092 -177.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 666' ' ' ARG . . . . . 0.73 ' NH2' ' O ' ' A' ' 660' ' ' ALA . 45.1 mtm-85 -96.77 134.95 22.48 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 108.886 -0.783 . . . . 46.65 108.886 176.919 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 667' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -52.99 159.68 5.02 Favored 'Trans proline' 0 C--N 1.332 -0.319 0 CA-C-O 122.253 0.855 . . . . 39.77 111.728 179.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 668' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 -91.07 157.21 17.37 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 119.59 -0.844 . . . . 62.91 109.301 168.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 669' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -58.53 -30.48 67.13 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 118.987 -1.085 . . . . 43.33 111.363 -175.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 6.6 t -66.11 -34.69 78.63 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 120.048 -0.661 . . . . 52.36 111.073 178.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 671' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.4 -37.55 68.66 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 119.793 -0.763 . . . . 59.24 110.207 177.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 33.1 mt -63.08 -44.5 95.59 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 116.324 -0.398 . . . . 45.72 110.881 179.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 673' ' ' LYS . . . . . 0.7 ' NZ ' ' O ' ' A' ' 803' ' ' HOH . 26.2 ttpt -57.76 -45.67 85.6 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 120.533 -0.467 . . . . 42.9 111.31 177.871 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 674' ' ' ALA . . . . . . . . . . . . . . . -65.75 -42.21 91.21 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.169 -1.012 . . . . 48.83 110.967 -178.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 675' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -68.15 -44.32 76.27 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 119.501 -0.88 . . . . 57.29 111.382 -178.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 60.0 mt -62.06 -32.3 72.82 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 120.354 -0.538 . . . . 43.39 111.711 177.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 677' ' ' SER . . . . . . . . . . . . . 8.6 t -63.6 -42.68 98.23 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 120.454 -0.499 . . . . 48.14 110.741 178.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 678' ' ' THR . . . . . . . . . . . . . 91.9 m -63.45 -47.66 80.95 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 111.854 0.316 . . . . 50.08 111.854 173.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 73.1 mt -60.65 -33.57 55.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 C-N-CA 120.483 -0.487 . . . . 49.93 111.412 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 680' ' ' LEU . . . . . . . . . . . . . 6.9 tt -70.28 -51.92 26.83 Favored 'General case' 0 C--O 1.24 0.603 0 O-C-N 121.614 -0.678 . . . . 47.38 111.072 176.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -47.42 -47.52 26.66 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.92 0.39 . . . . 66.27 111.325 179.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -63.96 -39.16 93.51 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.201 0.445 . . . . 65.02 112.201 -179.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 683' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -78.56 -26.4 45.58 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 119.372 -0.931 . . . . 54.98 111.628 -172.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 684' ' ' LYS . . . . . . . . . . . . . 7.3 ttpt . . . . . 0 CA--C 1.543 0.71 0 CA-C-O 122.469 1.128 . . . . 66.19 113.808 -170.662 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 701' ' ' EUW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 801' ' ' HOH . . . . . 0.443 ' O ' ' O ' ' A' ' 596' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 802' ' ' HOH . . . . . 0.456 ' O ' ' O ' ' A' ' 624' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 803' ' ' HOH . . . . . 0.7 ' O ' ' NZ ' ' A' ' 673' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 804' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 805' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 806' ' ' HOH . . . . . 0.632 ' O ' ' NH2' ' A' ' 421' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 807' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 808' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 809' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 810' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 811' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 812' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 813' ' ' HOH . . . . . 0.434 ' O ' ' NH1' ' A' ' 550' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 814' ' ' HOH . . . . . 0.469 ' O ' ' NZ ' ' A' ' 657' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 815' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 816' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 817' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 818' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 819' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 820' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 821' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 822' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 823' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 824' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 825' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 826' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 827' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 828' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 829' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 830' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 831' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 832' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 833' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 834' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 835' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 836' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 837' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 838' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 839' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 840' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 841' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 842' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 843' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 844' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 845' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 846' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 847' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 848' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 849' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 850' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 851' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 852' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 853' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 854' ' ' HOH . . . . . 0.823 ' O ' ' HG3' ' A' ' 485' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 855' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 856' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 857' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 858' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 859' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 860' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 861' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 862' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 863' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 864' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 865' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 866' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 413' ' ' ARG . . . . . 0.688 ' HA ' ' HE ' ' A' ' 413' ' ' ARG . 