data_6u6l_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 6u6l _Structure_validation_residue.Date_analyzed 2020-08-14 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 ' 348' ' ' SER . . . . . . . . . . . . . 77.6 p . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.63 0.252 . . . . 74.71 110.806 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 349' ' ' LYS . . . . . . . . . . . . . 18.2 ttmt -60.19 -38.12 82.29 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.12 -0.632 . . . . 68.59 110.64 171.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 350' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.58 -37.6 79.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-O 120.892 0.377 . . . . 58.56 110.528 177.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 43.9 t -65.27 -39.66 92.9 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 121.945 -0.472 . . . . 63.55 111.324 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 352' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -72.78 -30.47 64.12 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.189 -0.605 . . . . 55.52 111.475 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 353' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -66.33 -42.87 87.57 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.401 -0.52 . . . . 57.16 111.215 174.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 354' ' ' LEU . . . . . . . . . . . . . 79.0 mt -66.37 -27.25 67.73 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.399 -0.52 . . . . 49.74 111.689 179.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 355' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -68.11 -37.03 80.7 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.081 -0.648 . . . . 77.5 110.995 173.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 356' ' ' CYS . . . . . . . . . . . . . 96.2 m -69.49 -33.59 73.09 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.259 -0.577 . . . . 63.22 111.463 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 357' ' ' CYS . . . . . . . . . . . . . 74.4 m -59.34 -37.67 78.42 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.575 -0.45 . . . . 44.66 111.383 175.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 55.9 m -65.15 -40.46 94.41 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.253 -0.579 . . . . 58.08 111.25 177.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 359' ' ' GLY . . . . . . . . . . . . . . . -68.18 -37.07 86.46 Favored Glycine 0 C--N 1.335 0.495 0 C-N-CA 120.144 -1.027 . . . . 39.0 112.627 177.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 360' ' ' ILE . . . . . . . . . . . . . 74.0 mt -62.44 -45.07 99.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 O-C-N 122.322 -0.517 . . . . 39.03 110.474 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 361' ' ' LEU . . . . . . . . . . . . . 34.0 tp -69.29 -28.37 66.22 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 119.944 -0.702 . . . . 35.87 111.535 177.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 362' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -65.39 -42.03 93.07 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.34 -0.544 . . . . 72.68 111.051 175.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 363' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -65.9 -35.89 81.9 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.364 -0.534 . . . . 42.77 111.117 176.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 364' ' ' MET . . . . . . . . . . . . . 88.7 mtp -64.44 -28.98 70.04 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.393 -0.523 . . . . 40.62 111.407 176.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 365' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -83.61 -9.79 58.66 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.964 0.727 . . . . 39.25 112.964 174.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -69.61 158.35 35.47 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.974 0.892 . . . . 38.65 111.126 -173.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 367' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -66.14 -20.61 66.2 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.065 -0.97 . . . . 46.99 112.28 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 368' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -58.28 -31.88 67.89 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 117.865 0.302 . . . . 66.53 111.794 178.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 369' ' ' HIS . . . . . 0.484 ' ND1' ' OH ' ' A' ' 372' ' ' TYR . 62.1 m-70 -114.78 10.02 16.45 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 112.811 0.671 . . . . 42.22 112.811 -178.239 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -63.51 -23.83 67.56 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.863 0.69 . . . . 36.61 112.863 -173.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 371' ' ' ALA . . . . . . . . . . . . . . . -66.91 -23.65 66.01 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.548 0.573 . . . . 40.14 112.548 -178.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 372' ' ' TYR . . . . . 0.484 ' OH ' ' ND1' ' A' ' 369' ' ' HIS . 12.3 p90 -128.2 1.39 5.79 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 113.916 1.08 . . . . 44.15 113.916 179.645 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -105.53 -6.74 19.11 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 113.358 0.873 . . . . 41.49 113.358 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 374' ' ' TRP . . . . . . . . . . . . . 59.5 p-90 -66.18 -31.59 4.66 Favored Pre-proline 0 C--O 1.237 0.429 0 N-CA-C 114.212 1.19 . . . . 46.22 114.212 -176.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 375' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -65.68 -7.98 18.04 Favored 'Trans proline' 0 C--O 1.239 0.536 0 CA-C-N 121.456 1.556 . . . . 44.69 113.949 177.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 376' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -113.73 3.39 15.55 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 112.996 0.739 . . . . 43.24 112.996 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 377' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -64.01 -61.31 2.35 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 118.353 0.524 . . . . 44.98 111.12 179.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 378' ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -101.05 165.15 14.71 Favored Pre-proline 0 C--N 1.324 -0.542 0 C-N-CA 124.901 1.281 . . . . 58.0 110.382 -177.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -59.56 150.96 72.8 Favored 'Trans proline' 0 C--O 1.233 0.254 0 CA-C-O 121.46 0.525 . . . . 46.2 111.453 175.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 40.8 t -60.98 122.28 11.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-N 115.263 -0.881 . . . . 44.89 109.423 -176.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -74.54 98.13 3.29 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.876 -0.787 . . . . 48.31 108.876 -179.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 382' ' ' VAL . . . . . . . . . . . . . 26.8 m -73.16 -8.79 12.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 112.934 0.716 . . . . 55.75 112.934 179.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 383' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -85.28 1.94 46.15 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.802 0.667 . . . . 65.21 112.802 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 384' ' ' ALA . . . . . . . . . . . . . . . -81.38 161.33 23.82 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.743 0.782 . . . . 50.94 110.544 179.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 3.3 tt -69.36 129.51 39.96 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.319 -0.855 . . . . 62.12 110.033 -178.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 386' ' ' GLY . . . . . . . . . . . . . . . 92.31 -13.27 67.61 Favored Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 115.185 0.834 . . . . 53.04 115.185 179.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 10.8 mp -103.51 26.41 8.49 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 118.494 1.147 . . . . 53.11 112.272 -177.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 388' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -70.99 -17.63 62.64 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.694 0.627 . . . . 52.08 112.694 -178.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 389' ' ' ASP . . . . . . . . . . . . . 28.9 p-10 -112.75 25.86 11.05 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 118.219 0.463 . . . . 57.36 112.098 -177.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 390' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -74.91 -45.8 40.23 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.35 -0.54 . . . . 54.12 111.366 -178.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 391' ' ' CYS . . . . . . . . . . . . . 74.8 m -68.63 -16.58 63.89 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.367 0.506 . . . . 66.85 112.367 179.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 392' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -81.45 -28.24 34.27 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 118.178 0.444 . . . . 