data_6z3g_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6z3g _Structure_validation_residue.Date_analyzed 2020-06-26 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 397' ' ' LYS . . . . . . . . . . . . . 92.4 mttt . . . . . 0 C--O 1.232 0.169 0 N-CA-C 111.873 0.323 . . . . 193.72 111.873 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -109.41 167.38 10.16 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.937 0.875 . . . . 166.81 110.493 -178.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 399' ' ' ARG . . . . . . . . . . . . . 59.2 mtt85 -59.47 161.76 5.52 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.084 -0.962 . . . . 243.74000000000001 110.526 -176.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 400' ' ' CYS . . . . . . . . . . . . . 10.9 t -60.56 114.1 2.8 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.127 -0.942 . . . . 114.41 109.593 175.164 168.221 61.774 76.771 104.779 2.047 105.474 69.363 -177.23 1 1 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' SER . . . . . . . . . . . . . 57.6 p -142.88 167.61 21.66 Favored 'General case' 0 C--O 1.243 0.751 0 CA-C-O 121.97 0.891 . . . . 95.730000000000004 109.988 -174.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 -91.25 139.46 30.72 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 113.844 -1.525 . . . . 114.14 109.788 179.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -134.59 162.51 32.09 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.525 0.679 . . . . 157.75 109.187 -176.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 404' ' ' ALA . . . . . . . . . . . . . . . -70.34 135.48 48.88 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.688 -0.687 . . . . 151.30000000000001 110.575 -177.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 405' ' ' LEU . . . . . . . . . . . . . 45.8 tp -141.96 110.63 6.14 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 107.722 -1.214 . . . . 108.03 107.722 170.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 406' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -90.77 131.52 36.39 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 123.535 0.522 . . . . 122.06 109.659 -179.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 407' ' ' VAL . . . . . . . . . . . . . 39.2 t -111.85 116.82 53.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 107.522 -1.288 . . . . 111.15000000000001 107.522 -177.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 408' ' ' ASN . . . . . . . . . . . . . 33.0 t-20 -114.13 109.88 19.12 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 108.111 -1.07 . . . . 147.91 108.111 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 409' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -69.0 -28.71 66.84 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 112.202 0.445 . . . . 141.91 112.202 -177.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . . . -63.37 -34.45 77.74 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 119.6 -0.84 . . . . 163.22 111.193 176.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 411' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -66.77 -24.41 66.19 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.958 -0.297 . . . . 161.93000000000001 111.684 179.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 34.1 mtt -97.79 10.16 40.82 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.631 0.604 . . . . 176.78999999999999 112.631 -176.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . 65.89 8.83 43.68 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.584 -0.817 . . . . 200.50999999999999 114.845 -178.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 414' ' ' TRP . . . . . . . . . . . . . 39.8 m0 -80.39 9.52 5.76 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 118.264 1.032 . . . . 148.41999999999999 112.513 175.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 415' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -65.81 -19.97 66.08 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.534 -0.466 . . . . 189.00999999999999 111.551 171.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 416' ' ' ASP . . . . . . . . . . . . . 40.5 p-10 -74.44 -6.05 46.06 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 113.272 0.841 . . . . 168.81999999999999 113.272 -177.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 417' ' ' TRP . . . . . . . . . . . . . 17.1 p-90 -143.53 -24.63 0.58 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 114.549 1.314 . . . . 153.03 114.549 178.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 418' ' ' ILE . . . . . . . . . . . . . 39.1 mt -86.46 130.27 36.95 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 CA-C-N 120.21 1.368 . . . . 116.27 109.54 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 59.2 mt -85.67 -72.4 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 108.769 -0.826 . . . . 129.16 108.769 175.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 420' ' ' ALA . . . . . . . . . . . . . . . -140.18 149.29 57.67 Favored Pre-proline 0 C--O 1.238 0.461 0 N-CA-C 109.13 -0.692 . . . . 128.88999999999999 109.13 178.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 421' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -77.29 173.41 57.97 Favored 'Cis proline' 0 CA--C 1.515 -0.458 0 C-N-CA 125.931 -0.446 . . . . 129.22 111.671 -4.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 84.5 mt -101.91 -12.39 18.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.775 0.658 . . . . 159.03 112.775 176.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 423' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -164.37 152.0 12.06 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 108.918 -0.771 . . . . 148.36000000000001 108.918 -178.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 424' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -157.76 163.42 38.11 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.702 0.763 . . . . 113.97 109.882 178.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 425' ' ' GLU . . . . . . . . . . . . . 29.8 tp10 -86.51 118.11 25.73 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 114.934 -1.03 . . . . 147.84 109.842 175.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 426' ' ' ALA . . . . . . . . . . . . . . . -108.02 -27.59 10.06 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 114.045 1.128 . . . . 99.620000000000005 114.045 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 427' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 68.07 167.55 0.26 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.252 0.549 . . . . 98.870000000000005 111.394 -177.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 428' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -152.62 166.59 31.61 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.282 -1.377 . . . . 128.91 107.282 173.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 73.4 m -108.22 142.62 38.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.819 -0.628 . . . . 98.519999999999996 109.78 -177.556 -63.095 -67.758 -84.026 103.825 2.044 104.275 -80.146 -58.35 1 1 . 1 . 001 ecloud orig full ' A' A ' 430' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -163.3 136.3 5.54 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.175 -1.046 . . . . 182.97999999999999 108.175 -178.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 431' ' ' GLY . . . . . . . . . . . . . . . 149.62 167.12 13.83 Favored Glycine 0 N--CA 1.451 -0.301 0 CA-C-O 122.342 0.968 . . . . 112.06999999999999 111.647 175.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 56.7 mt -75.86 141.81 42.32 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.331 -0.935 . . . . 126.02 111.014 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 433' ' ' CYS . . . . . . . . . . . . . 30.7 m -118.29 77.0 1.12 Allowed 'General case' 0 C--O 1.232 0.16 0 N-CA-C 107.937 -1.134 . . . . 155.94 107.937 177.18 -78.727 -77.901 -88.603 104.272 2.052 104.954 -80.419 -62.209 1 1 . 1 . 001 ecloud orig full ' A' A ' 434' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -116.84 168.2 10.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.809 0.814 . . . . 182.91999999999999 110.128 -179.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 435' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -78.26 135.34 61.9 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.069 -0.969 . . . . 177.06999999999999 110.359 -175.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -90.45 170.16 27.86 Favored 'Cis proline' 0 C--N 1.347 0.483 0 CA-C-N 118.36 0.45 . . . . 139.11000000000001 112.773 -1.