1.1 mmp_? . . . . . 0 N--CA 1.464 0.256 0 CA-C-O 121.089 0.471 . . . . 61.79 111.12 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 55.7 t0 -106.68 113.04 26.29 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.707 -1.22 . . . . 56.29 107.707 175.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 415' ' ' TYR . . . . . 0.41 ' CE2' ' HD2' ' A' ' 476' ' ' ARG . 78.8 m-85 -86.27 -0.49 55.93 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 112.855 0.687 . . . . 54.3 112.855 177.071 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 416' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -69.25 132.05 45.86 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.2 -0.6 . . . . 45.48 109.394 174.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 417' ' ' ILE . . . . . . . . . . . . . 3.3 mm -120.92 134.57 63.91 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 N-CA-C 108.458 -0.941 . . . . 40.26 108.458 -176.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 418' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -69.27 131.15 44.42 Favored 'General case' 0 C--O 1.235 0.315 0 O-C-N 123.362 0.414 . . . . 52.6 111.023 171.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 419' ' ' ARG . . . . . . . . . . . . . 44.6 ttm-85 -61.18 -29.5 69.84 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 119.653 -0.819 . . . . 40.49 111.583 -177.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 420' ' ' GLU . . . . . . . . . . . . . 53.2 mp0 -71.83 -11.55 60.86 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 119.649 -0.821 . . . . 45.47 112.104 -174.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 421' ' ' ARG . . . . . 0.632 ' NH2' ' O ' ' A' ' 806' ' ' HOH . 17.8 mtt180 -83.39 -13.03 55.77 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 119.992 -0.683 . . . . 41.22 112.356 174.211 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 9.5 mm -102.85 132.38 49.12 Favored 'Isoleucine or valine' 0 C--O 1.242 0.662 0 N-CA-C 109.245 -0.65 . . . . 42.76 109.245 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 423' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -116.42 108.99 16.72 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 106.417 -1.697 . . . . 56.83 106.417 173.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 424' ' ' LEU . . . . . . . . . . . . . 1.9 mp -78.86 134.54 36.93 Favored 'General case' 0 CA--C 1.506 -0.742 0 O-C-N 123.456 0.472 . . . . 42.36 110.454 -176.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -113.06 -140.66 7.8 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 119.413 -1.375 . . . . 40.73 111.286 179.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -73.84 151.67 40.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 122.216 1.008 . . . . 62.57 112.336 -171.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 427' ' ' CYS . . . . . . . . . . . . . 15.8 t -66.75 141.93 57.57 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.385 -0.825 . . . . 41.9 109.185 173.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 428' ' ' ILE . . . . . . . . . . . . . 9.9 pt -125.05 3.31 4.66 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.145 0 N-CA-C 112.898 0.703 . . . . 40.39 112.898 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 163.12 -175.35 39.45 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 110.219 -1.152 . . . . 39.91 110.219 176.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 430' ' ' GLU . . . . . . . . . . . . . 8.2 pm0 -133.15 149.97 52.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.391 -0.904 . . . . 60.47 109.492 -178.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 431' ' ' GLY . . . . . . . . . . . . . . . -133.14 178.44 18.19 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 110.115 -1.194 . . . . 47.07 110.115 171.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 432' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -50.12 -25.54 3.62 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 114.0 1.111 . . . . 64.94 114.0 -178.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 433' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -110.25 -19.78 12.88 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 114.153 1.168 . . . . 47.33 114.153 -172.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 434' ' ' GLY . . . . . 0.716 ' HA2' ' HD2' ' A' ' 457' ' ' LYS . . . 167.01 -175.19 42.28 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.329 -0.938 . . . . 48.9 111.529 -178.182 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 435' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -77.3 157.34 30.78 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 122.246 1.022 . . . . 52.27 110.684 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 436' ' ' VAL . . . . . . . . . . . . . 18.5 t -112.84 129.86 67.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 106.308 -1.738 . . . . 37.4 106.308 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 437' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -117.53 151.0 38.02 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.619 -0.882 . . . . 39.26 108.619 -177.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 438' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -86.57 171.45 11.03 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 116.182 -2.207 . . . . 43.97 108.239 160.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 439' ' ' GLY . . . . . . . . . . . . . . . 172.58 -172.58 45.05 Favored Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 110.398 -1.081 . . . . 39.39 110.398 -176.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 440' ' ' ILE . . . . . 0.444 ' CG2' ' HB1' ' A' ' 448' ' ' ALA . 5.3 mp -130.61 133.34 63.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 108.192 -1.04 . . . . 40.88 108.192 -170.363 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 441' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -103.88 120.25 40.61 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.181 -1.044 . . . . 43.87 108.181 170.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 442' ' ' MET . . . . . . . . . . . . . 44.8 mtm -100.38 142.68 31.53 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 124.028 0.931 . . . . 43.35 110.535 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 443' ' ' SER . . . . . . . . . . . . . 66.0 p -140.16 137.82 18.51 Favored Pre-proline 0 C--O 1.24 0.567 0 C-N-CA 119.915 -0.714 . . . . 47.52 109.637 174.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 444' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -44.08 132.13 8.61 Favored 'Trans proline' 0 C--O 1.238 0.521 0 C-N-CA 120.853 1.036 . . . . 47.57 111.646 175.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 445' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 69.76 6.99 6.0 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 126.267 1.827 . . . . 66.76 114.164 168.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 446' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -136.7 150.93 71.57 Favored Pre-proline 0 C--O 1.241 0.629 0 CA-C-N 119.328 0.967 . . . . 61.68 110.17 -172.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 447' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -64.61 151.81 84.19 Favored 'Trans proline' 0 C--O 1.234 0.316 0 CA-C-O 122.01 0.754 . . . . 50.87 112.546 -170.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.444 ' HB1' ' CG2' ' A' ' 440' ' ' ILE . . . -65.32 140.7 58.7 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.176 -0.92 . . . . 46.8 110.054 177.31 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 449' ' ' MET . . . . . . . . . . . . . 40.8 ttp -113.66 125.22 53.9 Favored 'General case' 0 CA--C 1.523 -0.076 0 C-N-CA 123.452 0.701 . . . . 45.63 109.748 -175.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 450' ' ' ALA . . . . . . . . . . . . . . . -75.48 135.81 40.67 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 119.047 -1.061 . . . . 37.27 109.834 178.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 451' ' ' VAL . . . . . . . . . . . . . 22.9 m -138.93 160.18 29.87 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-O 121.961 0.886 . . . . 33.15 109.952 -174.