68.31 111.914 175.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 393' ' ' ILE . . . . . . . . . . . . . 50.1 mm -94.18 -42.98 13.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 117.706 0.23 . . . . 56.4 111.351 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 394' ' ' ILE . . . . . . . . . . . . . 36.0 mm -96.92 114.12 33.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 108.193 -1.04 . . . . 52.01 108.193 -177.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 10.2 mmpt? -87.43 -24.7 24.09 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 113.335 0.865 . . . . 63.42 113.335 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 396' ' ' HIS . . . . . . . . . . . . . 61.8 m80 -131.51 89.25 40.94 Favored Pre-proline 0 C--O 1.238 0.486 0 N-CA-C 108.901 -0.778 . . . . 51.72 108.901 -179.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 397' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -65.52 156.46 63.48 Favored 'Trans proline' 0 C--N 1.33 -0.411 0 CA-C-O 121.965 0.736 . . . . 45.32 111.374 176.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 398' ' ' MET . . . . . . . . . . . . . 41.5 tpp -161.5 139.32 9.12 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.014 -0.994 . . . . 39.93 109.095 -179.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 399' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -142.43 174.42 10.64 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.172 -0.677 . . . . 46.97 109.172 -179.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 400' ' ' MET . . . . . . . . . . . . . 73.9 mtp -71.13 -33.67 70.3 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.449 -0.796 . . . . 39.23 112.093 -177.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' SER . . . . . . . . . . . . . 75.0 m -68.56 -35.35 77.28 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.035 -0.666 . . . . 39.38 111.265 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' THR . . . . . . . . . . . . . 48.4 m -68.55 -39.82 80.9 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.258 -0.577 . . . . 48.12 111.012 175.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' ILE . . . . . . . . . . . . . 85.9 mt -62.64 -40.21 87.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 120.831 0.348 . . . . 46.99 110.42 176.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 31.9 tttp -66.83 -39.91 87.82 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 119.989 -0.684 . . . . 56.44 111.208 177.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 405' ' ' SER . . . . . . . . . . . . . 45.4 t -63.56 -37.72 88.39 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.671 -0.411 . . . . 53.1 111.369 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 406' ' ' LYS . . . . . 0.402 ' NZ ' ' OD2' ' A' ' 421' ' ' ASP . 45.6 mtmt -77.27 -25.11 51.11 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.206 -0.598 . . . . 42.6 111.984 179.015 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 24.0 mt -67.84 -43.64 79.05 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.091 -0.644 . . . . 50.14 111.008 171.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -66.56 -37.46 85.02 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.649 -0.421 . . . . 64.37 111.258 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 409' ' ' ALA . . . . . . . . . . . . . . . -78.19 -3.55 43.17 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.725 0.639 . . . . 45.93 112.725 174.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 56.39 43.42 26.18 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.232 0.613 . . . . 54.9 111.52 179.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 411' ' ' GLU . . . . . . . . . . . . . 74.3 tt0 -79.55 -27.33 41.28 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.517 -0.473 . . . . 48.6 111.886 177.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 412' ' ' TYR . . . . . . . . . . . . . 73.1 m-85 -73.93 124.6 26.48 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.846 -0.427 . . . . 49.31 109.846 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 413' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -70.84 -55.21 9.0 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.416 -0.513 . . . . 55.61 110.895 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -126.27 -179.36 4.7 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.548 0.69 . . . . 48.42 109.4 -179.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -73.34 -22.21 60.36 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.671 -0.695 . . . . 44.36 112.567 -178.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 416' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -73.31 -30.17 63.2 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.257 -0.577 . . . . 70.65 111.769 -179.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 417' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -69.92 -34.28 73.29 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.886 -0.726 . . . . 49.36 111.049 173.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 418' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -61.53 -49.31 77.21 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.867 0.365 . . . . 41.95 110.897 173.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 419' ' ' GLY . . . . . . . . . . . . . . . -63.95 -30.43 77.69 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.327 -0.939 . . . . 44.64 113.234 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 420' ' ' ALA . . . . . . . . . . . . . . . -64.52 -35.19 80.15 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 117.339 0.57 . . . . 38.27 111.535 177.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 421' ' ' ASP . . . . . 0.402 ' OD2' ' NZ ' ' A' ' 406' ' ' LYS . 38.0 m-20 -76.47 -36.52 57.82 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.333 -0.547 . . . . 40.3 111.692 176.726 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 422' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.94 -44.4 98.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 C-N-CA 120.335 -0.546 . . . . 39.18 110.103 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 423' ' ' ARG . . . . . . . . . . . . . 67.8 mtt180 -73.48 -27.39 61.37 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 112.153 0.427 . . . . 39.34 112.153 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 424' ' ' LEU . . . . . . . . . . . . . 45.4 tp -63.98 -36.26 83.38 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.235 -0.586 . . . . 35.9 110.727 169.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 425' ' ' MET . . . . . . . . . . . . . 57.7 ttp -63.14 -42.25 99.43 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.841 -0.344 . . . . 41.93 111.231 178.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 426' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -75.55 -34.7 60.74 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.433 -0.507 . . . . 38.52 112.159 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 74.2 m -65.1 -37.19 86.68 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 120.16 -0.616 . . . . 42.11 111.518 179.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 428' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -61.34 -35.78 78.37 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.082 -0.647 . . . . 44.81 111.131 176.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 49.3 t -71.23 -39.82 71.46 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.731 -0.388 . . . . 35.64 111.27 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 430' ' ' TYR . . . . . 0.4 ' OH ' ' OE1' ' A' ' 447' ' ' GLN . 21.1 m-85 -67.45 -33.81 75.92 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.498 -0.481 . . . . 37.64 111.793 178.57 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 431' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -78.08 -43.24 29.67 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 111.866 0.321 . . . . 45.42 111.866 -176.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -79.7 -42.39 24.77 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.169 0.433 . . . . 54.61 112.169 -175.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 433' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -90.45 146.1 33.8 Favored Pre-proline 0 C--O 1.236 0.361 0 C-N-CA 117.196 -1.802 . . . . 53.04 111.401 -172.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 434' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -62.84 151.52 83.75 Favored 'Trans proline' 0 C--O 1.246 0.879 0 O-C-N 122.356 0.661 . . . . 47.03 110.577 176.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -60.86 -37.36 78.3 Favored 'Trans proline' 0 C--O 1.237 0.472 0 N-CA-C 114.167 0.795 . . . . 48.62 114.167 -173.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 436' ' ' ASP . . . . . . . . . . . . . 36.4 p-10 -75.68 -7.47 54.41 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.148 0.795 . . . . 61.39 113.148 -175.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 437' ' ' HIS . . . . . . . . . . . . . 9.7 m170 -66.87 154.49 40.82 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 122.063 0.935 . . . . 45.18 111.197 -177.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 438' ' ' GLU . . . . . . . . . . . . . 87.4 tt0 -68.74 -34.11 75.04 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 114.981 -1.009 . . . . 