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 437' ' ' LEU . . . . . . . . . . . . . 51.7 mt -96.31 143.21 27.58 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.947 -0.39 . . . . 154.83000000000001 109.947 -178.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 34.1 ttp180 -78.4 161.68 26.97 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 121.803 0.811 . . . . 185.69 110.84 -174.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 439' ' ' SER . . . . . . . . . . . . . 30.8 t -62.56 -45.17 94.17 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.22 -0.9 . . . . 204.16 111.451 -177.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 440' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -67.77 -12.66 61.05 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 112.965 0.728 . . . . 218.84 112.965 -177.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 45.3 mt -75.1 -26.55 59.36 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.095 -0.642 . . . . 158.34999999999999 111.564 175.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 31.96 68.6 0.85 Allowed Pre-proline 0 C--N 1.353 0.726 0 C-N-CA 128.795 2.838 . . . . 148.28999999999999 113.186 179.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 443' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -91.93 -178.23 1.04 Allowed 'Trans proline' 0 C--N 1.331 -0.372 0 C-N-CA 120.166 0.577 . . . . 121.73 113.298 -164.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 80.3 p -85.86 152.27 23.13 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.411 0.624 . . . . 99.989999999999995 110.134 179.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 445' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -49.46 -46.3 47.77 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 115.255 -0.884 . . . . 102.52 111.1 177.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 446' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -57.21 -43.74 83.04 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.93 -0.308 . . . . 120.73 111.612 173.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.98 -41.4 91.94 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 119.386 -0.925 . . . . 79.75 110.97 178.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 448' ' ' VAL . . . . . . . . . . . . . 86.3 t -60.7 -49.17 85.6 Favored 'Isoleucine or valine' 0 C--O 1.239 0.539 0 CA-C-O 121.417 0.627 . . . . 104.93000000000001 110.1 178.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 97.7 mt -64.81 -44.1 96.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 116.083 -0.508 . . . . 103.59 110.813 -175.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -64.57 -39.18 93.27 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 121.944 -0.473 . . . . 101.84 111.031 179.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 56.9 m -63.27 -45.94 89.17 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 119.134 -1.026 . . . . 109.17 110.815 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 65.5 tp -61.27 -41.39 96.85 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.927 -0.709 . . . . 128.03 111.139 -179.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 453' ' ' MET . . . . . . . . . . . . . 54.2 mtm -67.58 -38.58 84.26 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.256 -0.577 . . . . 141.19999999999999 111.691 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 454' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -61.88 -36.87 82.53 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.749 -0.781 . . . . 141.41999999999999 110.545 175.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 455' ' ' SER . . . . . . . . . . . . . 29.9 t -64.95 -40.83 95.62 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.416 -0.513 . . . . 132.91 111.156 176.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 456' ' ' MET . . . . . . . . . . . . . 78.0 mtp -65.46 -50.86 63.78 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.697 -0.401 . . . . 167.78999999999999 111.525 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -145.1 99.63 4.6 Favored Pre-proline 0 C--O 1.242 0.691 0 N-CA-C 108.115 -1.069 . . . . 155.22999999999999 108.115 -178.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -67.07 -15.46 46.72 Favored 'Trans proline' 0 C--O 1.238 0.508 0 N-CA-C 113.585 0.571 . . . . 138.55000000000001 113.585 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -77.24 -31.81 55.35 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.441 0.564 . . . . 194.06999999999999 112.103 178.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 460' ' ' SER . . . . . . . . . . . . . 80.8 p -95.47 -14.73 23.47 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.229 0.825 . . . . 151.16 113.229 -177.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 461' ' ' THR . . . . . . . . . . . . . 2.9 m -143.56 124.9 8.18 Favored Pre-proline 0 C--O 1.247 0.968 0 N-CA-C 109.648 -0.501 . . . . 127.22 109.648 -179.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -84.75 154.25 11.66 Favored 'Trans proline' 0 C--O 1.241 0.675 0 C-N-CA 120.659 0.906 . . . . 127.97 110.55 176.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.3 157.25 59.91 Favored 'Trans proline' 0 C--O 1.236 0.391 0 CA-C-O 121.884 0.702 . . . . 121.79000000000001 111.623 -178.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 33.2 p -66.88 177.18 1.76 Allowed 'General case' 0 C--O 1.239 0.527 0 CA-C-N 114.708 -1.133 . . . . 115.31999999999999 110.013 172.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 465' ' ' CYS . . . . . . . . . . . . . 49.0 t -121.67 156.25 33.44 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 122.15 0.976 . . . . 158.74000000000001 111.452 -174.661 -174.15 0.0 0.0 0.0 0.0 0.0 0.0 -174.15 1 1 . 1 . 001 ecloud orig full ' A' A ' 466' ' ' CYS . . . . . . . . . . . . . 46.8 t -89.78 110.64 21.54 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.423 -0.954 . . . . 111.44 108.423 -179.131 -177.23 69.363 76.771 105.474 2.047 104.779 61.774 168.221 1 1 . 1 . 001 ecloud orig full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 35.5 m -137.81 166.29 27.39 Favored Pre-proline 0 C--O 1.239 0.501 0 CA-C-O 121.538 0.685 . . . . 103.55 109.96 -175.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 468' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -68.95 127.89 15.94 Favored 'Trans proline' 0 CA--C 1.517 -0.362 0 C-N-CA 120.264 0.643 . . . . 92.420000000000002 111.504 176.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 469' ' ' THR . . . . . . . . . . . . . 29.9 p -107.64 -18.91 13.71 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 114.058 1.132 . . . . 103.09999999999999 114.058 175.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -137.06 134.89 37.0 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.218 0.917 . . . . 175.72 108.899 169.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 6.2 mp -129.39 158.38 39.31 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.825 0.822 . . . . 94.549999999999997 110.098 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 472' ' ' SER . . . . . . . . . . . . . 68.9 m -118.05 159.86 41.32 Favored Pre-proline 0 N--CA 1.447 -0.587 0 CA-C-N 114.841 -1.072 . . . . 97.739999999999995 109.309 174.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 473' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -89.69 168.62 4.8 Favored 'Trans proline' 0 C--N 1.33 -0.412 0 C-N-CA 120.554 0.836 . . . . 103.90000000000001 111.031 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 9.8 pt -134.88 157.09 40.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 108.377 -0.971 . . . . 108.33 108.377 162.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 38.3 m -103.04 123.54 46.82 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.151 -0.932 . . . . 156.31 108.941 -178.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 476' ' ' ILE . . . . . . . . . . . . . 27.3 mt -114.84 141.46 31.36 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 123.91 0.884 . . . . 108.48 109.153 -179.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 8.1 tp -109.31 123.63 49.61 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.898 -1.149 . . . . 109.72 107.898 176.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 478' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -147.17 174.48 11.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.778 0.799 . . . . 123.93000000000001 110.434 -174.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 479' ' ' ILE . . . . . . . . . . . . . 54.5 mt -113.28 118.13 57.