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 452' ' ' ALA . . . . . . . . . . . . . . . -109.81 139.98 44.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.7 -1.137 . . . . 31.74 107.969 169.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 453' ' ' ILE . . . . . 0.409 HG23 HD13 ' A' ' 498' ' ' ILE . 3.2 mp -124.44 112.86 33.94 Favored 'Isoleucine or valine' 0 C--O 1.239 0.546 0 N-CA-C 108.766 -0.828 . . . . 35.35 108.766 -172.605 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 454' ' ' LYS . . . . . . . . . . . . . 50.6 mtpt -80.63 124.54 29.07 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.213 -0.662 . . . . 35.38 109.213 169.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 30.8 p -105.27 159.31 15.98 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.001 -0.74 . . . . 40.73 109.001 173.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 456' ' ' CYS . . . . . 0.547 ' SG ' ' SG ' ' A' ' 459' ' ' CYS . 42.7 t -131.14 118.67 20.81 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.148 -0.933 . . . . 50.57 111.738 -179.929 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 457' ' ' LYS . . . . . 0.716 ' HD2' ' HA2' ' A' ' 434' ' ' GLY . 3.3 mtpt -66.64 -41.91 87.55 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 116.434 2.013 . . . . 63.3 116.434 -179.856 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 458' ' ' ASN . . . . . . . . . . . . . . . -101.49 21.68 13.87 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 116.779 2.14 . . . . 57.78 116.779 -176.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 459' ' ' CYS . . . . . 0.547 ' SG ' ' SG ' ' A' ' 456' ' ' CYS . 1.0 OUTLIER -63.9 -18.57 64.33 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 118.332 2.716 . . . . 56.05 118.332 -178.24 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 460' ' ' THR . . . . . 0.479 HG22 HD22 ' A' ' 493' ' ' ASN . 4.1 p -58.34 -33.12 69.18 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 118.388 -1.325 . . . . 63.41 110.993 -179.797 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 461' ' ' SER . . . . . . . . . . . . . 1.1 p -77.65 131.78 37.92 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 122.51 0.324 . . . . 59.9 110.178 177.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -64.07 -25.85 68.29 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.807 -0.633 . . . . 71.0 112.467 -172.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 463' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.67 -41.92 25.86 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 118.253 -1.379 . . . . 52.82 111.061 -176.355 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 464' ' ' VAL . . . . . . . . . . . . . 48.2 t -63.66 -44.91 98.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 C-N-CA 120.014 -0.675 . . . . 56.4 110.114 172.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -58.68 -37.82 76.87 Favored 'General case' 0 C--O 1.237 0.401 0 O-C-N 121.959 -0.463 . . . . 65.16 111.97 -177.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 466' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -74.84 -29.29 61.01 Favored 'General case' 0 C--O 1.241 0.654 0 C-N-CA 119.157 -1.017 . . . . 71.05 110.971 -178.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 467' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -69.62 -45.93 67.4 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.921 0.391 . . . . 51.97 110.676 173.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 468' ' ' PHE . . . . . . . . . . . . . 55.1 t80 -56.33 -54.47 45.11 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 122.758 0.423 . . . . 47.2 111.47 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 44.6 mt -67.47 -23.91 65.55 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 112.6 0.593 . . . . 43.72 112.6 -176.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 470' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -63.65 -22.55 66.96 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 118.511 -1.275 . . . . 51.84 110.761 176.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 471' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -71.49 -37.74 71.25 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 118.343 -1.343 . . . . 47.73 111.849 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -61.96 -44.26 97.13 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 120.179 -0.608 . . . . 36.53 111.256 172.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 6.9 mt -62.17 -35.85 80.07 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.233 -0.587 . . . . 44.02 111.264 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 474' ' ' THR . . . . . . . . . . . . . 17.3 m -60.42 -47.39 86.32 Favored 'General case' 0 C--N 1.335 -0.057 0 C-N-CA 120.196 -0.602 . . . . 40.02 111.178 171.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 475' ' ' MET . . . . . . . . . . . . . 56.8 mmm -69.18 -26.81 65.03 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 118.594 -1.242 . . . . 38.82 111.452 179.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.41 ' HD2' ' CE2' ' A' ' 415' ' ' TYR . 12.8 ttp180 -60.12 -27.36 66.98 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 112.004 0.372 . . . . 48.41 112.004 179.299 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 477' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -67.39 -18.9 65.31 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 113.07 0.766 . . . . 59.91 113.07 -175.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 478' ' ' PHE . . . . . 0.629 ' HE1' ' HG2' ' A' ' 540' ' ' LYS . 55.7 m-85 -113.0 148.38 35.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 122.426 1.108 . . . . 38.67 112.717 -167.108 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -146.5 98.42 3.07 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 106.228 -1.768 . . . . 46.92 106.228 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 480' ' ' HIS . . . . . . . . . . . . . 61.8 t-80 -157.01 141.09 11.72 Favored Pre-proline 0 N--CA 1.442 -0.863 0 N-CA-C 108.288 -1.004 . . . . 35.5 108.288 -174.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -55.87 -35.45 93.98 Favored 'Trans proline' 0 C--O 1.237 0.471 0 N-CA-C 114.294 0.844 . . . . 33.48 114.294 -178.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 482' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -106.98 26.18 10.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 121.755 -0.591 . . . . 33.4 112.077 -169.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 483' ' ' ILE . . . . . . . . . . . . . 53.0 mt -129.59 137.77 55.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 107.45 -1.315 . . . . 30.7 107.45 167.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 5.1 m -60.1 137.2 22.84 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 C-N-CA 119.824 -0.75 . . . . 36.63 109.756 179.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 485' ' ' LYS . . . . . 0.823 ' HG3' ' O ' ' A' ' 854' ' ' HOH . 12.5 mtmm -96.32 142.37 28.53 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.958 -0.565 . . . . 48.96 110.948 179.221 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 20.5 tp -74.06 140.82 45.63 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.102 -1.073 . . . . 35.28 108.102 173.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 487' ' ' ILE . . . . . . . . . . . . . 44.2 mm -98.62 -55.83 5.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 N-CA-C 109.666 -0.494 . . . . 34.5 109.666 177.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 488' ' ' GLY . . . . . . . . . . . . . . . -171.71 -179.1 42.5 Favored Glycine 0 CA--C 1.505 -0.531 0 N-CA-C 108.585 -1.806 . . . . 32.96 108.585 178.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 35.4 m -128.77 160.15 39.72 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-O 122.241 1.019 . . . . 39.96 109.44 172.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 2.5 mt -117.24 123.13 71.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 105.447 -2.057 . . . . 40.04 105.447 167.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 1.6 p -97.91 -16.45 19.73 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 119.561 -0.856 . . . . 50.18 113.157 -173.