66.41 111.78 -177.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 439' ' ' VAL . . . . . . . . . . . . . 14.6 p -65.18 -29.18 46.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 120.683 -0.407 . . . . 40.3 111.091 -177.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 85.4 t -67.16 -40.05 84.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 O-C-N 121.795 -0.566 . . . . 41.55 110.423 175.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -65.45 -37.73 87.74 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.319 -0.552 . . . . 36.38 111.036 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 442' ' ' MET . . . . . . . . . . . . . 53.2 mtp -65.77 -32.45 74.0 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.684 -0.407 . . . . 41.81 111.531 176.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -69.08 -36.76 77.97 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.375 -0.53 . . . . 39.09 111.294 178.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 444' ' ' ARG . . . . . . . . . . . . . 70.2 mtt85 -65.46 -37.93 88.32 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.299 -0.56 . . . . 65.37 111.371 177.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -68.98 -41.27 78.12 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.464 -0.494 . . . . 48.06 111.202 -179.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 446' ' ' LEU . . . . . . . . . . . . . 34.2 tp -72.21 -37.45 69.21 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.04 -0.664 . . . . 35.61 111.284 178.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 447' ' ' GLN . . . . . 0.4 ' OE1' ' OH ' ' A' ' 430' ' ' TYR . 63.6 tt0 -67.64 -34.14 76.36 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.91 -0.716 . . . . 46.47 111.39 177.353 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 448' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -61.44 -41.7 97.6 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.082 -0.647 . . . . 67.5 110.906 175.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 449' ' ' VAL . . . . . . . . . . . . . 97.5 t -62.24 -40.37 87.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 120.994 0.426 . . . . 37.65 110.402 175.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 450' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -68.77 -51.47 40.71 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 121.892 -0.505 . . . . 34.56 111.385 -178.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -62.27 -31.92 72.56 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.393 -0.523 . . . . 39.08 112.057 -175.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 94.5 mmm -73.02 -38.51 66.53 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.891 -0.724 . . . . 50.59 111.26 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 453' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -74.64 -37.83 62.66 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.361 -0.536 . . . . 59.12 111.176 176.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 454' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -69.39 -28.0 65.79 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.781 -0.367 . . . . 40.92 111.666 -178.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -70.52 -31.3 68.33 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.428 -0.509 . . . . 47.69 111.779 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 456' ' ' LYS . . . . . . . . . . . . . 17.3 mtpt -88.37 38.08 0.85 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.147 0.499 . . . . 64.83 112.163 178.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 40.2 tpp -71.05 138.05 84.83 Favored Pre-proline 0 C--O 1.236 0.36 0 N-CA-C 109.866 -0.42 . . . . 56.0 109.866 175.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -64.57 130.59 26.95 Favored 'Trans proline' 0 C--N 1.332 -0.302 0 C-N-CA 120.024 0.483 . . . . 52.21 111.37 178.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 459' ' ' ASP . . . . . . . . . . . . . 15.2 t0 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 115.694 -0.684 . . . . 63.4 110.754 -178.089 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.091 . . . . . . . . 52.32 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -90.39 160.42 16.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.836 0.351 . . . . 57.56 111.197 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -146.98 142.91 28.02 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 108.894 -0.78 . . . . 55.76 108.894 -177.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 43.7 m -136.76 118.88 15.44 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.968 -0.752 . . . . 48.17 108.968 -179.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 84.9 mt -134.71 114.44 17.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 O-C-N 123.238 0.336 . . . . 50.49 110.256 177.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 82.19 -10.48 53.68 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 114.243 -1.344 . . . . 57.55 114.552 177.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 52.4 m -108.47 129.3 55.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.278 -1.328 . . . . 58.29 111.051 -179.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' TRP . . . . . . . . . . . . . 18.1 p90 -150.73 164.87 35.13 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.393 0.616 . . . . 53.68 109.433 179.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 20.9 ttp180 -104.83 123.5 47.79 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.205 -0.907 . . . . 69.71 108.816 178.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 53.5 p -66.65 163.72 18.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.787 0.327 . . . . 54.14 111.215 -178.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -70.76 -41.84 71.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.385 -1.28 . . . . 60.71 111.122 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' CYS . . . . . . . . . . . . . 58.0 m -82.61 -5.08 58.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 60.09 111.111 -178.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 1 C--N 1.43 4.105 0 O-C-N 118.529 -2.607 . . . . 61.72 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 348' ' ' SER . . . . . . . . . . . . . 77.6 p . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.63 0.252 . . . . 74.71 110.806 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 349' ' ' LYS . . . . . . . . . . . . . 18.2 ttmt -60.19 -38.12 82.29 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.12 -0.632 . . . . 68.59 110.64 171.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 350' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.58 -37.6 79.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-O 120.892 0.377 . . . . 58.56 110.528 177.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 43.9 t -65.27 -39.66 92.9 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 121.945 -0.472 . . . . 63.55 111.324 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 352' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -72.78 -30.47 64.12 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.189 -0.605 . . . . 55.52 111.475 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 353' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -66.33 -42.87 87.57 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.401 -0.52 . . . . 57.16 111.215 174.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 354' ' ' LEU . . . . . . . . . . . . . 79.0 mt -66.37 -27.25 67.73 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.399 -0.52 . . . . 49.74 111.689 179.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 355' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -68.11 -37.03 80.7 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.081 -0.648 . . . . 77.5 110.995 173.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 356' ' ' CYS . . . . . . . . . . . . . 96.2 m -69.49 -33.59 73.09 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.259 -0.577 . . . . 63.22 111.463 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 357' ' ' CYS . . . . . . . . . . . . . 74.4 m -59.34 -37.67 78.42 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.575 -0.45 . . . . 44.66 111.383 175.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 55.9 m -65.15 -40.46 94.41 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.253 -0.579 . . . . 58.08 111.25 177.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 359' ' ' GLY . . . . . . . . . . . . . . . -68.18 -37.07 86.46 Favored Glycine 0 C--N 1.335 0.495 0 C-N-CA 120.144 -1.027 . . . . 39.0 112.627 177.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 360' ' ' ILE . . . . . . . . . . . . . 74.0 mt -62.44 -45.07 99.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 O-C-N 122.322 -0.517 . . . . 39.03 110.474 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 361' ' ' LEU . . . . . . . . . . . . . 34.0 tp -69.29 -28.37 66.22 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 119.944 -0.702 . . . . 35.87 111.535 177.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 362' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -65.39 -42.03 93.07 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.34 -0.544 . . . . 72.68 111.051 175.