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 N-CA-C 107.942 -1.133 . . . . 146.03 107.942 175.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 50.3 p-10 -84.7 -153.91 0.17 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.123 0.487 . . . . 143.24000000000001 111.654 -175.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 481' ' ' SER . . . . . . . . . . . . . 2.5 p -66.82 -50.76 61.58 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.423 -0.808 . . . . 163.81999999999999 111.663 -177.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -77.54 19.71 0.35 Allowed 'General case' 0 C--O 1.236 0.382 0 N-CA-C 113.405 0.891 . . . . 192.66999999999999 113.405 -173.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 483' ' ' ASN . . . . . . . . . . . . . 64.3 t30 56.97 46.61 19.16 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.902 0.858 . . . . 183.06999999999999 110.9 -179.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 484' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -120.31 134.37 55.28 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.367 -0.833 . . . . 141.40000000000001 108.869 179.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 485' ' ' VAL . . . . . . . . . . . . . 21.7 t -83.79 128.33 38.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 N-CA-C 109.362 -0.607 . . . . 122.47 109.362 177.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 486' ' ' VAL . . . . . . . . . . . . . 66.7 t -127.67 127.16 68.21 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 C-N-CA 123.919 0.887 . . . . 106.76000000000001 109.267 -170.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -98.68 105.57 17.73 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 108.173 -1.047 . . . . 164.37 108.173 169.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -120.86 139.43 53.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.849 0.356 . . . . 144.44 110.698 -173.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 489' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -90.97 98.12 11.59 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.128 -1.064 . . . . 133.44 108.128 174.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -78.62 130.5 35.97 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 109.866 -0.42 . . . . 140.43000000000001 109.866 173.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 491' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -89.7 164.86 14.53 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.577 0.703 . . . . 119.73999999999999 110.832 -177.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 48.7 62.39 2.59 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.011 -0.995 . . . . 107.37 110.96 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 89.0 mmm -115.82 -31.98 5.61 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 114.636 -1.165 . . . . 120.75 113.862 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 94.2 t -120.72 114.92 45.36 Favored 'Isoleucine or valine' 0 C--O 1.24 0.597 0 N-CA-C 108.635 -0.876 . . . . 93.120000000000005 108.635 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 60.3 t -61.2 128.88 23.24 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 C-N-CA 120.449 -0.501 . . . . 93.209999999999994 110.03 174.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -117.45 -22.16 8.31 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 114.195 1.183 . . . . 118.98 114.195 179.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 77.9 p -150.8 150.14 30.6 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 108.301 -1.0 . . . . 124.95 108.301 166.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 69.5 m -108.31 158.68 17.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.561 -0.745 . . . . 98.340000000000003 109.772 174.505 -58.35 -80.146 -84.026 104.275 2.044 103.825 -67.758 -63.095 1 1 . 1 . 001 ecloud orig full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . -161.54 -176.14 33.32 Favored Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 108.92 -1.672 . . . . 116.68000000000001 108.92 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 500' ' ' CYS . . . . . . . . . . . . . 71.7 m -112.25 132.0 55.18 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 114.887 -0.656 . . . . 114.38 109.778 -177.839 -62.209 -80.419 -88.603 104.954 2.052 104.272 -77.901 -78.727 1 1 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' ARG . . . . . . . . . . . . . 62.5 mmt-85 . . . . . 0 CA--C 1.541 0.633 0 N-CA-C 113.892 1.071 . . . . 115.76000000000001 113.892 -171.808 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo . . . . . 0 C--O 1.232 0.185 0 N-CA-C 112.622 0.201 . . . . 235.27000000000001 112.622 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' CYS . . . . . . . . . . . . . 43.0 t -68.95 144.23 54.21 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.492 0.663 . . . . 302.77999999999997 110.347 178.463 176.91 69.334 102.906 104.686 2.032 104.95 -92.362 -54.252 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . . . -144.79 52.58 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.613 0.72 . . . . 229.56 110.191 -177.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 2.4 pp -83.97 -18.41 9.93 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 O-C-N 121.71 -0.619 . . . . 241.56 111.798 172.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 94.0 mt -69.89 -14.08 62.56 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.295 0.48 . . . . 226.06 112.295 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -77.75 -41.65 36.88 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.338 0.517 . . . . 247.69 111.146 171.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' CYS . . . . . . . . . . . . . 59.4 m -63.42 -31.03 72.08 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.202 -0.599 . . . . 292.20999999999998 110.998 171.209 -55.215 -70.605 -88.181 105.503 2.036 105.672 -80.603 -162.041 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -71.56 -13.09 61.68 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.681 0.622 . . . . 272.44 112.681 173.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 75.3 m -112.75 -1.75 14.63 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 112.589 0.588 . . . . 243.93000000000001 112.589 174.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -101.86 -52.9 3.07 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.294 0.638 . . . . 259.22000000000003 112.43 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -71.05 -41.47 70.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.612 -0.435 . . . . 293.54000000000002 111.101 175.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' TRP . . . . . . . . . . . . . 60.3 t-105 -68.01 -17.93 64.56 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 112.474 0.546 . . . . 325.69999999999999 112.474 -178.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 99.4 p -100.97 -8.42 22.43 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 113.309 0.855 . . . . 317.41000000000003 113.309 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 118.344 0.52 . . . . 252.19999999999999 111.123 179.795 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 pm0 . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.684 0.278 . . . . 249.99000000000001 110.794 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -102.71 168.11 9.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.772 0.796 . . . . 261.67000000000002 110.189 176.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' CYS . . . . . . . . . . . . . 17.8 m -104.11 29.02 6.25 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.319 -0.855 . . . . 293.94 112.288 -179.699 -47.306 -146.469 -79.792 104.331 2.032 104.389 -68.666 -58.886 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.4 -11.91 60.89 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.563 0.579 . . . . 264.31 112.563 176.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -103.35 -30.44 10.6 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 113.331 0.863 . . . . 263.91000000000003 113.331 178.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 56.7 tp -69.46 -36.87 76.98 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.38 -0.528 . . . . 277.49000000000001 111.201 178.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 -65.3 -31.89 73.26 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.368 -0.533 . . . . 324.94 111.122 172.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 34.5 t -64.71 -37.56 88.0 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.373 -0.531 . . . . 321.13999999999999 111.034 174.