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -82.1 134.71 35.35 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.902 -0.777 . . . . 60.3 108.902 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 493' ' ' ASN . . . . . 0.479 HD22 HG22 ' A' ' 460' ' ' THR . 8.3 m-20 -63.92 141.28 98.0 Favored Pre-proline 0 N--CA 1.451 -0.425 0 CA-C-N 115.678 -0.692 . . . . 58.94 110.211 -172.096 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 494' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.07 140.12 62.52 Favored 'Cis proline' 0 C--N 1.351 0.694 0 C-N-CA 123.011 -1.662 . . . . 42.73 112.813 -4.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 49.2 t -79.87 137.09 22.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.64 0 N-CA-C 109.05 -0.722 . . . . 43.56 109.05 -176.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 496' ' ' TRP . . . . . . . . . . . . . 49.0 m0 -131.72 141.93 49.67 Favored 'General case' 0 C--N 1.345 0.398 0 C-N-CA 124.245 1.018 . . . . 39.57 111.08 -177.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 497' ' ' ILE . . . . . . . . . . . . . 25.7 mt -108.56 122.86 63.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 N-CA-C 108.005 -1.109 . . . . 36.23 108.005 172.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 498' ' ' ILE . . . . . 0.409 HD13 HG23 ' A' ' 453' ' ' ILE . 4.9 mm -100.89 123.21 53.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 107.933 -1.136 . . . . 33.78 107.933 -177.509 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 499' ' ' MET . . . . . . . . . . . . . 47.8 mmm -120.7 166.78 13.23 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.19 0.519 . . . . 35.39 109.9 175.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 500' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.49 143.32 58.0 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.843 -0.617 . . . . 38.16 109.729 170.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' LEU . . . . . . . . . . . . . 14.5 tp -85.17 129.5 34.79 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.06 -0.518 . . . . 31.45 110.823 171.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' CYS . . . . . . . . . . . . . 59.4 m -94.86 105.02 16.92 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 105.619 -1.993 . . . . 27.64 105.619 157.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 6.4 t -80.86 -6.99 59.33 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 113.929 1.085 . . . . 36.62 113.929 -161.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 11.4 mt -96.71 -1.65 46.08 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 119.332 0.969 . . . . 36.55 112.498 177.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . 92.31 -153.81 21.96 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 114.818 0.687 . . . . 31.49 114.818 167.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -81.14 145.01 31.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.616 0.246 . . . . 47.33 110.831 -173.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.416 HD22 HG11 ' A' ' 552' ' ' VAL . 32.6 tp -60.43 -47.84 84.34 Favored 'General case' 0 C--N 1.347 0.485 0 N-CA-C 112.434 0.531 . . . . 34.27 112.434 -173.009 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 35.9 mtp180 -59.8 -55.67 31.4 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 121.006 0.431 . . . . 41.8 111.025 -172.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' SER . . . . . . . . . . . . . 8.3 t -54.61 -44.47 73.13 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.123 -0.489 . . . . 54.47 110.596 177.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -53.52 -44.76 69.4 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.365 -0.534 . . . . 33.82 111.409 175.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 76.9 mt -69.8 -43.27 72.43 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.591 0.589 . . . . 38.22 112.591 -175.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -56.87 -46.2 81.98 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 119.652 -0.819 . . . . 45.87 111.597 179.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' VAL . . . . . . . . . . . . . 10.3 m -86.69 -19.29 8.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 C-N-CA 119.811 -0.756 . . . . 43.41 112.691 -172.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -103.05 24.88 10.12 Favored 'General case' 0 C--O 1.235 0.295 0 O-C-N 120.969 -1.082 . . . . 49.95 111.925 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.416 ' HB2' ' HE3' ' A' ' 515' ' ' LYS . 20.1 ttmt -57.54 -60.27 3.92 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.869 0.366 . . . . 56.8 111.552 -175.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 516' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -67.68 0.07 3.55 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 113.84 1.052 . . . . 48.78 113.84 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 73.0 m -109.62 -11.17 14.79 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 113.813 1.042 . . . . 52.56 113.813 -178.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 11.3 mt -110.55 157.12 19.99 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.793 0.806 . . . . 46.75 110.012 177.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -107.9 173.25 6.4 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.307 -0.86 . . . . 55.01 109.488 174.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 520' ' ' LEU . . . . . . . . . . . . . 37.5 tp -56.91 -33.2 66.7 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.524 -1.217 . . . . 42.58 111.788 170.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.95 -35.85 81.49 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.812 -0.755 . . . . 43.29 111.107 179.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' SER . . . . . . . . . . . . . 50.7 m -67.49 -43.66 80.41 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.252 -0.579 . . . . 43.78 110.591 -179.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 25.0 mt -63.37 -39.5 94.69 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.324 -0.55 . . . . 36.79 110.985 -177.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 524' ' ' ILE . . . . . . . . . . . . . 11.2 mt -68.89 -34.08 62.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 C-N-CA 118.125 -1.43 . . . . 37.57 110.037 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 525' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 529' ' ' GLN . 54.0 tp -54.36 -48.55 71.35 Favored 'General case' 0 C--O 1.236 0.346 0 O-C-N 121.879 -0.513 . . . . 36.17 112.169 172.218 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 526' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -57.2 -44.86 84.04 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 119.773 -0.771 . . . . 31.6 110.852 179.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 527' ' ' ALA . . . . . . . . . . . . . . . -62.54 -43.37 98.99 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 120.489 -0.484 . . . . 32.74 110.687 -179.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 528' ' ' TYR . . . . . 0.461 ' O ' HG23 ' A' ' 532' ' ' THR . 64.3 t80 -60.82 -39.82 90.45 Favored 'General case' 0 C--O 1.242 0.705 0 C-N-CA 119.947 -0.701 . . . . 41.37 111.44 175.462 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 529' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' A' ' 525' ' ' LEU . 89.5 mt-30 -68.25 -43.1 78.63 Favored 'General case' 0 C--N 1.347 0.494 0 C-N-CA 119.332 -0.947 . . . . 34.2 110.682 -178.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 530' ' ' LEU . . . . . . . . . . . . . 94.9 mt -64.74 -29.7 70.69 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 119.628 -0.829 . . . . 31.27 110.919 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 79.0 p -70.62 -40.26 73.24 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 120.413 -0.515 . . . . 36.49 111.297 -178.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 532' ' ' THR . . . . . 0.618 HG22 ' HD3' ' A' ' 673' ' ' LYS . 22.6 p -56.53 -46.05 80.82 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 120.661 -0.415 . . . . 34.91 111.101 173.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 533' ' ' ALA . . . . . . . . . . . . . . . -58.33 -42.45 86.81 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.753 -0.379 . . . . 