data_3fkm_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 3fkm _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' X' X ' 331' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 . . . . . 0 N--CA 1.51 2.537 0 N-CA-C 112.402 0.519 . . . . 40.939999999999998 112.402 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 332' ' ' GLY . . . . . . . . . . . . . . . 85.89 -119.67 5.17 Favored Glycine 0 N--CA 1.478 1.439 0 C-N-CA 123.482 0.563 . . . . 40.240000000000002 112.88 165.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 333' ' ' ASN . . . . . 0.428 ' C ' ' OD1' ' X' ' 333' ' ' ASN . 22.2 p30 -106.34 5.55 29.71 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 119.382 -0.927 . . . . 38.82 111.522 169.081 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 334' ' ' LYS . . . . . . . . . . . . . 9.0 mmtm -61.57 -36.31 80.28 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 112.67 0.619 . . . . 36.359999999999999 112.67 -176.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 335' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -65.19 -54.18 33.46 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 113.021 0.749 . . . . 37.57 113.021 -171.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 336' ' ' TRP . . . . . . . . . . . . . 42.3 p-90 -67.74 -26.55 66.2 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 114.787 1.403 . . . . 36.420000000000002 114.787 177.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 337' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.8 -43.16 94.58 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 106.866 -1.531 . . . . 37.810000000000002 106.866 172.271 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 338' ' ' LEU . . . . . . . . . . . . . 16.1 mt -69.78 -36.91 76.12 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 117.76 2.504 . . . . 34.009999999999998 117.76 -176.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 339' ' ' LEU . . . . . . . . . . . . . 10.1 mt -68.0 -41.11 82.77 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 118.585 0.63 . . . . 35.57 111.617 167.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 340' ' ' ALA . . . . . . . . . . . . . . . -55.67 -48.58 74.81 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.437 -0.505 . . . . 33.460000000000001 110.039 176.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 341' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -59.54 -38.47 81.12 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 119.325 -0.95 . . . . 36.07 112.626 176.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 342' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -66.61 -38.87 87.88 Favored 'General case' 0 C--O 1.245 0.86 0 O-C-N 121.525 -0.734 . . . . 49.170000000000002 111.342 176.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 343' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.28 -51.27 68.39 Favored 'General case' 0 C--O 1.205 -1.283 0 CA-C-N 114.795 -1.093 . . . . 41.590000000000003 109.022 -177.183 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 344' ' ' ILE . . . . . . . . . . . . . 6.8 tp -65.82 -24.33 34.02 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.896 0 N-CA-C 115.211 1.56 . . . . 39.229999999999997 115.211 177.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 345' ' ' LEU . . . . . . . . . . . . . 52.7 mt -79.5 -25.88 41.71 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 118.816 -1.154 . . . . 38.600000000000001 111.755 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 346' ' ' SER . . . . . . . . . . . . . 94.0 p -83.27 -32.47 26.38 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.522 0.729 . . . . 40.299999999999997 112.104 177.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 347' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.41 -50.83 70.49 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-O 121.01 0.434 . . . . 35.850000000000001 111.452 168.643 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 348' ' ' SER . . . . . . . . . . . . . 2.1 p -68.46 -19.82 64.59 Favored 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 113.98 1.104 . . . . 40.579999999999998 113.98 -175.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 349' ' ' LYS . . . . . . . . . . . . . 30.9 mtpt -88.78 -32.11 18.04 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 123.743 0.817 . . . . 42.759999999999998 112.019 177.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 350' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -54.84 150.8 9.39 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.984 0.514 . . . . 38.630000000000003 110.612 -173.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 351' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -38.71 113.7 0.32 Allowed 'General case' 0 C--O 1.249 1.058 0 N-CA-C 115.653 1.723 . . . . 45.009999999999998 115.653 173.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 352' ' ' GLY . . . . . . . . . . . . . . . 73.7 13.36 80.47 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 117.282 1.673 . . . . 39.0 117.282 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 353' ' ' GLY . . . . . . . . . . . . . . . -64.39 -33.7 87.94 Favored Glycine 0 C--O 1.214 -1.144 0 N-CA-C 116.104 1.202 . . . . 37.759999999999998 116.104 177.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 354' ' ' HIS . . . . . . . . . . . . . 20.9 p80 -54.55 -14.6 1.35 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.349 0.87 . . . . 36.009999999999998 113.349 -177.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 355' ' ' ILE . . . . . . . . . . . . . 48.3 mt -65.25 -24.36 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-O 120.863 0.363 . . . . 36.409999999999997 110.357 175.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 356' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -114.07 19.61 16.32 Favored 'General case' 0 CA--C 1.486 -1.503 0 N-CA-C 112.636 0.606 . . . . 36.039999999999999 112.636 -170.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 357' ' ' GLU . . . . . . . . . . . . . 24.5 tp10 -79.74 -56.33 4.36 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.891 -0.595 . . . . 42.619999999999997 110.978 -170.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 358' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.45 -175.91 2.81 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 124.085 0.866 . . . . 39.43 110.157 -179.719 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 359' ' ' LEU . . . . . . . . . . . . . 2.9 mt -108.37 137.55 46.14 Favored 'General case' 0 C--O 1.245 0.867 0 N-CA-C 107.778 -1.193 . . . . 43.659999999999997 107.778 -175.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 360' ' ' VAL . . . . . . . . . . . . . . . -51.45 100.82 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 O-C-N 124.449 1.093 . . . . 47.189999999999998 109.108 172.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 361' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.663 0 C-N-CA 122.894 0.477 . . . . 48.310000000000002 110.712 -178.052 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 367' ' ' CYS . . . . . . . . . . . . . 37.5 t . . . . . 0 CA--C 1.544 0.732 0 CA-C-O 121.41 0.624 . . . . 41.990000000000002 111.24 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 368' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -80.5 154.62 21.16 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 122.887 2.391 . . . . 37.5 112.613 -165.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 369' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -67.5 139.67 57.01 Favored 'General case' 0 CA--C 1.506 -0.75 0 N-CA-C 108.214 -1.032 . . . . 36.899999999999999 108.214 172.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 370' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -55.03 -48.18 73.74 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 112.588 0.588 . . . . 31.780000000000001 112.588 -176.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 371' ' ' TYR . . . . . . . . . . . . . 25.3 p90 -61.84 -15.33 41.18 Favored 'General case' 0 C--O 1.257 1.469 0 N-CA-C 115.294 1.59 . . . . 32.310000000000002 115.294 179.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 372' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -91.89 -21.84 20.38 Favored 'General case' 0 CA--C 1.491 -1.292 0 CA-C-O 121.379 0.609 . . . . 33.719999999999999 111.643 -177.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 373' ' ' VAL . . . . . . . . . . . . . 55.6 t -56.83 126.41 14.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 109.273 -0.64 . . . . 35.359999999999999 109.273 175.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 374' ' ' ILE . . . . . . . . . . . . . 79.8 mt -98.78 126.58 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 N-CA-C 108.254 -1.017 . . . . 35.700000000000003 108.254 -176.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 375' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -56.5 -53.41 57.83 Favored 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 120.472 -0.491 . . . . 39.560000000000002 111.633 -179.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 376' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -129.75 88.25 49.95 Favored Pre-proline 0 N--CA 1.475 0.819 0 CA-C-O 118.587 -0.72 . . . . 42.810000000000002 112.891 177.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 377' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -54.07 149.94 33.41 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 O-C-N 122.89 0.942 . . . . 32.460000000000001 109.944 174.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 378' ' ' MSE . . . . . . . . . . . . . 45.4 tpp -158.45 149.01 20.2 Favored 'General case' 0 C--O 1.196 -1.739 0 N-CA-C 108.49 -0.93 . . . . 42.18 108.49 174.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 379' ' ' SER . . . . . . . . . . . . . 10.8 p -150.65 163.74 37.8 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.219 -1.03 . . . . 36.280000000000001 108.219 176.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 380' ' ' PHE . . . . . . . . . . . . . 23.4 m-30 -56.34 -39.22 72.47 Favored 'General case' 0 C--O 1.256 1.422 0 N-CA-C 112.762 0.653 . . . . 