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -68.48 -38.98 81.52 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 120.515 -0.474 . . . . 341.75999999999999 111.104 175.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.1 -40.94 91.39 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.231 -0.588 . . . . 311.58999999999997 111.064 175.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 78.4 mt -68.46 -37.47 80.21 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.56 -0.456 . . . . 346.37 111.436 177.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' CYS . . . . . . . . . . . . . 8.1 t -60.92 -40.22 92.37 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.786 -0.366 . . . . 340.61000000000001 111.039 176.656 -162.041 -80.603 -88.181 105.672 2.036 105.503 -70.605 -55.215 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 18.5 p -75.83 -36.55 59.61 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.447 -0.501 . . . . 307.92000000000002 111.871 -179.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 70.2 mtm180 -77.92 -14.84 59.41 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 113.109 0.781 . . . . 287.60000000000002 113.109 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . . . -63.99 -22.91 67.13 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 118.741 0.701 . . . . 284.73000000000002 111.798 172.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' THR . . . . . . . . . . . . . 77.9 p -121.34 55.08 1.09 Allowed 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.853 -0.425 . . . . 262.08999999999997 109.853 173.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' ALA . . . . . . . . . . . . . . . -79.8 8.67 6.33 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 113.444 0.905 . . . . 269.31 113.444 -175.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -129.73 -40.23 1.39 Allowed 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.868 0.692 . . . . 265.31999999999999 112.868 178.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 70.9 p -65.9 -32.82 74.55 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.474 0.546 . . . . 273.02999999999997 112.474 -171.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' CYS . . . . . . . . . . . . . 57.2 m -97.83 30.97 2.79 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.782 0.66 . . . . 330.95999999999998 112.782 -172.845 -54.252 -92.362 102.906 104.95 2.032 104.686 69.334 176.91 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' ARG . . . . . . . . . . . . . 2.0 mmt85 -80.63 88.93 5.7 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 108.191 -1.04 . . . . 272.75999999999999 108.191 177.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . 149.44 -38.22 0.95 Allowed Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.712 -0.676 . . . . 176.97999999999999 112.75 -175.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -66.75 127.55 32.89 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.728 -0.471 . . . . 210.69999999999999 109.728 176.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 26.9 mt -63.11 -35.76 81.34 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 120.009 -0.676 . . . . 168.22999999999999 111.219 -179.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.33 -29.69 69.94 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.081 0.4 . . . . 179.99000000000001 112.081 -176.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -65.6 -53.45 41.64 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.591 -0.444 . . . . 256.79000000000002 111.346 178.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 -64.59 -34.22 77.75 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 120.622 -0.431 . . . . 203.40000000000001 111.03 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 47.8 t -62.34 -44.3 96.8 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.962 -0.295 . . . . 216.52000000000001 111.395 175.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.41 -38.84 81.63 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.582 -0.447 . . . . 214.31999999999999 111.358 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 72.3 t -61.58 -48.46 88.66 Favored 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-O 121.202 0.525 . . . . 234.08000000000001 110.407 177.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -67.18 -32.62 73.83 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 119.583 -0.847 . . . . 289.27999999999997 111.888 -179.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -69.31 -36.67 79.13 Favored Glycine 0 C--N 1.336 0.567 0 C-N-CA 119.932 -1.127 . . . . 285.31 112.677 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 97.7 mt -64.18 -39.9 87.15 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 O-C-N 122.299 -0.53 . . . . 282.27999999999997 110.208 173.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -60.18 -42.29 94.69 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.155 -0.618 . . . . 307.88999999999999 111.306 174.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -64.22 -48.86 74.22 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.912 0.387 . . . . 355.62 111.227 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.72 -18.31 64.86 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.453 0.538 . . . . 332.64999999999998 112.453 179.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' MET . . . . . . . . . . . . . 45.1 tpp -70.78 -34.0 71.33 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 118.29 0.496 . . . . 333.44999999999999 111.707 177.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 50.9 m -102.7 29.77 5.12 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 122.942 0.497 . . . . 335.56999999999999 112.225 -179.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -118.99 -44.8 2.59 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.167 0.802 . . . . 333.23000000000002 113.167 179.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -96.86 14.12 26.39 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 112.739 0.644 . . . . 329.01999999999998 112.739 179.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 57.54 81.22 0.15 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 123.542 0.737 . . . . 316.37 111.411 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' CYS . . . . . . . . . . . . . 76.6 m -106.16 60.05 0.65 Allowed 'General case' 0 C--O 1.237 0.411 0 N-CA-C 111.444 0.165 . . . . 296.01999999999998 111.444 -179.141 -58.886 -68.666 -79.792 104.389 2.032 104.331 -146.469 -47.306 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 35.6 t . . . . . 0 N--CA 1.463 0.197 0 C-N-CA 123.297 0.639 . . . . 276.14999999999998 112.07 179.365 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 601' ' ' CIT . . . . . 0.419 ' O3 ' ' O7 ' ' A' ' 601' ' ' CIT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 397' ' ' LYS . . . . . . . . . . . . . 92.4 mttt . . . . . 0 C--O 1.232 0.169 0 N-CA-C 111.873 0.323 . . . . 193.72 111.873 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -109.41 167.38 10.16 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.937 0.875 . . . . 166.81 110.493 -178.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 399' ' ' ARG . . . . . . . . . . . . . 59.2 mtt85 -59.47 161.76 5.52 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.084 -0.962 . . . . 243.74 110.526 -176.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 400' ' ' CYS . . . . . 0.498 ' HA ' ' HA3' ' A' ' 431' ' ' GLY . 10.9 t -60.56 114.1 2.8 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.127 -0.942 . . . . 114.41 109.593 175.164 168.221 61.774 76.771 104.779 2.047 105.474 69.363 -177.23 2 2 . 1 . 001 ecloud build full ' A' A ' 401' ' ' SER . . . . . . . . . . . . . 57.6 p -142.88 167.61 21.66 Favored 'General case' 0 C--O 1.243 0.751 0 CA-C-O 121.97 0.891 . . . . 95.73 109.988 -174.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 402' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 -91.25 139.46 30.72 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 113.844 -1.525 . . . . 114.14 109.788 179.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 403' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -134.59 162.51 32.09 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.525 0.679 . . . . 157.75 109.187 -176.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 404' ' ' ALA . . . . . . . . . . . . . . . -70.34 135.48 48.88 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.688 -0.687 . . . . 151.3 110.575 -177.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 405' ' ' LEU . . . . . 0.41 HD22 ' HB3' ' A' ' 428' ' ' HIS . 