34.9 110.851 176.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 534' ' ' LEU . . . . . . . . . . . . . 30.4 mt -79.8 -34.44 39.64 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 120.05 -0.66 . . . . 37.65 112.197 -173.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 535' ' ' ALA . . . . . . . . . . . . . . . -58.84 -50.54 73.6 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.547 -0.861 . . . . 43.03 110.334 167.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 536' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -47.46 -47.46 27.12 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 120.194 -0.602 . . . . 39.14 111.248 176.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 537' ' ' LEU . . . . . . . . . . . . . 75.0 mt -69.77 -27.27 64.78 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 119.711 -0.795 . . . . 42.75 110.927 -177.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 538' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -71.62 -34.61 69.97 Favored 'General case' 0 C--O 1.238 0.478 0 O-C-N 123.195 0.309 . . . . 50.41 110.812 176.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 539' ' ' SER . . . . . . . . . . . . . 54.6 p -70.64 -30.73 67.43 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 119.417 -0.913 . . . . 47.66 110.556 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 540' ' ' LYS . . . . . 0.629 ' HG2' ' HE1' ' A' ' 478' ' ' PHE . 4.6 tptm -80.13 3.83 19.26 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.785 0.834 . . . . 55.58 112.028 171.899 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 541' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 52.07 35.63 16.81 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.487 0.715 . . . . 60.98 111.599 -179.471 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 542' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -96.9 141.07 30.53 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.71 0.804 . . . . 45.93 109.976 174.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 543' ' ' VAL . . . . . 0.482 HG12 ' HG3' ' A' ' 545' ' ' ARG . 53.5 t -116.06 118.16 57.87 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 N-CA-C 107.834 -1.173 . . . . 40.9 107.834 -175.256 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 544' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 -75.05 -55.09 6.1 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.984 -0.553 . . . . 38.39 111.346 -170.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 545' ' ' ARG . . . . . 0.482 ' HG3' HG12 ' A' ' 543' ' ' VAL . 10.1 mtp85 81.04 -5.76 1.65 Allowed 'General case' 0 C--O 1.242 0.698 0 C-N-CA 127.987 2.515 . . . . 49.81 112.611 177.823 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -144.92 51.53 1.23 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 119.709 1.14 . . . . 44.95 111.104 -172.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 547' ' ' ILE . . . . . . . . . . . . . 15.2 mt -81.54 133.55 29.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 107.836 -1.172 . . . . 33.31 107.836 171.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -177.06 145.73 0.48 Allowed 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 105.427 -2.064 . . . . 31.64 105.427 -175.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -56.66 -32.21 65.16 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.23 -0.988 . . . . 28.21 112.117 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 550' ' ' ARG . . . . . 0.434 ' NH1' ' O ' ' A' ' 813' ' ' HOH . 4.3 ptp85 -59.25 -18.65 39.07 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 112.723 0.638 . . . . 40.54 112.723 -179.602 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -104.13 2.86 32.4 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 123.845 0.858 . . . . 31.68 112.792 -174.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 552' ' ' VAL . . . . . 0.416 HG11 HD22 ' A' ' 507' ' ' LEU . 57.5 t -97.17 141.13 16.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.619 0 C-N-CA 124.771 1.228 . . . . 26.05 108.15 177.662 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 31.5 mt -118.73 162.36 18.56 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.418 -0.586 . . . . 25.32 109.418 -178.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 554' ' ' VAL . . . . . . . . . . . . . 61.6 t -116.74 114.82 47.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.092 -0.707 . . . . 27.06 109.092 -174.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 11.8 t -90.96 -24.63 20.08 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.87 0.868 . . . . 40.82 112.017 178.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -170.64 160.58 7.21 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 106.914 -1.513 . . . . 29.5 106.914 -176.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 20.6 p -57.23 -18.84 17.84 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.252 -0.579 . . . . 32.65 112.032 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 40.2 p-10 -119.35 22.24 11.84 Favored 'General case' 0 C--O 1.237 0.396 0 O-C-N 121.994 -0.441 . . . . 43.51 111.886 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 559' ' ' CYS . . . . . . . . . . . . . 4.5 t -153.12 114.42 4.19 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.347 0.594 . . . . 33.83 109.66 -175.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 5.1 m -120.74 161.44 20.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 107.424 -1.324 . . . . 28.75 107.424 172.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 19.0 mttt -145.66 146.81 31.45 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.43 -0.805 . . . . 35.04 109.949 -172.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 562' ' ' LEU . . . . . . . . . . . . . 23.8 mt -64.25 127.08 29.91 Favored 'General case' 0 C--O 1.23 0.07 0 N-CA-C 109.244 -0.65 . . . . 31.53 109.244 167.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 563' ' ' GLY . . . . . . . . . . . . . . . -70.87 -166.97 6.97 Favored Glycine 0 N--CA 1.443 -0.869 0 CA-C-O 123.505 1.614 . . . . 31.78 114.225 178.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 564' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -65.32 125.1 24.03 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 113.96 -1.12 . . . . 37.39 109.279 -176.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -57.74 -34.57 69.66 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.966 -0.561 . . . . 39.72 111.955 -176.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 566' ' ' GLY . . . . . . . . . . . . . . . -73.02 -37.86 56.02 Favored Glycine 0 C--N 1.336 0.572 0 C-N-CA 120.376 -0.916 . . . . 39.26 112.65 -178.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 567' ' ' LEU . . . . . . . . . . . . . 51.7 mt -70.48 -13.29 62.06 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.416 0.525 . . . . 38.63 112.416 176.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 69.1 m -81.35 -16.94 50.83 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 113.091 0.774 . . . . 40.28 113.091 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 569' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 . . . . . 0 C--N 1.323 -0.554 0 C-N-CA 118.856 -1.138 . . . . 55.77 109.739 -175.654 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 584' ' ' LEU . . . . . . . . . . . . . 8.2 mt . . . . . 0 C--O 1.241 0.606 0 CA-C-O 121.187 0.518 . . . . 54.13 112.257 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 585' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -77.73 61.32 7.5 Favored 'Trans proline' 0 C--N 1.332 -0.299 0 C-N-CA 120.431 0.754 . . . . 41.42 111.44 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 586' ' ' ILE . . . . . . . . . . . . . 44.2 mm -49.75 -48.69 21.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-N 115.361 -0.836 . . . . 39.14 111.109 -168.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 587' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -67.52 -6.96 22.16 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 119.269 -0.972 . . . . 43.02 113.522 -172.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 588' ' ' TRP . . . . . . . . . . . . . 