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 363' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -65.9 -35.89 81.9 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.364 -0.534 . . . . 42.77 111.117 176.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 364' ' ' MET . . . . . . . . . . . . . 88.7 mtp -64.44 -28.98 70.04 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.393 -0.523 . . . . 40.62 111.407 176.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 365' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -83.61 -9.79 58.66 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.964 0.727 . . . . 39.25 112.964 174.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -69.61 158.35 35.47 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.974 0.892 . . . . 38.65 111.126 -173.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 367' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -66.14 -20.61 66.2 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.065 -0.97 . . . . 46.99 112.28 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 368' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -58.28 -31.88 67.89 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 117.865 0.302 . . . . 66.53 111.794 178.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 369' ' ' HIS . . . . . . . . . . . . . 62.1 m-70 -114.78 10.02 16.45 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 112.811 0.671 . . . . 42.22 112.811 -178.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -63.51 -23.83 67.56 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.863 0.69 . . . . 36.61 112.863 -173.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 371' ' ' ALA . . . . . . . . . . . . . . . -66.91 -23.65 66.01 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.548 0.573 . . . . 40.14 112.548 -178.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . . 12.3 p90 -128.2 1.39 5.79 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 113.916 1.08 . . . . 44.15 113.916 179.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -105.53 -6.74 19.11 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 113.358 0.873 . . . . 41.49 113.358 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 374' ' ' TRP . . . . . 0.452 ' CG ' ' HD3' ' A' ' 375' ' ' PRO . 59.5 p-90 -66.18 -31.59 4.66 Favored Pre-proline 0 C--O 1.237 0.429 0 N-CA-C 114.212 1.19 . . . . 46.22 114.212 -176.746 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 375' ' ' PRO . . . . . 0.452 ' HD3' ' CG ' ' A' ' 374' ' ' TRP . 34.0 Cg_exo -65.68 -7.98 18.04 Favored 'Trans proline' 0 C--O 1.239 0.536 0 CA-C-N 121.456 1.556 . . . . 44.69 113.949 177.429 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 376' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -113.73 3.39 15.55 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 112.996 0.739 . . . . 43.24 112.996 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 377' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -64.01 -61.31 2.35 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 118.353 0.524 . . . . 44.98 111.12 179.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 378' ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -101.05 165.15 14.71 Favored Pre-proline 0 C--N 1.324 -0.542 0 C-N-CA 124.901 1.281 . . . . 58.0 110.382 -177.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -59.56 150.96 72.8 Favored 'Trans proline' 0 C--O 1.233 0.254 0 CA-C-O 121.46 0.525 . . . . 46.2 111.453 175.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 40.8 t -60.98 122.28 11.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-N 115.263 -0.881 . . . . 44.89 109.423 -176.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -74.54 98.13 3.29 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.876 -0.787 . . . . 48.31 108.876 -179.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 382' ' ' VAL . . . . . . . . . . . . . 26.8 m -73.16 -8.79 12.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 112.934 0.716 . . . . 55.75 112.934 179.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 383' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -85.28 1.94 46.15 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.802 0.667 . . . . 65.21 112.802 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 384' ' ' ALA . . . . . . . . . . . . . . . -81.38 161.33 23.82 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.743 0.782 . . . . 50.94 110.544 179.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 3.3 tt -69.36 129.51 39.96 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.319 -0.855 . . . . 62.12 110.033 -178.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 386' ' ' GLY . . . . . . . . . . . . . . . 92.31 -13.27 67.61 Favored Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 115.185 0.834 . . . . 53.04 115.185 179.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 10.8 mp -103.51 26.41 8.49 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 118.494 1.147 . . . . 53.11 112.272 -177.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 388' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -70.99 -17.63 62.64 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.694 0.627 . . . . 52.08 112.694 -178.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 389' ' ' ASP . . . . . . . . . . . . . 28.9 p-10 -112.75 25.86 11.05 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 118.219 0.463 . . . . 57.36 112.098 -177.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 390' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -74.91 -45.8 40.23 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.35 -0.54 . . . . 54.12 111.366 -178.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 391' ' ' CYS . . . . . . . . . . . . . 74.8 m -68.63 -16.58 63.89 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.367 0.506 . . . . 66.85 112.367 179.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 392' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -81.45 -28.24 34.27 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 118.178 0.444 . . . . 68.31 111.914 175.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 393' ' ' ILE . . . . . . . . . . . . . 50.1 mm -94.18 -42.98 13.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 117.706 0.23 . . . . 56.4 111.351 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 394' ' ' ILE . . . . . . . . . . . . . 36.0 mm -96.92 114.12 33.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 108.193 -1.04 . . . . 52.01 108.193 -177.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 10.2 mmpt? -87.43 -24.7 24.09 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 113.335 0.865 . . . . 63.42 113.335 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 396' ' ' HIS . . . . . . . . . . . . . 61.8 m80 -131.51 89.25 40.94 Favored Pre-proline 0 C--O 1.238 0.486 0 N-CA-C 108.901 -0.778 . . . . 51.72 108.901 -179.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 397' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -65.52 156.46 63.48 Favored 'Trans proline' 0 C--N 1.33 -0.411 0 CA-C-O 121.965 0.736 . . . . 45.32 111.374 176.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 398' ' ' MET . . . . . . . . . . . . . 41.5 tpp -161.5 139.32 9.12 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.014 -0.994 . . . . 39.93 109.095 -179.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 399' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -142.43 174.42 10.64 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.172 -0.677 . . . . 46.97 109.172 -179.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 400' ' ' MET . . . . . . . . . . . . . 73.9 mtp -71.13 -33.67 70.3 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.449 -0.796 . . . . 39.23 112.093 -177.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 401' ' ' SER . . . . . . . . . . . . . 75.0 m -68.56 -35.35 77.28 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.035 -0.666 . . . . 39.38 111.265 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 402' ' ' THR . . . . . . . . . . . . . 48.4 m -68.55 -39.82 80.9 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.258 -0.577 . . . . 48.12 111.012 175.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 403' ' ' ILE . . . . . . . . . . . . . 85.9 mt -62.64 -40.21 87.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 120.831 0.348 . . . . 46.99 110.42 176.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 31.9 tttp -66.83 -39.91 87.82 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 119.989 -0.684 . . . . 56.44 111.208 177.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 405' ' ' SER . . . . . . . . . . . . . 45.4 t -63.56 -37.72 88.39 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.671 -0.411 . . . . 53.1 111.369 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 45.6 mtmt -77.27 -25.11 51.11 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.206 -0.598 . . . . 42.6 111.984 179.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 24.0 mt -67.84 -43.64 79.05 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.091 -0.644 . . . . 50.14 111.008 171.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -66.56 -37.46 85.02 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.649 -0.421 . . . . 