45.8 tp -141.96 110.63 6.14 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 107.722 -1.214 . . . . 108.03 107.722 170.48 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 406' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -90.77 131.52 36.39 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 123.535 0.522 . . . . 122.06 109.659 -179.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 407' ' ' VAL . . . . . . . . . . . . . 39.2 t -111.85 116.82 53.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 107.522 -1.288 . . . . 111.15 107.522 -177.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 408' ' ' ASN . . . . . . . . . . . . . 33.0 t-20 -114.13 109.88 19.12 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 108.111 -1.07 . . . . 147.91 108.111 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 409' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -69.0 -28.71 66.84 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 112.202 0.445 . . . . 141.91 112.202 -177.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . . . -63.37 -34.45 77.74 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 119.6 -0.84 . . . . 163.22 111.193 176.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 411' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -66.77 -24.41 66.19 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.958 -0.297 . . . . 161.93 111.684 179.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 34.1 mtt -97.79 10.16 40.82 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.631 0.604 . . . . 176.79 112.631 -176.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . 65.89 8.83 43.68 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.584 -0.817 . . . . 200.51 114.845 -178.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 414' ' ' TRP . . . . . . . . . . . . . 39.8 m0 -80.39 9.52 5.76 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 118.264 1.032 . . . . 148.42 112.513 175.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 415' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -65.81 -19.97 66.08 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.534 -0.466 . . . . 189.01 111.551 171.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 416' ' ' ASP . . . . . . . . . . . . . 40.5 p-10 -74.44 -6.05 46.06 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 113.272 0.841 . . . . 168.82 113.272 -177.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 417' ' ' TRP . . . . . . . . . . . . . 17.1 p-90 -143.53 -24.63 0.58 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 114.549 1.314 . . . . 153.03 114.549 178.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 418' ' ' ILE . . . . . . . . . . . . . 39.1 mt -86.46 130.27 36.95 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 CA-C-N 120.21 1.368 . . . . 116.27 109.54 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 59.2 mt -85.67 -72.4 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 108.769 -0.826 . . . . 129.16 108.769 175.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 420' ' ' ALA . . . . . . . . . . . . . . . -140.18 149.29 57.67 Favored Pre-proline 0 C--O 1.238 0.461 0 N-CA-C 109.13 -0.692 . . . . 128.89 109.13 178.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 421' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -77.29 173.41 57.97 Favored 'Cis proline' 0 CA--C 1.515 -0.458 0 C-N-CA 125.931 -0.446 . . . . 129.22 111.671 -4.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 84.5 mt -101.91 -12.39 18.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.775 0.658 . . . . 159.03 112.775 176.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 423' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -164.37 152.0 12.06 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 108.918 -0.771 . . . . 148.36 108.918 -178.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 424' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -157.76 163.42 38.11 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.702 0.763 . . . . 113.97 109.882 178.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 425' ' ' GLU . . . . . . . . . . . . . 29.8 tp10 -86.51 118.11 25.73 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 114.934 -1.03 . . . . 147.84 109.842 175.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 426' ' ' ALA . . . . . . . . . . . . . . . -108.02 -27.59 10.06 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 114.045 1.128 . . . . 99.62 114.045 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 427' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 68.07 167.55 0.26 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.252 0.549 . . . . 98.87 111.394 -177.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 428' ' ' HIS . . . . . 0.41 ' HB3' HD22 ' A' ' 405' ' ' LEU . 8.9 p80 -152.62 166.59 31.61 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.282 -1.377 . . . . 128.91 107.282 173.363 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 73.4 m -108.22 142.62 38.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.819 -0.628 . . . . 98.52 109.78 -177.556 -63.095 -67.758 -84.026 103.825 2.044 104.275 -80.146 -58.35 1 1 . 1 . 001 ecloud build full ' A' A ' 430' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -163.3 136.3 5.54 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.175 -1.046 . . . . 182.98 108.175 -178.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 431' ' ' GLY . . . . . 0.498 ' HA3' ' HA ' ' A' ' 400' ' ' CYS . . . 149.62 167.12 13.83 Favored Glycine 0 N--CA 1.451 -0.301 0 CA-C-O 122.342 0.968 . . . . 112.07 111.647 175.044 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 56.7 mt -75.86 141.81 42.32 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.331 -0.935 . . . . 126.02 111.014 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 433' ' ' CYS . . . . . . . . . . . . . 30.7 m -118.29 77.0 1.12 Allowed 'General case' 0 C--O 1.232 0.16 0 N-CA-C 107.937 -1.134 . . . . 155.94 107.937 177.18 -78.727 -77.901 -88.603 104.272 2.052 104.954 -80.419 -62.209 1 1 . 1 . 001 ecloud build full ' A' A ' 434' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -116.84 168.2 10.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.809 0.814 . . . . 182.92 110.128 -179.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 435' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -78.26 135.34 61.9 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.069 -0.969 . . . . 177.07 110.359 -175.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -90.45 170.16 27.86 Favored 'Cis proline' 0 C--N 1.347 0.483 0 CA-C-N 118.36 0.45 . . . . 139.11 112.773 -1.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 437' ' ' LEU . . . . . . . . . . . . . 51.7 mt -96.31 143.21 27.58 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.947 -0.39 . . . . 154.83 109.947 -178.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 34.1 ttp180 -78.4 161.68 26.97 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 121.803 0.811 . . . . 185.69 110.84 -174.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 439' ' ' SER . . . . . . . . . . . . . 30.8 t -62.56 -45.17 94.17 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.22 -0.9 . . . . 204.16 111.451 -177.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 440' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -67.77 -12.66 61.05 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 112.965 0.728 . . . . 218.84 112.965 -177.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 45.3 mt -75.1 -26.55 59.36 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.095 -0.642 . . . . 158.35 111.564 175.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 31.96 68.6 0.85 Allowed Pre-proline 0 C--N 1.353 0.726 0 C-N-CA 128.795 2.838 . . . . 148.29 113.186 179.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 443' ' ' PRO . . . . . 0.539 ' HA ' ' NH1' ' A' ' 501' ' ' ARG . 37.2 Cg_endo -91.93 -178.23 1.04 Allowed 'Trans proline' 0 C--N 1.331 -0.372 0 C-N-CA 120.166 0.577 . . . . 121.73 113.298 -164.822 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 80.3 p -85.86 152.27 23.13 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.411 0.624 . . . . 99.99 110.134 179.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 445' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -49.46 -46.3 47.77 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 115.255 -0.884 . . . . 102.52 111.1 177.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 446' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -57.21 -43.74 83.04 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.93 -0.308 . . . . 