19.3 m-90 -104.67 -12.84 16.18 Favored 'General case' 0 C--O 1.241 0.656 0 N-CA-C 113.988 1.107 . . . . 31.56 113.988 175.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 589' ' ' MET . . . . . . . . . . . . . 78.2 mtp -88.38 144.92 26.09 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 114.303 1.223 . . . . 40.14 114.303 -163.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 590' ' ' ALA . . . . . . . . . . . . . . . -60.2 157.07 35.3 Favored Pre-proline 0 C--O 1.237 0.431 0 CA-C-N 115.283 -0.871 . . . . 38.03 110.681 174.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 591' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -60.15 -43.73 33.72 Favored 'Trans proline' 0 C--O 1.241 0.664 0 N-CA-C 113.385 0.494 . . . . 40.18 113.385 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 592' ' ' GLU . . . . . 0.534 ' OE1' ' NH1' ' A' ' 666' ' ' ARG . 24.9 pm0 -62.84 -29.07 70.46 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 118.109 0.413 . . . . 42.08 111.58 177.643 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 593' ' ' SER . . . . . . . . . . . . . 2.2 m -67.29 -37.52 83.53 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.441 0.162 . . . . 39.37 111.057 176.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 594' ' ' ILE . . . . . . . . . . . . . 75.8 mt -80.83 -45.23 21.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-O 120.906 0.384 . . . . 43.45 110.79 -175.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 595' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -74.35 -32.35 62.76 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 113.988 1.106 . . . . 44.73 113.988 -177.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 596' ' ' PHE . . . . . 0.443 ' O ' ' O ' ' A' ' 801' ' ' HOH . 10.8 m-85 -133.98 6.37 3.65 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 119.056 0.844 . . . . 45.47 113.183 -168.844 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 597' ' ' ARG . . . . . . . . . . . . . . . 48.96 36.69 8.81 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 118.503 0.592 . . . . 42.78 111.993 -173.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 598' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -90.41 133.57 34.92 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.111 -0.699 . . . . 46.99 109.111 174.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 599' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -137.76 108.13 6.49 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 107.764 -1.199 . . . . 43.3 107.764 -172.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 600' ' ' THR . . . . . . . . . . . . . 28.0 p -134.74 178.51 6.95 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.444 -0.946 . . . . 42.9 108.444 -171.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 601' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -64.16 -34.51 78.24 Favored 'General case' 0 CA--C 1.511 -0.528 0 C-N-CA 118.325 -1.35 . . . . 46.16 110.78 175.346 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 602' ' ' ALA . . . . . . . . . . . . . . . -62.55 -36.42 82.57 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 121.072 -0.251 . . . . 36.86 111.548 175.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 603' ' ' SER . . . . . . . . . . . . . 99.6 p -74.44 -30.51 61.92 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.083 -1.047 . . . . 36.92 110.308 -179.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 604' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -58.63 -39.95 81.97 Favored 'General case' 0 C--O 1.242 0.673 0 O-C-N 123.346 0.404 . . . . 36.86 111.13 169.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 605' ' ' VAL . . . . . . . . . . . . . 42.7 t -60.9 -37.67 77.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 CA-C-O 120.75 0.31 . . . . 34.57 111.079 179.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 606' ' ' TRP . . . . . 0.426 ' CZ3' ' O ' ' A' ' 659' ' ' TRP . 7.6 t-105 -62.77 -60.05 4.03 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 121.655 -0.653 . . . . 36.74 110.215 176.611 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 30.3 mtp -40.56 -49.91 2.96 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 113.444 0.905 . . . . 36.75 113.444 172.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 608' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -58.97 -33.9 71.18 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 122.094 -0.379 . . . . 32.98 111.883 -179.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 609' ' ' GLY . . . . . . . . . . . . . . . -68.27 -34.73 81.09 Favored Glycine 0 C--N 1.334 0.428 0 C-N-CA 119.817 -1.182 . . . . 31.61 111.608 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 610' ' ' VAL . . . . . . . . . . . . . 87.8 t -68.24 -44.55 83.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-O 121.198 0.523 . . . . 30.1 110.211 175.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 46.8 t -56.28 -45.97 79.92 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.201 0.524 . . . . 30.65 111.752 171.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 612' ' ' MET . . . . . 0.412 ' HE2' ' HB2' ' A' ' 612' ' ' MET . 2.2 ttm -61.55 -37.66 84.59 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 118.424 -1.31 . . . . 53.93 111.547 178.557 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 613' ' ' TRP . . . . . . . . . . . . . 90.9 t90 -61.17 -50.45 73.08 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.199 -0.6 . . . . 32.78 110.089 175.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 614' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -47.85 -37.25 13.46 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 112.555 0.576 . . . . 34.15 112.555 177.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 615' ' ' ILE . . . . . . . . . . . . . 76.7 mt -77.83 -41.73 28.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 C-N-CA 118.99 -1.084 . . . . 36.05 110.495 -172.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 616' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.66 -21.1 66.2 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 120.206 -0.598 . . . . 43.86 111.285 173.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 617' ' ' MET . . . . . 0.402 ' O ' HG23 ' A' ' 620' ' ' VAL . 77.7 mmm -94.39 5.55 51.45 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 124.766 1.226 . . . . 37.67 112.858 176.416 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 618' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 62.78 38.84 11.41 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.619 0.723 . . . . 44.13 111.383 171.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 619' ' ' GLY . . . . . . . . . . . . . . . 88.39 16.0 59.5 Favored Glycine 0 N--CA 1.443 -0.873 0 N-CA-C 116.224 1.25 . . . . 36.69 116.224 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 620' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 617' ' ' MET . 61.2 t -75.37 143.69 12.96 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.196 0 CA-C-N 118.788 1.294 . . . . 36.91 108.508 170.689 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 621' ' ' LYS . . . . . . . . . . . . . 74.3 mttt -83.65 144.92 46.41 Favored Pre-proline 0 C--O 1.237 0.421 0 C-N-CA 122.977 0.511 . . . . 50.32 110.928 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 622' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -69.08 144.49 57.86 Favored 'Trans proline' 0 C--O 1.237 0.434 0 CA-C-O 121.536 0.557 . . . . 32.76 110.988 174.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 623' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 55.2 42.94 30.07 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 122.175 0.988 . . . . 42.74 111.783 172.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.456 ' O ' ' O ' ' A' ' 802' ' ' HOH . 9.6 tt0 -56.22 131.32 47.58 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 114.985 -1.007 . . . . 49.37 109.195 172.416 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 625' ' ' GLY . . . . . . . . . . . . . . . 82.95 -17.16 23.61 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 115.552 0.981 . . . . 