37.469999999999999 112.762 176.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 381' ' ' SER . . . . . . . . . . . . . 3.5 m -57.61 -43.36 84.67 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 113.793 1.035 . . . . 40.579999999999998 113.793 174.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 382' ' ' CYS . . . . . . . . . . . . . 63.8 m -62.52 -36.63 83.18 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-O 121.236 0.541 . . . . 36.159999999999997 109.939 174.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 383' ' ' ILE . . . . . . . . . . . . . 27.8 mt -72.38 -48.69 46.69 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.576 0 C-N-CA 119.365 -0.934 . . . . 33.850000000000001 110.244 -174.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 384' ' ' LYS . . . . . . . . . . . . . 55.9 mttt -48.01 -37.77 15.57 Favored 'General case' 0 C--O 1.25 1.111 0 CA-C-N 115.753 -0.658 . . . . 35.670000000000002 110.543 173.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 385' ' ' THR . . . . . . . . . . . . . 95.6 m -75.24 -39.7 59.69 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 119.073 -1.051 . . . . 31.75 112.834 -176.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 386' ' ' LYS . . . . . . . . . . . . . 35.7 mttt -59.81 -36.73 77.37 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 122.235 -0.291 . . . . 38.07 110.626 174.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 387' ' ' LEU . . . . . . . . . . . . . 46.3 mt -67.04 -47.52 71.14 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 122.975 0.51 . . . . 31.34 111.173 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 388' ' ' LYS . . . . . . . . . . . . . 75.2 mttt -60.72 -32.0 71.28 Favored 'General case' 0 CA--C 1.504 -0.819 0 C-N-CA 120.238 -0.585 . . . . 41.490000000000002 110.796 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 389' ' ' LYS . . . . . . . . . . . . . 14.6 mttm -89.56 -13.81 36.48 Favored 'General case' 0 C--O 1.204 -1.32 0 CA-C-O 121.269 0.556 . . . . 44.159999999999997 111.365 -174.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 390' ' ' GLY . . . . . . . . . . . . . . . 72.41 42.65 48.28 Favored Glycine 0 C--O 1.199 -2.04 0 N-CA-C 108.761 -1.736 . . . . 33.200000000000003 108.761 -178.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 391' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -86.64 -14.71 41.88 Favored 'General case' 0 C--O 1.199 -1.583 0 N-CA-C 114.552 1.316 . . . . 39.75 114.552 -179.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 392' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -91.22 135.49 33.76 Favored 'General case' 0 C--O 1.203 -1.381 0 C-N-CA 118.437 -1.305 . . . . 40.939999999999998 110.053 -176.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 393' ' ' ALA . . . . . . . . . . . . . . . -99.04 -27.36 13.88 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 118.907 -1.117 . . . . 37.119999999999997 111.443 179.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 394' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -128.33 146.42 59.6 Favored Pre-proline 0 CA--C 1.545 0.765 0 N-CA-C 114.23 1.196 . . . . 42.289999999999999 114.23 179.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 395' ' ' PRO . . . . . 0.41 ' CD ' ' OE1' ' X' ' 446' ' ' GLU . 84.7 Cg_exo -51.06 -38.26 59.22 Favored 'Trans proline' 0 C--N 1.353 0.808 0 N-CA-C 115.259 1.215 . . . . 36.609999999999999 115.259 179.67 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 396' ' ' SER . . . . . . . . . . . . . 49.9 p -68.5 -24.57 64.69 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 114.77 1.396 . . . . 34.880000000000003 114.77 178.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 397' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -59.51 -43.37 93.4 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 118.748 -1.181 . . . . 39.810000000000002 110.78 172.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 398' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -56.78 -54.96 40.28 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 122.087 0.946 . . . . 35.5 112.076 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 399' ' ' VAL . . . . . . . . . . . . . 56.1 t -51.39 -47.0 35.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 113.587 0.958 . . . . 34.759999999999998 113.587 175.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 400' ' ' LYS . . . . . . . . . . . . . 27.5 mttp -55.37 -46.33 76.5 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 118.122 -1.431 . . . . 34.509999999999998 111.596 -175.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 401' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -64.66 -42.83 95.14 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 119.98 -0.688 . . . . 43.149999999999999 110.915 175.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 402' ' ' VAL . . . . . . . . . . . . . 27.0 t -65.37 -55.18 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 109.248 -0.649 . . . . 36.539999999999999 109.248 178.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 403' ' ' GLN . . . . . . . . . . . . . 73.5 tp60 -51.87 -29.55 20.2 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 119.281 -0.968 . . . . 42.689999999999998 111.252 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 404' ' ' LEU . . . . . . . . . . . . . 39.1 tp -61.92 -33.64 74.61 Favored 'General case' 0 C--N 1.319 -0.749 0 O-C-N 121.515 -0.741 . . . . 38.670000000000002 112.261 175.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 405' ' ' ILE . . . . . . . . . . . . . 2.2 mt -65.85 -33.03 60.82 Favored 'Isoleucine or valine' 0 C--O 1.253 1.242 0 C-N-CA 119.58 -0.848 . . . . 37.689999999999998 110.427 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 406' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -81.82 -35.27 29.65 Favored 'General case' 0 CA--C 1.48 -1.713 0 CA-C-N 115.041 -0.981 . . . . 38.630000000000003 113.021 -175.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 407' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -67.84 -43.41 79.57 Favored 'General case' 0 C--O 1.207 -1.146 0 N-CA-C 109.115 -0.698 . . . . 41.030000000000001 109.115 177.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 408' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -58.14 -44.28 87.74 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 108.18 -1.044 . . . . 36.119999999999997 108.18 173.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 409' ' ' CYS . . . . . . . . . . . . . 3.5 t -61.83 -41.82 98.27 Favored 'General case' 0 C--N 1.309 -1.158 0 C-N-CA 119.231 -0.987 . . . . 40.270000000000003 112.607 -175.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 410' ' ' SER . . . . . . . . . . . . . 93.9 p -78.98 -20.08 50.05 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 119.672 -0.811 . . . . 38.789999999999999 110.663 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 411' ' ' LEU . . . . . . . . . . . . . 14.7 tp -71.93 -52.54 16.7 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 114.373 1.249 . . . . 41.43 114.373 174.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 412' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -90.48 11.67 21.01 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 118.724 0.693 . . . . 39.82 111.254 -173.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 413' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -138.23 132.7 32.18 Favored 'General case' 0 C--O 1.251 1.183 0 N-CA-C 114.053 1.131 . . . . 39.579999999999998 114.053 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 414' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.39 141.44 30.41 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-N 116.132 -0.486 . . . . 40.859999999999999 111.498 174.391 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 415' ' ' SER . . . . . 0.59 ' N ' ' O ' ' X' ' 16' ' ' HOH . 8.7 t -56.34 -29.69 61.67 Favored 'General case' 0 C--O 1.211 -0.963 0 C-N-CA 120.912 -0.315 . . . . 38.329999999999998 111.371 -174.095 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 416' ' ' ASN . . . . . . . . . . . . . 46.2 p30 -92.59 9.53 34.29 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 118.368 2.729 . . . . 37.18 118.368 -175.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 417' ' ' SER . . . . . . . . . . . . . 90.9 p -90.1 159.85 16.59 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 118.306 0.503 . . . . 38.170000000000002 111.565 -179.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 418' ' ' VAL . . . . . . . . . . . . . 15.6 t -59.94 -41.91 87.61 Favored 'Isoleucine or valine' 0 C--O 1.257 1.497 0 N-CA-C 107.34 -1.356 . . . . 37.109999999999999 107.34 -176.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 419' ' ' VAL . . . . . . . . . . . . . 84.7 t -65.15 -41.62 92.21 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.196 0 CA-C-N 114.869 -1.06 . . . . 37.240000000000002 108.606 -176.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 420' ' ' ALA . . . . . . . . . . . . . . . -68.72 -37.95 79.86 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 120.192 1.36 . . . . 35.32 111.6 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 421' ' ' ILE . . . . . . . . . . . . . 93.5 mt -65.95 -48.68 81.01 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.117 0 N-CA-C 113.144 0.794 . . . . 35.890000000000001 113.144 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 422' ' ' THR . . . . . . . . . . . . . 88.1 m -48.07 -42.3 28.31 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 109.043 -0.725 . . . . 36.780000000000001 109.043 173.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 423' ' ' GLY . . . . . . . . . . . . . . . -65.4 -38.91 95.44 Favored Glycine 0 CA--C 1.504 -0.622 0 CA-C-O 118.808 -0.996 . . . . 38.689999999999998 113.319 -175.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 424' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -74.2 -30.64 62.3 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.229 1.014 . . . . 47.469999999999999 108.591 -179.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 425' ' ' ASN . . . . . . . . . . . . . 