120.73 111.612 173.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.98 -41.4 91.94 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 119.386 -0.925 . . . . 79.75 110.97 178.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 448' ' ' VAL . . . . . . . . . . . . . 86.3 t -60.7 -49.17 85.6 Favored 'Isoleucine or valine' 0 C--O 1.239 0.539 0 CA-C-O 121.417 0.627 . . . . 104.93 110.1 178.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 97.7 mt -64.81 -44.1 96.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 116.083 -0.508 . . . . 103.59 110.813 -175.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -64.57 -39.18 93.27 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 121.944 -0.473 . . . . 101.84 111.031 179.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 56.9 m -63.27 -45.94 89.17 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 119.134 -1.026 . . . . 109.17 110.815 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 65.5 tp -61.27 -41.39 96.85 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.927 -0.709 . . . . 128.03 111.139 -179.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 453' ' ' MET . . . . . . . . . . . . . 54.2 mtm -67.58 -38.58 84.26 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.256 -0.577 . . . . 141.2 111.691 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 454' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -61.88 -36.87 82.53 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.749 -0.781 . . . . 141.42 110.545 175.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 455' ' ' SER . . . . . . . . . . . . . 29.9 t -64.95 -40.83 95.62 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.416 -0.513 . . . . 132.91 111.156 176.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 456' ' ' MET . . . . . . . . . . . . . 78.0 mtp -65.46 -50.86 63.78 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.697 -0.401 . . . . 167.79 111.525 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -145.1 99.63 4.6 Favored Pre-proline 0 C--O 1.242 0.691 0 N-CA-C 108.115 -1.069 . . . . 155.23 108.115 -178.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -67.07 -15.46 46.72 Favored 'Trans proline' 0 C--O 1.238 0.508 0 N-CA-C 113.585 0.571 . . . . 138.55 113.585 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -77.24 -31.81 55.35 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.441 0.564 . . . . 194.07 112.103 178.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 460' ' ' SER . . . . . . . . . . . . . 80.8 p -95.47 -14.73 23.47 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.229 0.825 . . . . 151.16 113.229 -177.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 461' ' ' THR . . . . . . . . . . . . . 2.9 m -143.56 124.9 8.18 Favored Pre-proline 0 C--O 1.247 0.968 0 N-CA-C 109.648 -0.501 . . . . 127.22 109.648 -179.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -84.75 154.25 11.66 Favored 'Trans proline' 0 C--O 1.241 0.675 0 C-N-CA 120.659 0.906 . . . . 127.97 110.55 176.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.3 157.25 59.91 Favored 'Trans proline' 0 C--O 1.236 0.391 0 CA-C-O 121.884 0.702 . . . . 121.79 111.623 -178.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 33.2 p -66.88 177.18 1.76 Allowed 'General case' 0 C--O 1.239 0.527 0 CA-C-N 114.708 -1.133 . . . . 115.32 110.013 172.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 465' ' ' CYS . . . . . . . . . . . . . 49.0 t -121.67 156.25 33.44 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 122.15 0.976 . . . . 158.74 111.452 -174.661 -174.15 0.0 0.0 0.0 0.0 0.0 0.0 -174.15 1 1 . 1 . 001 ecloud build full ' A' A ' 466' ' ' CYS . . . . . . . . . . . . . 46.8 t -89.78 110.64 21.54 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.423 -0.954 . . . . 111.44 108.423 -179.131 -177.23 69.363 76.771 105.474 2.047 104.779 61.774 168.221 1 1 . 1 . 001 ecloud build full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 35.5 m -137.81 166.29 27.39 Favored Pre-proline 0 C--O 1.239 0.501 0 CA-C-O 121.538 0.685 . . . . 103.55 109.96 -175.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 468' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -68.95 127.89 15.94 Favored 'Trans proline' 0 CA--C 1.517 -0.362 0 C-N-CA 120.264 0.643 . . . . 92.42 111.504 176.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 469' ' ' THR . . . . . . . . . . . . . 29.9 p -107.64 -18.91 13.71 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 114.058 1.132 . . . . 103.1 114.058 175.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -137.06 134.89 37.0 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.218 0.917 . . . . 175.72 108.899 169.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 6.2 mp -129.39 158.38 39.31 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.825 0.822 . . . . 94.55 110.098 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 472' ' ' SER . . . . . . . . . . . . . 68.9 m -118.05 159.86 41.32 Favored Pre-proline 0 N--CA 1.447 -0.587 0 CA-C-N 114.841 -1.072 . . . . 97.74 109.309 174.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 473' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -89.69 168.62 4.8 Favored 'Trans proline' 0 C--N 1.33 -0.412 0 C-N-CA 120.554 0.836 . . . . 103.9 111.031 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 9.8 pt -134.88 157.09 40.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 108.377 -0.971 . . . . 108.33 108.377 162.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 38.3 m -103.04 123.54 46.82 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.151 -0.932 . . . . 156.31 108.941 -178.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 476' ' ' ILE . . . . . . . . . . . . . 27.3 mt -114.84 141.46 31.36 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 123.91 0.884 . . . . 108.48 109.153 -179.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 8.1 tp -109.31 123.63 49.61 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.898 -1.149 . . . . 109.72 107.898 176.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 478' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -147.17 174.48 11.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.778 0.799 . . . . 123.93 110.434 -174.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 479' ' ' ILE . . . . . . . . . . . . . 54.5 mt -113.28 118.13 57.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 N-CA-C 107.942 -1.133 . . . . 146.03 107.942 175.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 50.3 p-10 -84.7 -153.91 0.17 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.123 0.487 . . . . 143.24 111.654 -175.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 481' ' ' SER . . . . . 0.458 ' HB3' ' O ' ' B' ' 91' ' ' ARG . 2.5 p -66.82 -50.76 61.58 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.423 -0.808 . . . . 163.82 111.663 -177.945 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -77.54 19.71 0.35 Allowed 'General case' 0 C--O 1.236 0.382 0 N-CA-C 113.405 0.891 . . . . 192.67 113.405 -173.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 483' ' ' ASN . . . . . . . . . . . . . 64.3 t30 56.97 46.61 19.16 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.902 0.858 . . . . 183.07 110.9 -179.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 484' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -120.31 134.37 55.28 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.367 -0.833 . . . . 141.4 108.869 179.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 485' ' ' VAL . . . . . . . . . . . . . 21.7 t -83.79 128.33 38.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 N-CA-C 109.362 -0.607 . . . . 122.47 109.362 177.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 486' ' ' VAL . . . . . . . . . . . . . 66.7 t -127.67 127.16 68.21 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 C-N-CA 123.919 0.887 . . . . 106.76 109.267 -170.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -98.68 105.57 17.73 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 108.173 -1.047 . . . . 164.37 108.173 169.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -120.86 139.43 53.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.849 0.356 . . . . 144.44 110.698 -173.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 489' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -90.97 98.12 11.59 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.128 -1.064 . . . . 133.44 108.128 174.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -78.62 130.5 35.97 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 109.866 -0.42 . . . . 140.43 109.866 173.