64.37 111.258 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 409' ' ' ALA . . . . . . . . . . . . . . . -78.19 -3.55 43.17 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.725 0.639 . . . . 45.93 112.725 174.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 56.39 43.42 26.18 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.232 0.613 . . . . 54.9 111.52 179.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 411' ' ' GLU . . . . . . . . . . . . . 74.3 tt0 -79.55 -27.33 41.28 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.517 -0.473 . . . . 48.6 111.886 177.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 412' ' ' TYR . . . . . . . . . . . . . 73.1 m-85 -73.93 124.6 26.48 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.846 -0.427 . . . . 49.31 109.846 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 413' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -70.84 -55.21 9.0 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.416 -0.513 . . . . 55.61 110.895 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -126.27 -179.36 4.7 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.548 0.69 . . . . 48.42 109.4 -179.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -73.34 -22.21 60.36 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.671 -0.695 . . . . 44.36 112.567 -178.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 416' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -73.31 -30.17 63.2 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.257 -0.577 . . . . 70.65 111.769 -179.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 417' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -69.92 -34.28 73.29 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.886 -0.726 . . . . 49.36 111.049 173.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 418' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -61.53 -49.31 77.21 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.867 0.365 . . . . 41.95 110.897 173.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 419' ' ' GLY . . . . . . . . . . . . . . . -63.95 -30.43 77.69 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.327 -0.939 . . . . 44.64 113.234 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 420' ' ' ALA . . . . . . . . . . . . . . . -64.52 -35.19 80.15 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 117.339 0.57 . . . . 38.27 111.535 177.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 421' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -76.47 -36.52 57.82 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.333 -0.547 . . . . 40.3 111.692 176.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 422' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.94 -44.4 98.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 C-N-CA 120.335 -0.546 . . . . 39.18 110.103 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 423' ' ' ARG . . . . . . . . . . . . . 67.8 mtt180 -73.48 -27.39 61.37 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 112.153 0.427 . . . . 39.34 112.153 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 424' ' ' LEU . . . . . . . . . . . . . 45.4 tp -63.98 -36.26 83.38 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.235 -0.586 . . . . 35.9 110.727 169.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 425' ' ' MET . . . . . . . . . . . . . 57.7 ttp -63.14 -42.25 99.43 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.841 -0.344 . . . . 41.93 111.231 178.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 426' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -75.55 -34.7 60.74 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.433 -0.507 . . . . 38.52 112.159 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 74.2 m -65.1 -37.19 86.68 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 120.16 -0.616 . . . . 42.11 111.518 179.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 428' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -61.34 -35.78 78.37 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.082 -0.647 . . . . 44.81 111.131 176.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 49.3 t -71.23 -39.82 71.46 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.731 -0.388 . . . . 35.64 111.27 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 430' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -67.45 -33.81 75.92 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.498 -0.481 . . . . 37.64 111.793 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 431' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -78.08 -43.24 29.67 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 111.866 0.321 . . . . 45.42 111.866 -176.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -79.7 -42.39 24.77 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.169 0.433 . . . . 54.61 112.169 -175.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 433' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -90.45 146.1 33.8 Favored Pre-proline 0 C--O 1.236 0.361 0 C-N-CA 117.196 -1.802 . . . . 53.04 111.401 -172.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 434' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -62.84 151.52 83.75 Favored 'Trans proline' 0 C--O 1.246 0.879 0 O-C-N 122.356 0.661 . . . . 47.03 110.577 176.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -60.86 -37.36 78.3 Favored 'Trans proline' 0 C--O 1.237 0.472 0 N-CA-C 114.167 0.795 . . . . 48.62 114.167 -173.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 436' ' ' ASP . . . . . . . . . . . . . 36.4 p-10 -75.68 -7.47 54.41 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.148 0.795 . . . . 61.39 113.148 -175.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 437' ' ' HIS . . . . . . . . . . . . . 9.7 m170 -66.87 154.49 40.82 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 122.063 0.935 . . . . 45.18 111.197 -177.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 438' ' ' GLU . . . . . . . . . . . . . 87.4 tt0 -68.74 -34.11 75.04 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 114.981 -1.009 . . . . 66.41 111.78 -177.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 439' ' ' VAL . . . . . . . . . . . . . 14.6 p -65.18 -29.18 46.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 120.683 -0.407 . . . . 40.3 111.091 -177.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 85.4 t -67.16 -40.05 84.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 O-C-N 121.795 -0.566 . . . . 41.55 110.423 175.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -65.45 -37.73 87.74 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.319 -0.552 . . . . 36.38 111.036 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 442' ' ' MET . . . . . . . . . . . . . 53.2 mtp -65.77 -32.45 74.0 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.684 -0.407 . . . . 41.81 111.531 176.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -69.08 -36.76 77.97 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.375 -0.53 . . . . 39.09 111.294 178.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 444' ' ' ARG . . . . . . . . . . . . . 70.2 mtt85 -65.46 -37.93 88.32 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.299 -0.56 . . . . 65.37 111.371 177.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -68.98 -41.27 78.12 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.464 -0.494 . . . . 48.06 111.202 -179.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 446' ' ' LEU . . . . . . . . . . . . . 34.2 tp -72.21 -37.45 69.21 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.04 -0.664 . . . . 35.61 111.284 178.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 447' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -67.64 -34.14 76.36 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.91 -0.716 . . . . 46.47 111.39 177.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 448' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -61.44 -41.7 97.6 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.082 -0.647 . . . . 67.5 110.906 175.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 449' ' ' VAL . . . . . . . . . . . . . 97.5 t -62.24 -40.37 87.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 120.994 0.426 . . . . 37.65 110.402 175.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 450' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -68.77 -51.47 40.71 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 121.892 -0.505 . . . . 34.56 111.385 -178.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -62.27 -31.92 72.56 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.393 -0.523 . . . . 39.08 112.057 -175.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 94.5 mmm -73.02 -38.51 66.53 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.891 -0.724 . . . . 50.59 111.26 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 453' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -74.64 -37.83 62.66 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.361 -0.536 . . . . 59.12 111.176 176.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 454' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -69.39 -28.0 65.79 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.781 -0.367 . . . . 40.92 111.666 -178.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -70.52 -31.3 68.33 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.428 -0.509 . . . . 