43.2 m-20 -59.38 -60.25 4.15 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 115.43 -0.805 . . . . 44.799999999999997 109.199 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 426' ' ' ILE . . . . . . . . . . . . . 61.7 mt -60.32 -39.2 80.16 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.857 0 N-CA-C 113.88 1.067 . . . . 36.630000000000003 113.88 179.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 427' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -54.69 -46.3 74.08 Favored 'General case' 0 C--O 1.19 -2.07 0 C-N-CA 122.699 0.4 . . . . 45.579999999999998 110.603 175.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 428' ' ' THR . . . . . . . . . . . . . 97.9 m -71.7 -26.88 62.68 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.087 0.47 . . . . 38.340000000000003 110.183 -177.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 429' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -67.56 -51.25 52.87 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 122.463 1.125 . . . . 34.030000000000001 108.545 176.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 430' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -53.94 -61.57 2.22 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 114.413 -1.267 . . . . 34.590000000000003 109.598 176.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 431' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -57.79 -33.26 68.36 Favored 'General case' 0 CA--C 1.5 -0.969 0 O-C-N 121.482 -0.761 . . . . 36.93 110.8 -173.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 432' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -72.15 -39.2 68.93 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 118.824 -1.15 . . . . 35.32 111.452 -179.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 433' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -60.49 -33.95 73.34 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.627 0.771 . . . . 45.18 113.041 173.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 434' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.15 -37.08 64.01 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.956 -0.757 . . . . 36.729999999999997 108.956 174.614 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 435' ' ' ILE . . . . . . . . . . . . . 37.4 mt -76.78 -49.64 23.17 Favored 'Isoleucine or valine' 0 C--O 1.249 1.034 0 CA-C-O 121.941 0.877 . . . . 37.539999999999999 112.654 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 436' ' ' VAL . . . . . . . . . . . . . 56.7 t -67.49 -42.33 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.086 0 CA-C-N 114.725 -1.125 . . . . 37.159999999999997 109.386 -173.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 437' ' ' MSE . . . . . . . . . . . . . 43.4 mtt -76.75 -11.52 59.85 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 114.261 1.208 . . . . 47.189999999999998 114.261 178.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 438' ' ' GLY . . . . . . . . . . . . . . . 80.56 14.83 79.35 Favored Glycine 0 N--CA 1.473 1.117 0 N-CA-C 109.449 -1.46 . . . . 36.659999999999997 109.449 173.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 439' ' ' TYR . . . . . . . . . . . . . 22.3 t80 -69.66 -21.67 63.51 Favored 'General case' 0 C--O 1.206 -1.214 0 N-CA-C 111.919 0.34 . . . . 33.479999999999997 111.919 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 440' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -69.37 -19.39 63.84 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 120.798 0.332 . . . . 34.399999999999999 111.674 177.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 441' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -69.96 -35.61 74.61 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 112.337 0.495 . . . . 44.899999999999999 112.337 172.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 442' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -67.84 -36.97 81.27 Favored 'General case' 0 C--O 1.201 -1.468 0 CA-C-O 118.811 -0.614 . . . . 36.210000000000001 110.791 176.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 443' ' ' ILE . . . . . . . . . . . . . 22.6 mt -66.27 -46.6 86.81 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.719 0 O-C-N 123.41 0.444 . . . . 35.259999999999998 111.943 174.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 444' ' ' LEU . . . . . . . . . . . . . 13.8 tp -67.26 -35.0 78.61 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 118.56 -1.256 . . . . 34.060000000000002 109.789 -177.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 445' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -59.69 -25.07 64.47 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.057 0.943 . . . . 35.219999999999999 110.865 171.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 446' ' ' GLU . . . . . 0.41 ' OE1' ' CD ' ' X' ' 395' ' ' PRO . 41.0 tt0 -78.24 -45.69 22.25 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.419 0.896 . . . . 34.359999999999999 113.419 178.81 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 447' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -67.63 -32.41 73.09 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 123.129 0.572 . . . . 38.43 110.351 178.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 448' ' ' LYS . . . . . . . . . . . . . . . -68.52 -55.1 12.86 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.891 -0.595 . . . . 30.23 110.279 -179.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 449' ' ' ILE . . . . . . . . . . . . . 79.2 mt -51.53 -45.78 35.74 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.584 0 N-CA-C 109.088 -0.708 . . . . 27.32 109.088 174.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 450' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -66.9 -50.93 60.89 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 114.272 1.212 . . . . 30.75 114.272 -177.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 451' ' ' ASP . . . . . . . . . . . . . . . -61.98 -39.88 93.68 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 123.509 0.723 . . . . 27.329999999999998 109.928 -178.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 452' ' ' MSE . . . . . . . . . . . . . . . -50.73 -47.53 59.22 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 114.994 -1.003 . . . . 33.43 110.623 169.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 453' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -49.92 71.01 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 115.507 1.669 . . . . 27.23 115.507 -170.865 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 454' ' ' LYS . . . . . . . . . . . . . . . -63.69 -8.97 11.71 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.948 1.092 . . . . 27.07 113.948 -173.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 455' ' ' LEU . . . . . . . . . . . . . 4.8 mt . . . . . 0 C--O 1.253 1.242 0 N-CA-C 112.924 0.713 . . . . 27.399999999999999 112.924 -175.292 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 16' ' ' HOH . . . . . 0.59 ' O ' ' N ' ' X' ' 415' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 331' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 . . . . . 0 N--CA 1.51 2.537 0 N-CA-C 112.402 0.519 . . . . 40.939999999999998 112.402 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 332' ' ' GLY . . . . . . . . . . . . . . . 85.89 -119.67 5.17 Favored Glycine 0 N--CA 1.478 1.439 0 C-N-CA 123.482 0.563 . . . . 40.240000000000002 112.88 165.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 333' ' ' ASN . . . . . 0.428 ' C ' ' OD1' ' X' ' 333' ' ' ASN . 22.2 p30 -106.34 5.55 29.71 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 119.382 -0.927 . . . . 38.82 111.522 169.081 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 334' ' ' LYS . . . . . . . . . . . . . 9.0 mmtm -61.57 -36.31 80.28 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 112.67 0.619 . . . . 36.359999999999999 112.67 -176.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 335' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -65.19 -54.18 33.46 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 113.021 0.749 . . . . 37.57 113.021 -171.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 336' ' ' TRP . . . . . . . . . . . . . 42.3 p-90 -67.74 -26.55 66.2 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 114.787 1.403 . . . . 36.420000000000002 114.787 177.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 337' ' ' TYR . . . . . 0.467 ' CE1' ' HA2' ' X' ' 390' ' ' GLY . 0.8 OUTLIER -59.8 -43.16 94.58 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 106.866 -1.531 . . . . 37.810000000000002 106.866 172.271 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' X' X ' 338' ' ' LEU . . . . . . . . . . . . . 16.1 mt -69.78 -36.91 76.12 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 117.76 2.504 . . . . 34.009999999999998 117.76 -176.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 339' ' ' LEU . . . . . . . . . . . . . 10.1 mt -68.0 -41.11 82.77 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 118.585 0.63 . . . . 35.57 111.617 167.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 340' ' ' ALA . . . . . . . . . . . . . . . -55.67 -48.58 74.81 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.437 -0.505 . . . . 33.460000000000001 110.039 176.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 341' ' ' ASN . . . . . 0.426 ' O ' HG22 ' X' ' 344' ' ' ILE . 51.5 t30 -59.54 -38.47 81.12 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 119.325 -0.95 . . . . 36.07 112.626 176.091 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 342' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -66.61 -38.87 87.88 Favored 'General case' 0 C--O 1.245 0.86 0 O-C-N 121.525 -0.734 . . . . 49.170000000000002 111.342 176.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 343' ' ' LEU . . . . . 0.757 HD22 'SE ' ' X' ' 437' ' ' MSE . 0.0 OUTLIER -62.28 -51.27 68.39 Favored 'General case' 0 C--O 1.205 -1.283 0 CA-C-N 114.795 -1.093 . . . . 41.590000000000003 109.022 -177.183 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' X' X ' 344' ' ' ILE . . . . . 0.426 HG22 ' O ' ' X' ' 341' ' ' ASN . 6.8 tp -65.82 -24.33 34.02 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.896 0 N-CA-C 115.211 1.56 . . . . 