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 491' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -89.7 164.86 14.53 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.577 0.703 . . . . 119.74 110.832 -177.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 48.7 62.39 2.59 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.011 -0.995 . . . . 107.37 110.96 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 89.0 mmm -115.82 -31.98 5.61 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 114.636 -1.165 . . . . 120.75 113.862 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 94.2 t -120.72 114.92 45.36 Favored 'Isoleucine or valine' 0 C--O 1.24 0.597 0 N-CA-C 108.635 -0.876 . . . . 93.12 108.635 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 60.3 t -61.2 128.88 23.24 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 C-N-CA 120.449 -0.501 . . . . 93.21 110.03 174.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -117.45 -22.16 8.31 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 114.195 1.183 . . . . 118.98 114.195 179.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 77.9 p -150.8 150.14 30.6 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 108.301 -1.0 . . . . 124.95 108.301 166.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 69.5 m -108.31 158.68 17.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.561 -0.745 . . . . 98.34 109.772 174.505 -58.35 -80.146 -84.026 104.275 2.044 103.825 -67.758 -63.095 1 1 . 1 . 001 ecloud build full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . -161.54 -176.14 33.32 Favored Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 108.92 -1.672 . . . . 116.68 108.92 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 500' ' ' CYS . . . . . . . . . . . . . 71.7 m -112.25 132.0 55.18 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 114.887 -0.656 . . . . 114.38 109.778 -177.839 -62.209 -80.419 -88.603 104.954 2.052 104.272 -77.901 -78.727 1 1 . 1 . 001 ecloud build full ' A' A ' 501' ' ' ARG . . . . . 0.539 ' NH1' ' HA ' ' A' ' 443' ' ' PRO . 62.5 mmt-85 . . . . . 0 CA--C 1.541 0.633 0 N-CA-C 113.892 1.071 . . . . 115.76 113.892 -171.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo . . . . . 0 C--O 1.232 0.185 0 N-CA-C 112.622 0.201 . . . . 235.27 112.622 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 48' ' ' CYS . . . . . . . . . . . . . 43.0 t -68.95 144.23 54.21 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.492 0.663 . . . . 302.78 110.347 178.463 176.91 69.334 102.906 104.686 2.032 104.95 -92.362 -54.252 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . . . -144.79 52.58 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.613 0.72 . . . . 229.56 110.191 -177.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 2.4 pp -83.97 -18.41 9.93 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 O-C-N 121.71 -0.619 . . . . 241.56 111.798 172.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' LEU . . . . . 0.55 HD23 HD22 ' B' ' 54' ' ' ASN . 94.0 mt -69.89 -14.08 62.56 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.295 0.48 . . . . 226.06 112.295 179.354 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -77.75 -41.65 36.88 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.338 0.517 . . . . 247.69 111.146 171.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' CYS . . . . . . . . . . . . . 59.4 m -63.42 -31.03 72.08 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.202 -0.599 . . . . 292.21 110.998 171.209 -55.215 -70.605 -88.181 105.503 2.036 105.672 -80.603 -162.041 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ASN . . . . . 0.55 HD22 HD23 ' B' ' 51' ' ' LEU . 95.3 m-20 -71.56 -13.09 61.68 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.681 0.622 . . . . 272.44 112.681 173.115 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 75.3 m -112.75 -1.75 14.63 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 112.589 0.588 . . . . 243.93 112.589 174.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -101.86 -52.9 3.07 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.294 0.638 . . . . 259.22 112.43 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -71.05 -41.47 70.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.612 -0.435 . . . . 293.54 111.101 175.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' TRP . . . . . . . . . . . . . 60.3 t-105 -68.01 -17.93 64.56 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 112.474 0.546 . . . . 325.7 112.474 -178.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 99.4 p -100.97 -8.42 22.43 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 113.309 0.855 . . . . 317.41 113.309 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 118.344 0.52 . . . . 252.2 111.123 179.795 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 pm0 . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.684 0.278 . . . . 249.99 110.794 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -102.71 168.11 9.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.772 0.796 . . . . 261.67 110.189 176.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' CYS . . . . . . . . . . . . . 17.8 m -104.11 29.02 6.25 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.319 -0.855 . . . . 293.94 112.288 -179.699 -47.306 -146.469 -79.792 104.331 2.032 104.389 -68.666 -58.886 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.4 -11.91 60.89 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.563 0.579 . . . . 264.31 112.563 176.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -103.35 -30.44 10.6 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 113.331 0.863 . . . . 263.91 113.331 178.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 56.7 tp -69.46 -36.87 76.98 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.38 -0.528 . . . . 277.49 111.201 178.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 -65.3 -31.89 73.26 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.368 -0.533 . . . . 324.94 111.122 172.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 34.5 t -64.71 -37.56 88.0 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.373 -0.531 . . . . 321.14 111.034 174.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -68.48 -38.98 81.52 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 120.515 -0.474 . . . . 341.76 111.104 175.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.1 -40.94 91.39 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.231 -0.588 . . . . 311.59 111.064 175.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 78.4 mt -68.46 -37.47 80.21 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.56 -0.456 . . . . 346.37 111.436 177.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' CYS . . . . . . . . . . . . . 8.1 t -60.92 -40.22 92.37 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.786 -0.366 . . . . 340.61 111.039 176.656 -162.041 -80.603 -88.181 105.672 2.036 105.503 -70.605 -55.215 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 18.5 p -75.83 -36.55 59.61 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.447 -0.501 . . . . 307.92 111.871 -179.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 70.2 mtm180 -77.92 -14.84 59.41 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 113.109 0.781 . . . . 287.6 113.109 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . . . -63.99 -22.91 67.13 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 118.741 0.701 . . . . 284.73 111.798 172.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' THR . . . . . . . . . . . . . 77.9 p -121.34 55.08 1.09 Allowed 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.853 -0.425 . . . . 262.09 109.853 173.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' ALA . . . . . . . . . . . . . . . -79.8 8.67 6.33 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 113.444 0.905 . . . . 269.31 113.444 -175.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' ARG . . . . . 0.458 ' O ' ' HB3' ' A' ' 481' ' ' SER . 97.1 mtt180 -129.73 -40.23 1.39 Allowed 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.868 0.692 . . . . 265.32 112.868 178.442 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 70.9 p -65.9 -32.82 74.55 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.474 0.546 . . . . 273.03 112.474 -171.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' CYS . . . . . . . . . . . . . 57.2 m -97.83 30.97 2.79 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.782 0.66 . . . . 330.96 112.782 -172.845 -54.252 -92.362 102.906 104.95 2.032 104.686 69.334 176.91 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' ARG . . . . . . . . . . . . . 