47.69 111.779 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 456' ' ' LYS . . . . . . . . . . . . . 17.3 mtpt -88.37 38.08 0.85 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.147 0.499 . . . . 64.83 112.163 178.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 40.2 tpp -71.05 138.05 84.83 Favored Pre-proline 0 C--O 1.236 0.36 0 N-CA-C 109.866 -0.42 . . . . 56.0 109.866 175.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -64.57 130.59 26.95 Favored 'Trans proline' 0 C--N 1.332 -0.302 0 C-N-CA 120.024 0.483 . . . . 52.21 111.37 178.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 459' ' ' ASP . . . . . . . . . . . . . 15.2 t0 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 115.694 -0.684 . . . . 63.4 110.754 -178.089 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.091 . . . . . . . . 52.32 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -90.39 160.42 16.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.836 0.351 . . . . 57.56 111.197 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -146.98 142.91 28.02 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 108.894 -0.78 . . . . 55.76 108.894 -177.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 43.7 m -136.76 118.88 15.44 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.968 -0.752 . . . . 48.17 108.968 -179.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 84.9 mt -134.71 114.44 17.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 O-C-N 123.238 0.336 . . . . 50.49 110.256 177.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 82.19 -10.48 53.68 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 114.243 -1.344 . . . . 57.55 114.552 177.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 52.4 m -108.47 129.3 55.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.278 -1.328 . . . . 58.29 111.051 -179.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' TRP . . . . . . . . . . . . . 18.1 p90 -150.73 164.87 35.13 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.393 0.616 . . . . 53.68 109.433 179.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 20.9 ttp180 -104.83 123.5 47.79 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.205 -0.907 . . . . 69.71 108.816 178.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 53.5 p -66.65 163.72 18.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.787 0.327 . . . . 54.14 111.215 -178.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -70.76 -41.84 71.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.385 -1.28 . . . . 60.71 111.122 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' CYS . . . . . . . . . . . . . 58.0 m -82.61 -5.08 58.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 60.09 111.111 -178.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 1 C--N 1.43 4.105 0 O-C-N 118.529 -2.607 . . . . 61.72 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 348' ' ' SER . . . . . . . . . . . . . 77.6 p . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.63 0.252 . . . . 74.71 110.806 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 349' ' ' LYS . . . . . . . . . . . . . 18.2 ttmt -60.19 -38.12 82.29 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.12 -0.632 . . . . 68.59 110.64 171.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 350' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.58 -37.6 79.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-O 120.892 0.377 . . . . 58.56 110.528 177.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 43.9 t -65.27 -39.66 92.9 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 121.945 -0.472 . . . . 63.55 111.324 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 352' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -72.78 -30.47 64.12 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.189 -0.605 . . . . 55.52 111.475 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 353' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -66.33 -42.87 87.57 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.401 -0.52 . . . . 57.16 111.215 174.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 354' ' ' LEU . . . . . . . . . . . . . 79.0 mt -66.37 -27.25 67.73 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.399 -0.52 . . . . 49.74 111.689 179.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 355' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -68.11 -37.03 80.7 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.081 -0.648 . . . . 77.5 110.995 173.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 356' ' ' CYS . . . . . . . . . . . . . 96.2 m -69.49 -33.59 73.09 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.259 -0.577 . . . . 63.22 111.463 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 357' ' ' CYS . . . . . . . . . . . . . 74.4 m -59.34 -37.67 78.42 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.575 -0.45 . . . . 44.66 111.383 175.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 55.9 m -65.15 -40.46 94.41 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.253 -0.579 . . . . 58.08 111.25 177.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 359' ' ' GLY . . . . . . . . . . . . . . . -68.18 -37.07 86.46 Favored Glycine 0 C--N 1.335 0.495 0 C-N-CA 120.144 -1.027 . . . . 39.0 112.627 177.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 360' ' ' ILE . . . . . . . . . . . . . 74.0 mt -62.44 -45.07 99.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 O-C-N 122.322 -0.517 . . . . 39.03 110.474 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 361' ' ' LEU . . . . . . . . . . . . . 34.0 tp -69.29 -28.37 66.22 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 119.944 -0.702 . . . . 35.87 111.535 177.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 362' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -65.39 -42.03 93.07 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.34 -0.544 . . . . 72.68 111.051 175.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 363' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -65.9 -35.89 81.9 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.364 -0.534 . . . . 42.77 111.117 176.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 364' ' ' MET . . . . . . . . . . . . . 88.7 mtp -64.44 -28.98 70.04 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.393 -0.523 . . . . 40.62 111.407 176.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 365' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -83.61 -9.79 58.66 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.964 0.727 . . . . 39.25 112.964 174.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -69.61 158.35 35.47 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.974 0.892 . . . . 38.65 111.126 -173.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 367' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -66.14 -20.61 66.2 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.065 -0.97 . . . . 46.99 112.28 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 368' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -58.28 -31.88 67.89 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 117.865 0.302 . . . . 66.53 111.794 178.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 369' ' ' HIS . . . . . . . . . . . . . 62.1 m-70 -114.78 10.02 16.45 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 112.811 0.671 . . . . 42.22 112.811 -178.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -63.51 -23.83 67.56 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.863 0.69 . . . . 36.61 112.863 -173.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 371' ' ' ALA . . . . . . . . . . . . . . . -66.91 -23.65 66.01 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.548 0.573 . . . . 40.14 112.548 -178.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 372' ' ' TYR . . . . . . . . . . . . . 12.3 p90 -128.2 1.39 5.79 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 113.916 1.08 . . . . 44.15 113.916 179.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -105.53 -6.74 19.11 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 113.358 0.873 . . . . 41.49 113.358 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 374' ' ' TRP . . . . . 0.452 ' CG ' ' HD3' ' A' ' 375' ' ' PRO . 59.5 p-90 -66.18 -31.59 4.66 Favored Pre-proline 0 C--O 1.237 0.429 0 N-CA-C 114.212 1.19 . . . . 46.22 114.212 -176.746 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 375' ' ' PRO . . . . . 0.452 ' HD3' ' CG ' ' A' ' 374' ' ' TRP . 34.0 Cg_exo -65.68 -7.98 18.04 Favored 'Trans proline' 0 C--O 1.239 0.536 0 CA-C-N 121.456 1.556 . . . . 44.69 113.949 177.429 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 376' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -113.73 3.39 15.55 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 112.996 0.739 . . . . 43.24 112.996 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 377' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -64.01 -61.31 2.35 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 118.353 0.524 . . . . 44.98 111.12 179.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 378' ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -101.05 165.15 14.71 Favored Pre-proline 0 C--N 1.324 -0.542 0 C-N-CA 124.901 1.281 . . . . 58.0 110.382 -177.