39.229999999999997 115.211 177.246 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 345' ' ' LEU . . . . . . . . . . . . . 52.7 mt -79.5 -25.88 41.71 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 118.816 -1.154 . . . . 38.600000000000001 111.755 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 346' ' ' SER . . . . . . . . . . . . . 94.0 p -83.27 -32.47 26.38 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.522 0.729 . . . . 40.299999999999997 112.104 177.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 347' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.41 -50.83 70.49 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-O 121.01 0.434 . . . . 35.850000000000001 111.452 168.643 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 348' ' ' SER . . . . . 0.417 ' HB2' ' OE1' ' X' ' 357' ' ' GLU . 2.1 p -68.46 -19.82 64.59 Favored 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 113.98 1.104 . . . . 40.579999999999998 113.98 -175.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 349' ' ' LYS . . . . . . . . . . . . . 30.9 mtpt -88.78 -32.11 18.04 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 123.743 0.817 . . . . 42.759999999999998 112.019 177.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 350' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -54.84 150.8 9.39 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.984 0.514 . . . . 38.630000000000003 110.612 -173.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 351' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -38.71 113.7 0.32 Allowed 'General case' 0 C--O 1.249 1.058 0 N-CA-C 115.653 1.723 . . . . 45.009999999999998 115.653 173.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 352' ' ' GLY . . . . . . . . . . . . . . . 73.7 13.36 80.47 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 117.282 1.673 . . . . 39.0 117.282 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 353' ' ' GLY . . . . . . . . . . . . . . . -64.39 -33.7 87.94 Favored Glycine 0 C--O 1.214 -1.144 0 N-CA-C 116.104 1.202 . . . . 37.759999999999998 116.104 177.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 354' ' ' HIS . . . . . . . . . . . . . 20.9 p80 -54.55 -14.6 1.35 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.349 0.87 . . . . 36.009999999999998 113.349 -177.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 355' ' ' ILE . . . . . 0.618 HD12 HG21 ' X' ' 422' ' ' THR . 48.3 mt -65.25 -24.36 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-O 120.863 0.363 . . . . 36.409999999999997 110.357 175.912 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 356' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -114.07 19.61 16.32 Favored 'General case' 0 CA--C 1.486 -1.503 0 N-CA-C 112.636 0.606 . . . . 36.039999999999999 112.636 -170.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 357' ' ' GLU . . . . . 0.417 ' OE1' ' HB2' ' X' ' 348' ' ' SER . 24.5 tp10 -79.74 -56.33 4.36 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.891 -0.595 . . . . 42.619999999999997 110.978 -170.588 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 358' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.45 -175.91 2.81 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 124.085 0.866 . . . . 39.43 110.157 -179.719 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 359' ' ' LEU . . . . . . . . . . . . . 2.9 mt -108.37 137.55 46.14 Favored 'General case' 0 C--O 1.245 0.867 0 N-CA-C 107.778 -1.193 . . . . 43.659999999999997 107.778 -175.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 360' ' ' VAL . . . . . . . . . . . . . . . -51.45 100.82 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 O-C-N 124.449 1.093 . . . . 47.189999999999998 109.108 172.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 361' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.663 0 C-N-CA 122.894 0.477 . . . . 48.310000000000002 110.712 -178.052 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 367' ' ' CYS . . . . . . . . . . . . . 37.5 t . . . . . 0 CA--C 1.544 0.732 0 CA-C-O 121.41 0.624 . . . . 41.990000000000002 111.24 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 368' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -80.5 154.62 21.16 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 122.887 2.391 . . . . 37.5 112.613 -165.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 369' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -67.5 139.67 57.01 Favored 'General case' 0 CA--C 1.506 -0.75 0 N-CA-C 108.214 -1.032 . . . . 36.899999999999999 108.214 172.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 370' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -55.03 -48.18 73.74 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 112.588 0.588 . . . . 31.780000000000001 112.588 -176.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 371' ' ' TYR . . . . . . . . . . . . . 25.3 p90 -61.84 -15.33 41.18 Favored 'General case' 0 C--O 1.257 1.469 0 N-CA-C 115.294 1.59 . . . . 32.310000000000002 115.294 179.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 372' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -91.89 -21.84 20.38 Favored 'General case' 0 CA--C 1.491 -1.292 0 CA-C-O 121.379 0.609 . . . . 33.719999999999999 111.643 -177.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 373' ' ' VAL . . . . . . . . . . . . . 55.6 t -56.83 126.41 14.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 109.273 -0.64 . . . . 35.359999999999999 109.273 175.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 374' ' ' ILE . . . . . . . . . . . . . 79.8 mt -98.78 126.58 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 N-CA-C 108.254 -1.017 . . . . 35.700000000000003 108.254 -176.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 375' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -56.5 -53.41 57.83 Favored 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 120.472 -0.491 . . . . 39.560000000000002 111.633 -179.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 376' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -129.75 88.25 49.95 Favored Pre-proline 0 N--CA 1.475 0.819 0 CA-C-O 118.587 -0.72 . . . . 42.810000000000002 112.891 177.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 377' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -54.07 149.94 33.41 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 O-C-N 122.89 0.942 . . . . 32.460000000000001 109.944 174.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 378' ' ' MSE . . . . . . . . . . . . . 45.4 tpp -158.45 149.01 20.2 Favored 'General case' 0 C--O 1.196 -1.739 0 N-CA-C 108.49 -0.93 . . . . 42.18 108.49 174.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 379' ' ' SER . . . . . . . . . . . . . 10.8 p -150.65 163.74 37.8 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.219 -1.03 . . . . 36.280000000000001 108.219 176.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 380' ' ' PHE . . . . . . . . . . . . . 23.4 m-30 -56.34 -39.22 72.47 Favored 'General case' 0 C--O 1.256 1.422 0 N-CA-C 112.762 0.653 . . . . 37.469999999999999 112.762 176.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 381' ' ' SER . . . . . . . . . . . . . 3.5 m -57.61 -43.36 84.67 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 113.793 1.035 . . . . 40.579999999999998 113.793 174.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 382' ' ' CYS . . . . . . . . . . . . . 63.8 m -62.52 -36.63 83.18 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-O 121.236 0.541 . . . . 37.450000000000003 109.939 174.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 383' ' ' ILE . . . . . . . . . . . . . 27.8 mt -72.38 -48.69 46.69 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.576 0 C-N-CA 119.365 -0.934 . . . . 33.850000000000001 110.244 -174.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 384' ' ' LYS . . . . . . . . . . . . . 55.9 mttt -48.01 -37.77 15.57 Favored 'General case' 0 C--O 1.25 1.111 0 CA-C-N 115.753 -0.658 . . . . 35.670000000000002 110.543 173.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 385' ' ' THR . . . . . . . . . . . . . 95.6 m -75.24 -39.7 59.69 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 119.073 -1.051 . . . . 31.75 112.834 -176.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 386' ' ' LYS . . . . . . . . . . . . . 35.7 mttt -59.81 -36.73 77.37 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 122.235 -0.291 . . . . 38.07 110.626 174.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 387' ' ' LEU . . . . . . . . . . . . . 46.3 mt -67.04 -47.52 71.14 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 122.975 0.51 . . . . 31.34 111.173 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 388' ' ' LYS . . . . . . . . . . . . . 75.2 mttt -60.72 -32.0 71.28 Favored 'General case' 0 CA--C 1.504 -0.819 0 C-N-CA 120.238 -0.585 . . . . 41.490000000000002 110.796 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 389' ' ' LYS . . . . . . . . . . . . . 14.6 mttm -89.56 -13.81 36.48 Favored 'General case' 0 C--O 1.204 -1.32 0 CA-C-O 121.269 0.556 . . . . 44.159999999999997 111.365 -174.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 390' ' ' GLY . . . . . 0.467 ' HA2' ' CE1' ' X' ' 337' ' ' TYR . . . 72.41 42.65 48.28 Favored Glycine 0 C--O 1.199 -2.04 0 N-CA-C 108.761 -1.736 . . . . 33.200000000000003 108.761 -178.532 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 391' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -86.64 -14.71 41.88 Favored 'General case' 0 C--O 1.199 -1.583 0 N-CA-C 114.552 1.316 . . . . 39.75 114.552 -179.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 392' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -91.22 135.49 33.76 Favored 'General case' 0 C--O 1.203 -1.381 0 C-N-CA 118.437 -1.305 . . . . 40.939999999999998 110.053 -176.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 393' ' ' ALA . . . . . . . . . . . . . . . -99.04 -27.36 13.88 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 118.907 -1.117 . . . . 37.119999999999997 111.443 179.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 394' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -128.33 146.42 59.6 Favored Pre-proline 0 CA--C 1.545 0.765 0 N-CA-C 114.23 1.196 . . . . 