52.96 115.552 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 626' ' ' VAL . . . . . . . . . . . . . 93.1 t -82.16 146.71 6.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 118.449 1.124 . . . . 49.83 108.743 174.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 6.7 tttt -81.13 153.35 27.32 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.856 -0.424 . . . . 56.77 109.856 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 628' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -65.74 -38.47 89.22 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 112.354 0.502 . . . . 49.39 112.354 -175.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -73.85 -14.63 61.11 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.84 0.681 . . . . 56.99 112.84 -175.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 630' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -93.95 -12.14 29.43 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 124.401 1.081 . . . . 53.92 113.509 176.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 631' ' ' VAL . . . . . . . . . . . . . 13.3 t -63.61 -45.52 97.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-N 118.621 0.646 . . . . 47.81 110.261 -175.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 632' ' ' ILE . . . . . . . . . . . . . 6.8 tp -59.21 -35.04 55.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.819 -0.352 . . . . 48.48 110.581 -176.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 633' ' ' GLY . . . . . . . . . . . . . . . -67.51 -48.72 55.56 Favored Glycine 0 C--N 1.335 0.499 0 C-N-CA 119.962 -1.113 . . . . 50.47 112.447 177.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 12.3 mtt180 -59.23 -33.47 71.04 Favored 'General case' 0 C--O 1.241 0.637 0 O-C-N 122.401 -0.47 . . . . 58.45 111.969 177.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 635' ' ' ILE . . . . . . . . . . . . . 7.7 mt -78.25 -37.91 22.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 C-N-CA 120.863 -0.335 . . . . 46.1 110.601 179.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -61.07 -38.45 86.28 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 122.036 -0.415 . . . . 60.27 111.231 174.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -69.6 -19.39 63.65 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 112.664 0.616 . . . . 64.88 112.664 178.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 638' ' ' GLY . . . . . . . . . . . . . . . 111.04 -6.32 29.01 Favored Glycine 0 C--O 1.237 0.322 0 CA-C-O 118.904 -0.942 . . . . 50.29 114.39 176.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 639' ' ' GLU . . . . . . . . . . . . . 69.8 tt0 -52.32 142.94 15.92 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 119.155 1.478 . . . . 53.85 110.391 171.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 640' ' ' ARG . . . . . . . . . . . . . 85.8 mmt-85 -144.47 153.73 42.19 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 108.152 -1.055 . . . . 43.46 108.152 178.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 641' ' ' LEU . . . . . . . . . . . . . 38.9 mt -52.83 134.97 46.91 Favored Pre-proline 0 C--O 1.244 0.773 0 O-C-N 124.076 0.86 . . . . 33.74 109.978 177.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 642' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -76.09 169.8 21.34 Favored 'Trans proline' 0 C--N 1.324 -0.744 0 CA-C-O 122.312 0.88 . . . . 41.07 111.387 -173.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 643' ' ' MET . . . . . . . . . . . . . 10.7 ttp -69.25 125.82 92.25 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 114.622 -1.172 . . . . 42.97 109.485 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -69.52 141.27 45.74 Favored 'Trans proline' 0 C--O 1.244 0.811 0 C-N-CA 120.459 0.772 . . . . 43.22 110.898 -178.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 645' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -49.65 125.39 14.06 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 120.199 0.599 . . . . 53.06 111.258 173.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 646' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 69.68 31.22 3.66 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.932 0.893 . . . . 62.99 112.342 175.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 647' ' ' CYS . . . . . . . . . . . . . 1.3 t -102.26 129.71 25.66 Favored Pre-proline 0 C--N 1.292 -1.918 0 N-CA-C 108.817 -0.808 . . . . 48.83 108.817 167.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 648' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -61.75 149.7 88.92 Favored 'Trans proline' 0 C--O 1.249 1.074 0 C-N-CA 121.161 1.24 . . . . 50.52 110.714 -176.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 649' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -62.47 -36.73 64.13 Favored 'Trans proline' 0 C--O 1.237 0.443 0 CA-C-N 118.122 0.365 . . . . 50.25 112.798 179.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 650' ' ' THR . . . . . . . . . . . . . 3.2 t -63.53 -29.7 70.93 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 119.678 -0.809 . . . . 55.92 111.434 179.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 651' ' ' LEU . . . . . . . . . . . . . 30.2 tp -74.4 -45.01 49.51 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.404 -0.518 . . . . 49.58 111.265 176.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 652' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -63.35 -45.52 90.83 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 120.54 -0.464 . . . . 46.14 110.607 177.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 653' ' ' SER . . . . . . . . . . . . . 12.6 t -45.27 -48.69 12.88 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 120.849 0.357 . . . . 52.64 110.696 169.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 654' ' ' LEU . . . . . . . . . . . . . 30.3 tp -56.32 -48.33 76.94 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.719 0.295 . . . . 47.1 111.102 177.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 655' ' ' MET . . . . . . . . . . . . . 8.0 mtp -57.82 -55.47 34.49 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.892 -0.323 . . . . 38.45 111.606 179.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 656' ' ' THR . . . . . . . . . . . . . 29.8 p -54.87 -24.33 22.73 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 119.864 -0.735 . . . . 40.61 111.807 -177.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 657' ' ' LYS . . . . . 0.469 ' NZ ' ' O ' ' A' ' 814' ' ' HOH . 22.6 mttp -76.17 -29.1 57.6 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 119.572 -0.851 . . . . 47.8 111.781 176.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 658' ' ' CYS . . . . . 0.535 ' O ' ' HD3' ' A' ' 666' ' ' ARG . 21.4 m -68.94 -21.34 64.2 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 112.022 0.379 . . . . 42.69 112.022 170.401 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 659' ' ' TRP . . . . . 0.426 ' O ' ' CZ3' ' A' ' 606' ' ' TRP . 27.2 m0 -95.53 12.55 29.12 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.898 1.073 . . . . 40.37 113.898 -177.665 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 660' ' ' ALA . . . . . 0.73 ' O ' ' NH2' ' A' ' 666' ' ' ARG . . . -60.65 135.94 57.91 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 107.869 -1.16 . . . . 42.49 107.869 179.398 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -62.6 -39.74 94.7 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 109.7 -0.482 . . . . 46.47 109.7 -179.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 662' ' ' ASP . . . . . . . . . . . . . 45.9 t0 -78.79 122.16 84.36 Favored Pre-proline 0 N--CA 1.447 -0.608 0 N-CA-C 106.486 -1.672 . . . . 55.51 106.486 179.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 663' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -62.87 -31.37 77.72 Favored 'Trans proline' 0 C--N 1.385 2.479 0 C-N-CA 114.393 -3.271 . . . . 47.58 112.129 -179.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 9.2 m -61.71 -23.33 66.05 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.759 0.652 . . . . 50.9 112.759 -175.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 665' ' ' ARG . . . . . . . . . . . . . 57.6 mtp180 -99.44 15.8 25.24 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 113.092 0.775 . . . . 