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 379' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -59.56 150.96 72.8 Favored 'Trans proline' 0 C--O 1.233 0.254 0 CA-C-O 121.46 0.525 . . . . 46.2 111.453 175.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 380' ' ' VAL . . . . . . . . . . . . . 40.8 t -60.98 122.28 11.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-N 115.263 -0.881 . . . . 44.89 109.423 -176.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 381' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -74.54 98.13 3.29 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.876 -0.787 . . . . 48.31 108.876 -179.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 382' ' ' VAL . . . . . . . . . . . . . 26.8 m -73.16 -8.79 12.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 112.934 0.716 . . . . 55.75 112.934 179.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 383' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -85.28 1.94 46.15 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.802 0.667 . . . . 65.21 112.802 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 384' ' ' ALA . . . . . . . . . . . . . . . -81.38 161.33 23.82 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.743 0.782 . . . . 50.94 110.544 179.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 3.3 tt -69.36 129.51 39.96 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.319 -0.855 . . . . 62.12 110.033 -178.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 386' ' ' GLY . . . . . . . . . . . . . . . 92.31 -13.27 67.61 Favored Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 115.185 0.834 . . . . 53.04 115.185 179.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 10.8 mp -103.51 26.41 8.49 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 118.494 1.147 . . . . 53.11 112.272 -177.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 388' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -70.99 -17.63 62.64 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.694 0.627 . . . . 52.08 112.694 -178.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 389' ' ' ASP . . . . . . . . . . . . . 28.9 p-10 -112.75 25.86 11.05 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 118.219 0.463 . . . . 57.36 112.098 -177.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 390' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -74.91 -45.8 40.23 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.35 -0.54 . . . . 54.12 111.366 -178.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 391' ' ' CYS . . . . . . . . . . . . . 74.8 m -68.63 -16.58 63.89 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.367 0.506 . . . . 66.85 112.367 179.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 392' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -81.45 -28.24 34.27 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 118.178 0.444 . . . . 68.31 111.914 175.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 393' ' ' ILE . . . . . . . . . . . . . 50.1 mm -94.18 -42.98 13.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 117.706 0.23 . . . . 56.4 111.351 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 394' ' ' ILE . . . . . . . . . . . . . 36.0 mm -96.92 114.12 33.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 108.193 -1.04 . . . . 52.01 108.193 -177.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 10.2 mmpt? -87.43 -24.7 24.09 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 113.335 0.865 . . . . 63.42 113.335 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 396' ' ' HIS . . . . . . . . . . . . . 61.8 m80 -131.51 89.25 40.94 Favored Pre-proline 0 C--O 1.238 0.486 0 N-CA-C 108.901 -0.778 . . . . 51.72 108.901 -179.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 397' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -65.52 156.46 63.48 Favored 'Trans proline' 0 C--N 1.33 -0.411 0 CA-C-O 121.965 0.736 . . . . 45.32 111.374 176.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 398' ' ' MET . . . . . . . . . . . . . 41.5 tpp -161.5 139.32 9.12 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.014 -0.994 . . . . 39.93 109.095 -179.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 399' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -142.43 174.42 10.64 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.172 -0.677 . . . . 46.97 109.172 -179.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 400' ' ' MET . . . . . . . . . . . . . 73.9 mtp -71.13 -33.67 70.3 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.449 -0.796 . . . . 39.23 112.093 -177.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' SER . . . . . . . . . . . . . 75.0 m -68.56 -35.35 77.28 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.035 -0.666 . . . . 39.38 111.265 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' THR . . . . . . . . . . . . . 48.4 m -68.55 -39.82 80.9 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.258 -0.577 . . . . 48.12 111.012 175.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 403' ' ' ILE . . . . . . . . . . . . . 85.9 mt -62.64 -40.21 87.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 120.831 0.348 . . . . 46.99 110.42 176.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 404' ' ' LYS . . . . . . . . . . . . . 31.9 tttp -66.83 -39.91 87.82 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 119.989 -0.684 . . . . 56.44 111.208 177.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 405' ' ' SER . . . . . . . . . . . . . 45.4 t -63.56 -37.72 88.39 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.671 -0.411 . . . . 53.1 111.369 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 45.6 mtmt -77.27 -25.11 51.11 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.206 -0.598 . . . . 42.6 111.984 179.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 24.0 mt -67.84 -43.64 79.05 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.091 -0.644 . . . . 50.14 111.008 171.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -66.56 -37.46 85.02 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.649 -0.421 . . . . 64.37 111.258 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 409' ' ' ALA . . . . . . . . . . . . . . . -78.19 -3.55 43.17 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.725 0.639 . . . . 45.93 112.725 174.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 410' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 56.39 43.42 26.18 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.232 0.613 . . . . 54.9 111.52 179.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 411' ' ' GLU . . . . . . . . . . . . . 74.3 tt0 -79.55 -27.33 41.28 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.517 -0.473 . . . . 48.6 111.886 177.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 412' ' ' TYR . . . . . . . . . . . . . 73.1 m-85 -73.93 124.6 26.48 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.846 -0.427 . . . . 49.31 109.846 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 413' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -70.84 -55.21 9.0 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.416 -0.513 . . . . 55.61 110.895 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -126.27 -179.36 4.7 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.548 0.69 . . . . 48.42 109.4 -179.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -73.34 -22.21 60.36 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.671 -0.695 . . . . 44.36 112.567 -178.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 416' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -73.31 -30.17 63.2 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.257 -0.577 . . . . 70.65 111.769 -179.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 417' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -69.92 -34.28 73.29 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.886 -0.726 . . . . 49.36 111.049 173.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 418' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -61.53 -49.31 77.21 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.867 0.365 . . . . 41.95 110.897 173.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 419' ' ' GLY . . . . . . . . . . . . . . . -63.95 -30.43 77.69 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.327 -0.939 . . . . 44.64 113.234 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 420' ' ' ALA . . . . . . . . . . . . . . . -64.52 -35.19 80.15 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 117.339 0.57 . . . . 38.27 111.535 177.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 421' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -76.47 -36.52 57.82 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.333 -0.547 . . . . 40.3 111.692 176.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 422' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.94 -44.4 98.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 C-N-CA 120.335 -0.546 . . . . 39.18 110.103 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 423' ' ' ARG . . . . . . . . . . . . . 67.8 mtt180 -73.48 -27.39 61.37 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 112.153 0.427 . . . . 39.34 112.153 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 424' ' ' LEU . . . . . . . . . . . . . 