42.289999999999999 114.23 179.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 395' ' ' PRO . . . . . 0.702 ' HD2' ' OE1' ' X' ' 446' ' ' GLU . 84.7 Cg_exo -51.06 -38.26 59.22 Favored 'Trans proline' 0 C--N 1.353 0.808 0 N-CA-C 115.259 1.215 . . . . 36.609999999999999 115.259 179.67 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 396' ' ' SER . . . . . . . . . . . . . 49.9 p -68.5 -24.57 64.69 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 114.77 1.396 . . . . 34.880000000000003 114.77 178.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 397' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -59.51 -43.37 93.4 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 118.748 -1.181 . . . . 39.810000000000002 110.78 172.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 398' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -56.78 -54.96 40.28 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 122.087 0.946 . . . . 35.5 112.076 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 399' ' ' VAL . . . . . . . . . . . . . 56.1 t -51.39 -47.0 35.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 113.587 0.958 . . . . 34.759999999999998 113.587 175.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 400' ' ' LYS . . . . . . . . . . . . . 27.5 mttp -55.37 -46.33 76.5 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 118.122 -1.431 . . . . 37.560000000000002 111.596 -175.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 401' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -64.66 -42.83 95.14 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 119.98 -0.688 . . . . 43.149999999999999 110.915 175.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 402' ' ' VAL . . . . . . . . . . . . . 27.0 t -65.37 -55.18 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 109.248 -0.649 . . . . 36.539999999999999 109.248 178.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 403' ' ' GLN . . . . . . . . . . . . . 73.5 tp60 -51.87 -29.55 20.2 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 119.281 -0.968 . . . . 42.689999999999998 111.252 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 404' ' ' LEU . . . . . . . . . . . . . 39.1 tp -61.92 -33.64 74.61 Favored 'General case' 0 C--N 1.319 -0.749 0 O-C-N 121.515 -0.741 . . . . 38.670000000000002 112.261 175.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 405' ' ' ILE . . . . . . . . . . . . . 2.2 mt -65.85 -33.03 60.82 Favored 'Isoleucine or valine' 0 C--O 1.253 1.242 0 C-N-CA 119.58 -0.848 . . . . 37.689999999999998 110.427 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 406' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -81.82 -35.27 29.65 Favored 'General case' 0 CA--C 1.48 -1.713 0 CA-C-N 115.041 -0.981 . . . . 38.630000000000003 113.021 -175.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 407' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -67.84 -43.41 79.57 Favored 'General case' 0 C--O 1.207 -1.146 0 N-CA-C 109.115 -0.698 . . . . 41.030000000000001 109.115 177.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 408' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -58.14 -44.28 87.74 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 108.18 -1.044 . . . . 36.119999999999997 108.18 173.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 409' ' ' CYS . . . . . . . . . . . . . 3.5 t -61.83 -41.82 98.27 Favored 'General case' 0 C--N 1.309 -1.158 0 C-N-CA 119.231 -0.987 . . . . 40.270000000000003 112.607 -175.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 410' ' ' SER . . . . . . . . . . . . . 93.9 p -78.98 -20.08 50.05 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 119.672 -0.811 . . . . 38.789999999999999 110.663 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 411' ' ' LEU . . . . . 0.538 HD23 ' CE2' ' X' ' 412' ' ' TYR . 14.7 tp -71.93 -52.54 16.7 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 114.373 1.249 . . . . 41.43 114.373 174.672 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 412' ' ' TYR . . . . . 0.538 ' CE2' HD23 ' X' ' 411' ' ' LEU . 96.9 m-85 -90.48 11.67 21.01 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 118.724 0.693 . . . . 39.82 111.254 -173.75 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 413' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -138.23 132.7 32.18 Favored 'General case' 0 C--O 1.251 1.183 0 N-CA-C 114.053 1.131 . . . . 39.579999999999998 114.053 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 414' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.39 141.44 30.41 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-N 116.132 -0.486 . . . . 40.859999999999999 111.498 174.391 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 415' ' ' SER . . . . . . . . . . . . . 8.7 t -56.34 -29.69 61.67 Favored 'General case' 0 C--O 1.211 -0.963 0 C-N-CA 120.912 -0.315 . . . . 38.329999999999998 111.371 -174.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 416' ' ' ASN . . . . . . . . . . . . . 46.2 p30 -92.59 9.53 34.29 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 118.368 2.729 . . . . 37.18 118.368 -175.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 417' ' ' SER . . . . . . . . . . . . . 90.9 p -90.1 159.85 16.59 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 118.306 0.503 . . . . 38.170000000000002 111.565 -179.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 418' ' ' VAL . . . . . . . . . . . . . 15.6 t -59.94 -41.91 87.61 Favored 'Isoleucine or valine' 0 C--O 1.257 1.497 0 N-CA-C 107.34 -1.356 . . . . 37.109999999999999 107.34 -176.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 419' ' ' VAL . . . . . 0.404 HG23 ' O ' ' X' ' 8' ' ' HOH . 84.7 t -65.15 -41.62 92.21 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.196 0 CA-C-N 114.869 -1.06 . . . . 37.240000000000002 108.606 -176.94 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 420' ' ' ALA . . . . . . . . . . . . . . . -68.72 -37.95 79.86 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 120.192 1.36 . . . . 35.32 111.6 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 421' ' ' ILE . . . . . . . . . . . . . 93.5 mt -65.95 -48.68 81.01 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.117 0 N-CA-C 113.144 0.794 . . . . 35.890000000000001 113.144 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 422' ' ' THR . . . . . 0.618 HG21 HD12 ' X' ' 355' ' ' ILE . 88.1 m -48.07 -42.3 28.31 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 109.043 -0.725 . . . . 36.780000000000001 109.043 173.021 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 423' ' ' GLY . . . . . . . . . . . . . . . -65.4 -38.91 95.44 Favored Glycine 0 CA--C 1.504 -0.622 0 CA-C-O 118.808 -0.996 . . . . 38.689999999999998 113.319 -175.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 424' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -74.2 -30.64 62.3 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.229 1.014 . . . . 47.469999999999999 108.591 -179.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 425' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' X' ' 422' ' ' THR . 43.2 m-20 -59.38 -60.25 4.15 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 115.43 -0.805 . . . . 44.799999999999997 109.199 178.547 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 426' ' ' ILE . . . . . . . . . . . . . 61.7 mt -60.32 -39.2 80.16 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.857 0 N-CA-C 113.88 1.067 . . . . 36.630000000000003 113.88 179.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 427' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -54.69 -46.3 74.08 Favored 'General case' 0 C--O 1.19 -2.07 0 C-N-CA 122.699 0.4 . . . . 45.579999999999998 110.603 175.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 428' ' ' THR . . . . . . . . . . . . . 97.9 m -71.7 -26.88 62.68 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.087 0.47 . . . . 38.340000000000003 110.183 -177.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 429' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -67.56 -51.25 52.87 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 122.463 1.125 . . . . 34.030000000000001 108.545 176.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 430' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -53.94 -61.57 2.22 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 114.413 -1.267 . . . . 34.590000000000003 109.598 176.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 431' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -57.79 -33.26 68.36 Favored 'General case' 0 CA--C 1.5 -0.969 0 O-C-N 121.482 -0.761 . . . . 36.93 110.8 -173.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 432' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -72.15 -39.2 68.93 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 118.824 -1.15 . . . . 35.32 111.452 -179.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 433' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -60.49 -33.95 73.34 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.627 0.771 . . . . 45.18 113.041 173.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 434' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.15 -37.08 64.01 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.956 -0.757 . . . . 36.729999999999997 108.956 174.614 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 435' ' ' ILE . . . . . . . . . . . . . 37.4 mt -76.78 -49.64 23.17 Favored 'Isoleucine or valine' 0 C--O 1.249 1.034 0 CA-C-O 121.941 0.877 . . . . 37.539999999999999 112.654 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 436' ' ' VAL . . . . . . . . . . . . . 56.7 t -67.49 -42.33 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.086 0 CA-C-N 114.725 -1.125 . . . . 37.159999999999997 109.386 -173.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 437' ' ' MSE . . . . . 0.757 'SE ' HD22 ' X' ' 343' ' ' LEU . 43.4 mtt -76.75 -11.52 59.85 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 114.261 1.208 . . . . 47.189999999999998 114.261 178.639 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 438' ' ' GLY . . . . . . . . . . . . . . . 