69.74 113.092 -177.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 666' ' ' ARG . . . . . 0.73 ' NH2' ' O ' ' A' ' 660' ' ' ALA . 45.1 mtm-85 -96.77 134.95 22.48 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 108.886 -0.783 . . . . 46.65 108.886 176.919 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 667' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -52.99 159.68 5.02 Favored 'Trans proline' 0 C--N 1.332 -0.319 0 CA-C-O 122.253 0.855 . . . . 39.77 111.728 179.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 668' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 -91.07 157.21 17.37 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 119.59 -0.844 . . . . 62.91 109.301 168.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 669' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -58.53 -30.48 67.13 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 118.987 -1.085 . . . . 43.33 111.363 -175.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 6.6 t -66.11 -34.69 78.63 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 120.048 -0.661 . . . . 52.36 111.073 178.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 671' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.4 -37.55 68.66 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 119.793 -0.763 . . . . 59.24 110.207 177.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 33.1 mt -63.08 -44.5 95.59 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 116.324 -0.398 . . . . 45.72 110.881 179.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 673' ' ' LYS . . . . . 0.7 ' NZ ' ' O ' ' A' ' 803' ' ' HOH . 26.2 ttpt -57.76 -45.67 85.6 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 120.533 -0.467 . . . . 42.9 111.31 177.871 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 674' ' ' ALA . . . . . . . . . . . . . . . -65.75 -42.21 91.21 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.169 -1.012 . . . . 48.83 110.967 -178.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 675' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -68.15 -44.32 76.27 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 119.501 -0.88 . . . . 57.29 111.382 -178.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 60.0 mt -62.06 -32.3 72.82 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 120.354 -0.538 . . . . 43.39 111.711 177.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 677' ' ' SER . . . . . . . . . . . . . 8.6 t -63.6 -42.68 98.23 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 120.454 -0.499 . . . . 48.14 110.741 178.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 678' ' ' THR . . . . . . . . . . . . . 91.9 m -63.45 -47.66 80.95 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 111.854 0.316 . . . . 50.08 111.854 173.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 73.1 mt -60.65 -33.57 55.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 C-N-CA 120.483 -0.487 . . . . 49.93 111.412 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 680' ' ' LEU . . . . . . . . . . . . . 6.9 tt -70.28 -51.92 26.83 Favored 'General case' 0 C--O 1.24 0.603 0 O-C-N 121.614 -0.678 . . . . 47.38 111.072 176.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -47.42 -47.52 26.66 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.92 0.39 . . . . 66.27 111.325 179.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -63.96 -39.16 93.51 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.201 0.445 . . . . 65.02 112.201 -179.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 683' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -78.56 -26.4 45.58 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 119.372 -0.931 . . . . 54.98 111.628 -172.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 684' ' ' LYS . . . . . . . . . . . . . 7.3 ttpt . . . . . 0 CA--C 1.543 0.71 0 CA-C-O 122.469 1.128 . . . . 66.19 113.808 -170.662 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 701' ' ' EUW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 801' ' ' HOH . . . . . 0.443 ' O ' ' O ' ' A' ' 596' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 802' ' ' HOH . . . . . 0.456 ' O ' ' O ' ' A' ' 624' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 803' ' ' HOH . . . . . 0.7 ' O ' ' NZ ' ' A' ' 673' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 804' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 805' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 806' ' ' HOH . . . . . 0.632 ' O ' ' NH2' ' A' ' 421' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 807' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 808' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 809' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 810' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 811' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 812' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 813' ' ' HOH . . . . . 0.434 ' O ' ' NH1' ' A' ' 550' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 814' ' ' HOH . . . . . 0.469 ' O ' ' NZ ' ' A' ' 657' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 815' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 816' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 817' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 818' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 819' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 820' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 821' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 822' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 823' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 824' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 825' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 826' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 827' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 828' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 829' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 830' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 831' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 832' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 833' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 834' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 835' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 836' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 837' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 838' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 839' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 840' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 841' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 842' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 843' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 844' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 845' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 846' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 847' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 848' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 849' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 850' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 851' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 852' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 853' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 854' ' ' HOH . . . . . 0.823 ' O ' ' HG3' ' A' ' 485' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 855' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 856' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 857' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 858' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 859' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 860' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 861' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 862' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 863' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 864' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 865' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 866' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_