45.4 tp -63.98 -36.26 83.38 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.235 -0.586 . . . . 35.9 110.727 169.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 425' ' ' MET . . . . . . . . . . . . . 57.7 ttp -63.14 -42.25 99.43 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.841 -0.344 . . . . 41.93 111.231 178.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 426' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -75.55 -34.7 60.74 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.433 -0.507 . . . . 38.52 112.159 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 74.2 m -65.1 -37.19 86.68 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 120.16 -0.616 . . . . 42.11 111.518 179.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 428' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -61.34 -35.78 78.37 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.082 -0.647 . . . . 44.81 111.131 176.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 49.3 t -71.23 -39.82 71.46 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.731 -0.388 . . . . 35.64 111.27 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 430' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -67.45 -33.81 75.92 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.498 -0.481 . . . . 37.64 111.793 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 431' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -78.08 -43.24 29.67 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 111.866 0.321 . . . . 45.42 111.866 -176.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -79.7 -42.39 24.77 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.169 0.433 . . . . 54.61 112.169 -175.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 433' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -90.45 146.1 33.8 Favored Pre-proline 0 C--O 1.236 0.361 0 C-N-CA 117.196 -1.802 . . . . 53.04 111.401 -172.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 434' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -62.84 151.52 83.75 Favored 'Trans proline' 0 C--O 1.246 0.879 0 O-C-N 122.356 0.661 . . . . 47.03 110.577 176.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -60.86 -37.36 78.3 Favored 'Trans proline' 0 C--O 1.237 0.472 0 N-CA-C 114.167 0.795 . . . . 48.62 114.167 -173.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 436' ' ' ASP . . . . . . . . . . . . . 36.4 p-10 -75.68 -7.47 54.41 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.148 0.795 . . . . 61.39 113.148 -175.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 437' ' ' HIS . . . . . . . . . . . . . 9.7 m170 -66.87 154.49 40.82 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 122.063 0.935 . . . . 45.18 111.197 -177.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 438' ' ' GLU . . . . . . . . . . . . . 87.4 tt0 -68.74 -34.11 75.04 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 114.981 -1.009 . . . . 66.41 111.78 -177.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 439' ' ' VAL . . . . . . . . . . . . . 14.6 p -65.18 -29.18 46.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 120.683 -0.407 . . . . 40.3 111.091 -177.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 85.4 t -67.16 -40.05 84.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 O-C-N 121.795 -0.566 . . . . 41.55 110.423 175.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 441' ' ' ALA . . . . . . . . . . . . . . . -65.45 -37.73 87.74 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.319 -0.552 . . . . 36.38 111.036 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 442' ' ' MET . . . . . . . . . . . . . 53.2 mtp -65.77 -32.45 74.0 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.684 -0.407 . . . . 41.81 111.531 176.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 443' ' ' ALA . . . . . . . . . . . . . . . -69.08 -36.76 77.97 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.375 -0.53 . . . . 39.09 111.294 178.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 444' ' ' ARG . . . . . . . . . . . . . 70.2 mtt85 -65.46 -37.93 88.32 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.299 -0.56 . . . . 65.37 111.371 177.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 445' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -68.98 -41.27 78.12 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.464 -0.494 . . . . 48.06 111.202 -179.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 446' ' ' LEU . . . . . . . . . . . . . 34.2 tp -72.21 -37.45 69.21 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.04 -0.664 . . . . 35.61 111.284 178.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 447' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -67.64 -34.14 76.36 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.91 -0.716 . . . . 46.47 111.39 177.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 448' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -61.44 -41.7 97.6 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.082 -0.647 . . . . 67.5 110.906 175.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 449' ' ' VAL . . . . . . . . . . . . . 97.5 t -62.24 -40.37 87.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 120.994 0.426 . . . . 37.65 110.402 175.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 450' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -68.77 -51.47 40.71 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 121.892 -0.505 . . . . 34.56 111.385 -178.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -62.27 -31.92 72.56 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 120.393 -0.523 . . . . 39.08 112.057 -175.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 94.5 mmm -73.02 -38.51 66.53 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.891 -0.724 . . . . 50.59 111.26 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 453' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -74.64 -37.83 62.66 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.361 -0.536 . . . . 59.12 111.176 176.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 454' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -69.39 -28.0 65.79 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.781 -0.367 . . . . 40.92 111.666 -178.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 455' ' ' ALA . . . . . . . . . . . . . . . -70.52 -31.3 68.33 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.428 -0.509 . . . . 47.69 111.779 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 456' ' ' LYS . . . . . . . . . . . . . 17.3 mtpt -88.37 38.08 0.85 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.147 0.499 . . . . 64.83 112.163 178.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 457' ' ' MET . . . . . . . . . . . . . 40.2 tpp -71.05 138.05 84.83 Favored Pre-proline 0 C--O 1.236 0.36 0 N-CA-C 109.866 -0.42 . . . . 56.0 109.866 175.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -64.57 130.59 26.95 Favored 'Trans proline' 0 C--N 1.332 -0.302 0 C-N-CA 120.024 0.483 . . . . 52.21 111.37 178.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 459' ' ' ASP . . . . . . . . . . . . . 15.2 t0 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 115.694 -0.684 . . . . 63.4 110.754 -178.089 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.091 . . . . . . . . 52.32 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -90.39 160.42 16.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.836 0.351 . . . . 57.56 111.197 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -146.98 142.91 28.02 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 108.894 -0.78 . . . . 55.76 108.894 -177.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 43.7 m -136.76 118.88 15.44 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.968 -0.752 . . . . 48.17 108.968 -179.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 84.9 mt -134.71 114.44 17.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 O-C-N 123.238 0.336 . . . . 50.49 110.256 177.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 82.19 -10.48 53.68 Favored Glycine 0 N--CA 1.452 -0.234 0 CA-C-N 114.243 -1.344 . . . . 57.55 114.552 177.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 52.4 m -108.47 129.3 55.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.278 -1.328 . . . . 58.29 111.051 -179.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' TRP . . . . . . . . . . . . . 18.1 p90 -150.73 164.87 35.13 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.393 0.616 . . . . 53.68 109.433 179.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 20.9 ttp180 -104.83 123.5 47.79 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.205 -0.907 . . . . 69.71 108.816 178.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 53.5 p -66.65 163.72 18.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.787 0.327 . . . . 54.14 111.215 -178.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -70.76 -41.84 71.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.385 -1.28 . . . . 60.71 111.122 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' CYS . . . . . . . . . . . . . 58.0 m -82.61 -5.08 58.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 60.09 111.111 -178.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 1 C--N 1.43 4.105 0 O-C-N 118.529 -2.607 . . . . 61.72 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_