80.56 14.83 79.35 Favored Glycine 0 N--CA 1.473 1.117 0 N-CA-C 109.449 -1.46 . . . . 36.659999999999997 109.449 173.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 439' ' ' TYR . . . . . . . . . . . . . 22.3 t80 -69.66 -21.67 63.51 Favored 'General case' 0 C--O 1.206 -1.214 0 N-CA-C 111.919 0.34 . . . . 33.479999999999997 111.919 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 440' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -69.37 -19.39 63.84 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 120.798 0.332 . . . . 34.399999999999999 111.674 177.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 441' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -69.96 -35.61 74.61 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 112.337 0.495 . . . . 44.899999999999999 112.337 172.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 442' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -67.84 -36.97 81.27 Favored 'General case' 0 C--O 1.201 -1.468 0 CA-C-O 118.811 -0.614 . . . . 36.210000000000001 110.791 176.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 443' ' ' ILE . . . . . . . . . . . . . 22.6 mt -66.27 -46.6 86.81 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.719 0 O-C-N 123.41 0.444 . . . . 35.259999999999998 111.943 174.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 444' ' ' LEU . . . . . . . . . . . . . 13.8 tp -67.26 -35.0 78.61 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 118.56 -1.256 . . . . 34.060000000000002 109.789 -177.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 445' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -59.69 -25.07 64.47 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.057 0.943 . . . . 35.219999999999999 110.865 171.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 446' ' ' GLU . . . . . 0.702 ' OE1' ' HD2' ' X' ' 395' ' ' PRO . 41.0 tt0 -78.24 -45.69 22.25 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.419 0.896 . . . . 34.359999999999999 113.419 178.81 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 447' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -67.63 -32.41 73.09 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 123.129 0.572 . . . . 38.43 110.351 178.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 448' ' ' LYS . . . . . . . . . . . . . . . -68.52 -55.1 12.86 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.891 -0.595 . . . . 30.23 110.279 -179.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 449' ' ' ILE . . . . . . . . . . . . . 79.2 mt -51.53 -45.78 35.74 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.584 0 N-CA-C 109.088 -0.708 . . . . 27.32 109.088 174.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 450' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -66.9 -50.93 60.89 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 114.272 1.212 . . . . 30.75 114.272 -177.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 451' ' ' ASP . . . . . . . . . . . . . . . -61.98 -39.88 93.68 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 123.509 0.723 . . . . 27.329999999999998 109.928 -178.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 452' ' ' MSE . . . . . . . . . . . . . . . -50.73 -47.53 59.22 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 114.994 -1.003 . . . . 33.43 110.623 169.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 453' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -49.92 71.01 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 115.507 1.669 . . . . 27.23 115.507 -170.865 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 454' ' ' LYS . . . . . . . . . . . . . . . -63.69 -8.97 11.71 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.948 1.092 . . . . 27.07 113.948 -173.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 455' ' ' LEU . . . . . . . . . . . . . 4.8 mt . . . . . 0 C--O 1.253 1.242 0 N-CA-C 112.924 0.713 . . . . 27.399999999999999 112.924 -175.292 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 8' ' ' HOH . . . . . 0.404 ' O ' HG23 ' X' ' 419' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 331' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 . . . . . 0 N--CA 1.51 2.537 0 N-CA-C 112.402 0.519 . . . . 40.94 112.402 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 332' ' ' GLY . . . . . . . . . . . . . . . 85.89 -119.67 5.17 Favored Glycine 0 N--CA 1.478 1.439 0 C-N-CA 123.482 0.563 . . . . 40.24 112.88 165.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 333' ' ' ASN . . . . . 0.428 ' C ' ' OD1' ' X' ' 333' ' ' ASN . 22.2 p30 -106.34 5.55 29.71 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 119.382 -0.927 . . . . 38.82 111.522 169.081 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 334' ' ' LYS . . . . . . . . . . . . . 9.0 mmtm -61.57 -36.31 80.28 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 112.67 0.619 . . . . 36.36 112.67 -176.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 335' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -65.19 -54.18 33.46 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 113.021 0.749 . . . . 37.57 113.021 -171.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 336' ' ' TRP . . . . . . . . . . . . . 42.3 p-90 -67.74 -26.55 66.2 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 114.787 1.403 . . . . 36.42 114.787 177.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 337' ' ' TYR . . . . . 0.467 ' CE1' ' HA2' ' X' ' 390' ' ' GLY . 0.8 OUTLIER -59.8 -43.16 94.58 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 106.866 -1.531 . . . . 37.81 106.866 172.271 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' X' X ' 338' ' ' LEU . . . . . . . . . . . . . 16.1 mt -69.78 -36.91 76.12 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 117.76 2.504 . . . . 34.01 117.76 -176.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 339' ' ' LEU . . . . . . . . . . . . . 10.1 mt -68.0 -41.11 82.77 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 118.585 0.63 . . . . 35.57 111.617 167.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 340' ' ' ALA . . . . . . . . . . . . . . . -55.67 -48.58 74.81 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.437 -0.505 . . . . 33.46 110.039 176.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 341' ' ' ASN . . . . . 0.426 ' O ' HG22 ' X' ' 344' ' ' ILE . 51.5 t30 -59.54 -38.47 81.12 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 119.325 -0.95 . . . . 36.07 112.626 176.091 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 342' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -66.61 -38.87 87.88 Favored 'General case' 0 C--O 1.245 0.86 0 O-C-N 121.525 -0.734 . . . . 49.17 111.342 176.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 343' ' ' LEU . . . . . 0.757 HD22 'SE ' ' X' ' 437' ' ' MSE . 0.0 OUTLIER -62.28 -51.27 68.39 Favored 'General case' 0 C--O 1.205 -1.283 0 CA-C-N 114.795 -1.093 . . . . 41.59 109.022 -177.183 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' X' X ' 344' ' ' ILE . . . . . 0.426 HG22 ' O ' ' X' ' 341' ' ' ASN . 6.8 tp -65.82 -24.33 34.02 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.896 0 N-CA-C 115.211 1.56 . . . . 39.23 115.211 177.246 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 345' ' ' LEU . . . . . . . . . . . . . 52.7 mt -79.5 -25.88 41.71 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 118.816 -1.154 . . . . 38.6 111.755 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 346' ' ' SER . . . . . . . . . . . . . 94.0 p -83.27 -32.47 26.38 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.522 0.729 . . . . 40.3 112.104 177.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 347' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.41 -50.83 70.49 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-O 121.01 0.434 . . . . 35.85 111.452 168.643 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 348' ' ' SER . . . . . 0.417 ' HB2' ' OE1' ' X' ' 357' ' ' GLU . 2.1 p -68.46 -19.82 64.59 Favored 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 113.98 1.104 . . . . 40.58 113.98 -175.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 349' ' ' LYS . . . . . . . . . . . . . 30.9 mtpt -88.78 -32.11 18.04 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 123.743 0.817 . . . . 42.76 112.019 177.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 350' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -54.84 150.8 9.39 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.984 0.514 . . . . 38.63 110.612 -173.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 351' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -38.71 113.7 0.32 Allowed 'General case' 0 C--O 1.249 1.058 0 N-CA-C 115.653 1.723 . . . . 45.01 115.653 173.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 352' ' ' GLY . . . . . . . . . . . . . . . 73.7 13.36 80.47 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 117.282 1.673 . . . . 39.0 117.282 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 353' ' ' GLY . . . . . . . . . . . . . . . -64.39 -33.7 87.94 Favored Glycine 0 C--O 1.214 -1.144 0 N-CA-C 116.104 1.202 . . . . 37.76 116.104 177.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 354' ' ' HIS . . . . . . . . . . . . . 20.9 p80 -54.55 -14.6 1.35 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.349 0.87 . . . . 36.01 113.349 -177.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 355' ' ' ILE . . . . . 0.618 HD12 HG21 ' X' ' 422' ' ' THR . 48.3 mt -65.25 -24.36 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-O 120.863 0.363 . . . . 36.41 110.357 175.912 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 356' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -114.07 19.61 16.32 Favored 'General case' 0 CA--C 1.486 -1.503 0 N-CA-C 112.636 0.606 . . . . 36.04 112.636 -170.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 357' ' ' GLU . . . . . 0.417 ' OE1' ' HB2' ' X' ' 348' ' ' SER . 24.5 tp10 -79.74 -56.33 4.36 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.891 -0.595 . . . . 42.62 110.978 -170.588 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 358' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.45 -175.91 2.81 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 124.085 0.866 . . . . 39.43 110.157 -179.719 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 359' ' ' LEU . . . . . . . . . . . . . 2.9 mt -108.37 137.55 46.14 Favored 'General case' 0 C--O 1.245 0.867 0 N-CA-C 107.778 -1.193 . . . . 43.66 107.778 -175.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 360' ' ' VAL . . . . . . . . . . . . . . . -51.45 100.82 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 O-C-N 124.449 1.093 . . . . 47.19 109.108 172.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 361' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.663 0 C-N-CA 122.894 0.477 . . . . 48.31 110.712 -178.052 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 367' ' ' CYS . . . . . . . . . . . . . 37.5 t . . . . . 0 CA--C 1.544 0.732 0 CA-C-O 121.41 0.624 . . . . 41.99 111.24 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 368' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -80.5 154.62 21.16 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 122.887 2.391 . . . . 37.5 112.613 -165.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 369' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -67.5 139.67 57.01 Favored 'General case' 0 CA--C 1.506 -0.75 0 N-CA-C 108.214 -1.032 . . . . 36.9 108.214 172.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 370' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -55.03 -48.18 73.74 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 112.588 0.588 . . . . 31.78 112.588 -176.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 371' ' ' TYR . . . . . . . . . . . . . 25.3 p90 -61.84 -15.33 41.18 Favored 'General case' 0 C--O 1.257 1.469 0 N-CA-C 115.294 1.59 . . . . 32.31 115.294 179.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 372' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -91.89 -21.84 20.38 Favored 'General case' 0 CA--C 1.491 -1.292 0 CA-C-O 121.379 0.609 . . . . 33.72 111.643 -177.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 373' ' ' VAL . . . . . . . . . . . . . 55.6 t -56.83 126.41 14.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 109.273 -0.64 . . . . 35.36 109.273 175.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 374' ' ' ILE . . . . . . . . . . . . . 79.8 mt -98.78 126.58 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 N-CA-C 108.254 -1.017 . . . . 35.7 108.254 -176.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 375' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -56.5 -53.41 57.83 Favored 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 120.472 -0.491 . . . . 39.56 111.633 -179.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 376' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -129.75 88.25 49.95 Favored Pre-proline 0 N--CA 1.475 0.819 0 CA-C-O 118.587 -0.72 . . . . 42.81 112.891 177.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 377' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -54.07 149.94 33.41 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 O-C-N 122.89 0.942 . . . . 32.46 109.944 174.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 378' ' ' MSE . . . . . . . . . . . . . 45.4 tpp -158.45 149.01 20.2 Favored 'General case' 0 C--O 1.196 -1.739 0 N-CA-C 108.49 -0.93 . . . . 42.18 108.49 174.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 379' ' ' SER . . . . . . . . . . . . . 10.8 p -150.65 163.74 37.8 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.219 -1.03 . . . . 36.28 108.219 176.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 380' ' ' PHE . . . . . . . . . . . . . 23.4 m-30 -56.34 -39.22 72.47 Favored 'General case' 0 C--O 1.256 1.422 0 N-CA-C 112.762 0.653 . . . . 37.47 112.762 176.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 381' ' ' SER . . . . . . . . . . . . . 3.5 m -57.61 -43.36 84.67 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 113.793 1.035 . . . . 40.58 113.793 174.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 382' ' ' CYS . . . . . . . . . . . . . 63.8 m -62.52 -36.63 83.18 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-O 121.236 0.541 . . . . 37.45 109.939 174.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 383' ' ' ILE . . . . . . . . . . . . . 27.8 mt -72.38 -48.69 46.69 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.576 0 C-N-CA 119.365 -0.934 . . . . 33.85 110.244 -174.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 384' ' ' LYS . . . . . . . . . . . . . 55.9 mttt -48.01 -37.77 15.57 Favored 'General case' 0 C--O 1.25 1.111 0 CA-C-N 115.753 -0.658 . . . . 35.67 110.543 173.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 385' ' ' THR . . . . . . . . . . . . . 95.6 m -75.24 -39.7 59.69 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 119.073 -1.051 . . . . 31.75 112.834 -176.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 386' ' ' LYS . . . . . . . . . . . . . 35.7 mttt -59.81 -36.73 77.37 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 122.235 -0.291 . . . . 38.07 110.626 174.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 387' ' ' LEU . . . . . . . . . . . . . 46.3 mt -67.04 -47.52 71.14 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 122.975 0.51 . . . . 31.34 111.173 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 388' ' ' LYS . . . . . . . . . . . . . 75.2 mttt -60.72 -32.0 71.28 Favored 'General case' 0 CA--C 1.504 -0.819 0 C-N-CA 120.238 -0.585 . . . . 41.49 110.796 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 389' ' ' LYS . . . . . . . . . . . . . 14.6 mttm -89.56 -13.81 36.48 Favored 'General case' 0 C--O 1.204 -1.32 0 CA-C-O 121.269 0.556 . . . . 44.16 111.365 -174.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 390' ' ' GLY . . . . . 0.467 ' HA2' ' CE1' ' X' ' 337' ' ' TYR . . . 72.41 42.65 48.28 Favored Glycine 0 C--O 1.199 -2.04 0 N-CA-C 108.761 -1.736 . . . . 33.2 108.761 -178.532 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 391' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -86.64 -14.71 41.88 Favored 'General case' 0 C--O 1.199 -1.583 0 N-CA-C 114.552 1.316 . . . . 39.75 114.552 -179.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 392' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -91.22 135.49 33.76 Favored 'General case' 0 C--O 1.203 -1.381 0 C-N-CA 118.437 -1.305 . . . . 40.94 110.053 -176.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 393' ' ' ALA . . . . . . . . . . . . . . . -99.04 -27.36 13.88 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 118.907 -1.117 . . . . 37.12 111.443 179.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 394' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -128.33 146.42 59.6 Favored Pre-proline 0 CA--C 1.545 0.765 0 N-CA-C 114.23 1.196 . . . . 42.29 114.23 179.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 395' ' ' PRO . . . . . 0.702 ' HD2' ' OE1' ' X' ' 446' ' ' GLU . 84.7 Cg_exo -51.06 -38.26 59.22 Favored 'Trans proline' 0 C--N 1.353 0.808 0 N-CA-C 115.259 1.215 . . . . 36.61 115.259 179.67 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 396' ' ' SER . . . . . . . . . . . . . 49.9 p -68.5 -24.57 64.69 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 114.77 1.396 . . . . 34.88 114.77 178.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 397' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -59.51 -43.37 93.4 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 118.748 -1.181 . . . . 39.81 110.78 172.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 398' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -56.78 -54.96 40.28 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-O 122.087 0.946 . . . . 35.5 112.076 175.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 399' ' ' VAL . . . . . . . . . . . . . 56.1 t -51.39 -47.0 35.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 113.587 0.958 . . . . 34.76 113.587 175.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 400' ' ' LYS . . . . . . . . . . . . . 27.5 mttp -55.37 -46.33 76.5 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 118.122 -1.431 . . . . 37.56 111.596 -175.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 401' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -64.66 -42.83 95.14 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 119.98 -0.688 . . . . 43.15 110.915 175.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 402' ' ' VAL . . . . . . . . . . . . . 27.0 t -65.37 -55.18 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 109.248 -0.649 . . . . 36.54 109.248 178.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 403' ' ' GLN . . . . . . . . . . . . . 73.5 tp60 -51.87 -29.55 20.2 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 119.281 -0.968 . . . . 42.69 111.252 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 404' ' ' LEU . . . . . . . . . . . . . 39.1 tp -61.92 -33.64 74.61 Favored 'General case' 0 C--N 1.319 -0.749 0 O-C-N 121.515 -0.741 . . . . 38.67 112.261 175.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 405' ' ' ILE . . . . . . . . . . . . . 2.2 mt -65.85 -33.03 60.82 Favored 'Isoleucine or valine' 0 C--O 1.253 1.242 0 C-N-CA 119.58 -0.848 . . . . 37.69 110.427 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 406' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -81.82 -35.27 29.65 Favored 'General case' 0 CA--C 1.48 -1.713 0 CA-C-N 115.041 -0.981 . . . . 38.63 113.021 -175.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 407' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -67.84 -43.41 79.57 Favored 'General case' 0 C--O 1.207 -1.146 0 N-CA-C 109.115 -0.698 . . . . 41.03 109.115 177.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 408' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -58.14 -44.28 87.74 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 108.18 -1.044 . . . . 36.12 108.18 173.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 409' ' ' CYS . . . . . . . . . . . . . 3.5 t -61.83 -41.82 98.27 Favored 'General case' 0 C--N 1.309 -1.158 0 C-N-CA 119.231 -0.987 . . . . 40.27 112.607 -175.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 410' ' ' SER . . . . . . . . . . . . . 93.9 p -78.98 -20.08 50.05 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 119.672 -0.811 . . . . 38.79 110.663 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 411' ' ' LEU . . . . . 0.538 HD23 ' CE2' ' X' ' 412' ' ' TYR . 14.7 tp -71.93 -52.54 16.7 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 114.373 1.249 . . . . 41.43 114.373 174.672 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 412' ' ' TYR . . . . . 0.538 ' CE2' HD23 ' X' ' 411' ' ' LEU . 96.9 m-85 -90.48 11.67 21.01 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 118.724 0.693 . . . . 39.82 111.254 -173.75 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 413' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -138.23 132.7 32.18 Favored 'General case' 0 C--O 1.251 1.183 0 N-CA-C 114.053 1.131 . . . . 39.58 114.053 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 414' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.39 141.44 30.41 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-N 116.132 -0.486 . . . . 40.86 111.498 174.391 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 415' ' ' SER . . . . . . . . . . . . . 8.7 t -56.34 -29.69 61.67 Favored 'General case' 0 C--O 1.211 -0.963 0 C-N-CA 120.912 -0.315 . . . . 38.33 111.371 -174.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 416' ' ' ASN . . . . . . . . . . . . . 46.2 p30 -92.59 9.53 34.29 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 118.368 2.729 . . . . 37.18 118.368 -175.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 417' ' ' SER . . . . . . . . . . . . . 90.9 p -90.1 159.85 16.59 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 118.306 0.503 . . . . 38.17 111.565 -179.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 418' ' ' VAL . . . . . . . . . . . . . 15.6 t -59.94 -41.91 87.61 Favored 'Isoleucine or valine' 0 C--O 1.257 1.497 0 N-CA-C 107.34 -1.356 . . . . 37.11 107.34 -176.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 419' ' ' VAL . . . . . 0.404 HG23 ' O ' ' X' ' 8' ' ' HOH . 84.7 t -65.15 -41.62 92.21 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.196 0 CA-C-N 114.869 -1.06 . . . . 37.24 108.606 -176.94 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 420' ' ' ALA . . . . . . . . . . . . . . . -68.72 -37.95 79.86 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 120.192 1.36 . . . . 35.32 111.6 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 421' ' ' ILE . . . . . . . . . . . . . 93.5 mt -65.95 -48.68 81.01 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.117 0 N-CA-C 113.144 0.794 . . . . 35.89 113.144 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 422' ' ' THR . . . . . 0.618 HG21 HD12 ' X' ' 355' ' ' ILE . 88.1 m -48.07 -42.3 28.31 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 109.043 -0.725 . . . . 36.78 109.043 173.021 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 423' ' ' GLY . . . . . . . . . . . . . . . -65.4 -38.91 95.44 Favored Glycine 0 CA--C 1.504 -0.622 0 CA-C-O 118.808 -0.996 . . . . 38.69 113.319 -175.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 424' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -74.2 -30.64 62.3 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.229 1.014 . . . . 47.47 108.591 -179.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 425' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' X' ' 422' ' ' THR . 43.2 m-20 -59.38 -60.25 4.15 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 115.43 -0.805 . . . . 44.8 109.199 178.547 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 426' ' ' ILE . . . . . . . . . . . . . 61.7 mt -60.32 -39.2 80.16 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.857 0 N-CA-C 113.88 1.067 . . . . 36.63 113.88 179.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 427' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -54.69 -46.3 74.08 Favored 'General case' 0 C--O 1.19 -2.07 0 C-N-CA 122.699 0.4 . . . . 45.58 110.603 175.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 428' ' ' THR . . . . . . . . . . . . . 97.9 m -71.7 -26.88 62.68 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.087 0.47 . . . . 38.34 110.183 -177.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 429' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -67.56 -51.25 52.87 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 122.463 1.125 . . . . 34.03 108.545 176.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 430' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -53.94 -61.57 2.22 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 114.413 -1.267 . . . . 34.59 109.598 176.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 431' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -57.79 -33.26 68.36 Favored 'General case' 0 CA--C 1.5 -0.969 0 O-C-N 121.482 -0.761 . . . . 36.93 110.8 -173.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 432' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -72.15 -39.2 68.93 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 118.824 -1.15 . . . . 35.32 111.452 -179.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 433' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -60.49 -33.95 73.34 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.627 0.771 . . . . 45.18 113.041 173.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 434' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.15 -37.08 64.01 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.956 -0.757 . . . . 36.73 108.956 174.614 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 435' ' ' ILE . . . . . . . . . . . . . 37.4 mt -76.78 -49.64 23.17 Favored 'Isoleucine or valine' 0 C--O 1.249 1.034 0 CA-C-O 121.941 0.877 . . . . 37.54 112.654 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 436' ' ' VAL . . . . . . . . . . . . . 56.7 t -67.49 -42.33 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.086 0 CA-C-N 114.725 -1.125 . . . . 37.16 109.386 -173.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 437' ' ' MSE . . . . . 0.757 'SE ' HD22 ' X' ' 343' ' ' LEU . 43.4 mtt -76.75 -11.52 59.85 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 114.261 1.208 . . . . 47.19 114.261 178.639 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 438' ' ' GLY . . . . . . . . . . . . . . . 80.56 14.83 79.35 Favored Glycine 0 N--CA 1.473 1.117 0 N-CA-C 109.449 -1.46 . . . . 36.66 109.449 173.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 439' ' ' TYR . . . . . . . . . . . . . 22.3 t80 -69.66 -21.67 63.51 Favored 'General case' 0 C--O 1.206 -1.214 0 N-CA-C 111.919 0.34 . . . . 33.48 111.919 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 440' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -69.37 -19.39 63.84 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 120.798 0.332 . . . . 34.4 111.674 177.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 441' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -69.96 -35.61 74.61 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 112.337 0.495 . . . . 44.9 112.337 172.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 442' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -67.84 -36.97 81.27 Favored 'General case' 0 C--O 1.201 -1.468 0 CA-C-O 118.811 -0.614 . . . . 36.21 110.791 176.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 443' ' ' ILE . . . . . . . . . . . . . 22.6 mt -66.27 -46.6 86.81 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.719 0 O-C-N 123.41 0.444 . . . . 35.26 111.943 174.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 444' ' ' LEU . . . . . . . . . . . . . 13.8 tp -67.26 -35.0 78.61 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 118.56 -1.256 . . . . 34.06 109.789 -177.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 445' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -59.69 -25.07 64.47 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.057 0.943 . . . . 35.22 110.865 171.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 446' ' ' GLU . . . . . 0.702 ' OE1' ' HD2' ' X' ' 395' ' ' PRO . 41.0 tt0 -78.24 -45.69 22.25 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.419 0.896 . . . . 34.36 113.419 178.81 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 447' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -67.63 -32.41 73.09 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 123.129 0.572 . . . . 38.43 110.351 178.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 448' ' ' LYS . . . . . . . . . . . . . . . -68.52 -55.1 12.86 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.891 -0.595 . . . . 30.23 110.279 -179.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 449' ' ' ILE . . . . . . . . . . . . . 79.2 mt -51.53 -45.78 35.74 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.584 0 N-CA-C 109.088 -0.708 . . . . 27.32 109.088 174.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 450' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -66.9 -50.93 60.89 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 114.272 1.212 . . . . 30.75 114.272 -177.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 451' ' ' ASP . . . . . . . . . . . . . . . -61.98 -39.88 93.68 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 123.509 0.723 . . . . 27.33 109.928 -178.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 452' ' ' MSE . . . . . . . . . . . . . . . -50.73 -47.53 59.22 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 114.994 -1.003 . . . . 33.43 110.623 169.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 453' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -49.92 71.01 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 115.507 1.669 . . . . 27.23 115.507 -170.865 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 454' ' ' LYS . . . . . . . . . . . . . . . -63.69 -8.97 11.71 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.948 1.092 . . . . 27.07 113.948 -173.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 455' ' ' LEU . . . . . . . . . . . . . 4.8 mt . . . . . 0 C--O 1.253 1.242 0 N-CA-C 112.924 0.713 . . . . 27.4 112.924 -175.292 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 8' ' ' HOH . . . . . 0.404 ' O ' HG23 ' X' ' 419' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_