2.0 mmt85 -80.63 88.93 5.7 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 108.191 -1.04 . . . . 272.76 108.191 177.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . 149.44 -38.22 0.95 Allowed Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.712 -0.676 . . . . 176.98 112.75 -175.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -66.75 127.55 32.89 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.728 -0.471 . . . . 210.7 109.728 176.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 26.9 mt -63.11 -35.76 81.34 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 120.009 -0.676 . . . . 168.23 111.219 -179.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.33 -29.69 69.94 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.081 0.4 . . . . 179.99 112.081 -176.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -65.6 -53.45 41.64 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.591 -0.444 . . . . 256.79 111.346 178.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 -64.59 -34.22 77.75 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 120.622 -0.431 . . . . 203.4 111.03 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 47.8 t -62.34 -44.3 96.8 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.962 -0.295 . . . . 216.52 111.395 175.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.41 -38.84 81.63 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.582 -0.447 . . . . 214.32 111.358 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 72.3 t -61.58 -48.46 88.66 Favored 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-O 121.202 0.525 . . . . 234.08 110.407 177.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -67.18 -32.62 73.83 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 119.583 -0.847 . . . . 289.28 111.888 -179.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -69.31 -36.67 79.13 Favored Glycine 0 C--N 1.336 0.567 0 C-N-CA 119.932 -1.127 . . . . 285.31 112.677 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 97.7 mt -64.18 -39.9 87.15 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 O-C-N 122.299 -0.53 . . . . 282.28 110.208 173.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -60.18 -42.29 94.69 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.155 -0.618 . . . . 307.89 111.306 174.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -64.22 -48.86 74.22 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.912 0.387 . . . . 355.62 111.227 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.72 -18.31 64.86 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.453 0.538 . . . . 332.65 112.453 179.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' MET . . . . . . . . . . . . . 45.1 tpp -70.78 -34.0 71.33 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 118.29 0.496 . . . . 333.45 111.707 177.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 50.9 m -102.7 29.77 5.12 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 122.942 0.497 . . . . 335.57 112.225 -179.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -118.99 -44.8 2.59 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.167 0.802 . . . . 333.23 113.167 179.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -96.86 14.12 26.39 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 112.739 0.644 . . . . 329.02 112.739 179.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 57.54 81.22 0.15 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 123.542 0.737 . . . . 316.37 111.411 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' CYS . . . . . . . . . . . . . 76.6 m -106.16 60.05 0.65 Allowed 'General case' 0 C--O 1.237 0.411 0 N-CA-C 111.444 0.165 . . . . 296.02 111.444 -179.141 -58.886 -68.666 -79.792 104.389 2.032 104.331 -146.469 -47.306 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 35.6 t . . . . . 0 N--CA 1.463 0.197 0 C-N-CA 123.297 0.639 . . . . 276.15 112.07 179.365 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 601' ' ' CIT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 397' ' ' LYS . . . . . . . . . . . . . 92.4 mttt . . . . . 0 C--O 1.232 0.169 0 N-CA-C 111.873 0.323 . . . . 193.72 111.873 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -109.41 167.38 10.16 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.937 0.875 . . . . 166.81 110.493 -178.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 399' ' ' ARG . . . . . . . . . . . . . 59.2 mtt85 -59.47 161.76 5.52 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.084 -0.962 . . . . 243.74 110.526 -176.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 400' ' ' CYS . . . . . 0.498 ' HA ' ' HA3' ' A' ' 431' ' ' GLY . 10.9 t -60.56 114.1 2.8 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.127 -0.942 . . . . 114.41 109.593 175.164 168.221 61.774 76.771 104.779 2.047 105.474 69.363 -177.23 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' SER . . . . . . . . . . . . . 57.6 p -142.88 167.61 21.66 Favored 'General case' 0 C--O 1.243 0.751 0 CA-C-O 121.97 0.891 . . . . 95.73 109.988 -174.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 -91.25 139.46 30.72 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 113.844 -1.525 . . . . 114.14 109.788 179.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 403' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -134.59 162.51 32.09 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.525 0.679 . . . . 157.75 109.187 -176.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 404' ' ' ALA . . . . . . . . . . . . . . . -70.34 135.48 48.88 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.688 -0.687 . . . . 151.3 110.575 -177.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 405' ' ' LEU . . . . . 0.41 HD22 ' HB3' ' A' ' 428' ' ' HIS . 45.8 tp -141.96 110.63 6.14 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 107.722 -1.214 . . . . 108.03 107.722 170.48 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 406' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -90.77 131.52 36.39 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 123.535 0.522 . . . . 122.06 109.659 -179.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 407' ' ' VAL . . . . . . . . . . . . . 39.2 t -111.85 116.82 53.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 107.522 -1.288 . . . . 111.15 107.522 -177.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 408' ' ' ASN . . . . . . . . . . . . . 33.0 t-20 -114.13 109.88 19.12 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 108.111 -1.07 . . . . 147.91 108.111 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 409' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -69.0 -28.71 66.84 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 112.202 0.445 . . . . 141.91 112.202 -177.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . . . -63.37 -34.45 77.74 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 119.6 -0.84 . . . . 163.22 111.193 176.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 411' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -66.77 -24.41 66.19 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.958 -0.297 . . . . 161.93 111.684 179.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 412' ' ' MET . . . . . . . . . . . . . 34.1 mtt -97.79 10.16 40.82 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.631 0.604 . . . . 176.79 112.631 -176.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . 65.89 8.83 43.68 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.584 -0.817 . . . . 200.51 114.845 -178.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 414' ' ' TRP . . . . . . . . . . . . . 39.8 m0 -80.39 9.52 5.76 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 118.264 1.032 . . . . 148.42 112.513 175.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 415' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -65.81 -19.97 66.08 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.534 -0.466 . . . . 189.01 111.551 171.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 416' ' ' ASP . . . . . . . . . . . . . 40.5 p-10 -74.44 -6.05 46.06 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 113.272 0.841 . . . . 168.82 113.272 -177.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 417' ' ' TRP . . . . . . . . . . . . . 17.1 p-90 -143.53 -24.63 0.58 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 114.549 1.314 . . . . 153.03 114.549 178.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 418' ' ' ILE . . . . . . . . . . . . . 39.1 mt -86.46 130.27 36.95 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 CA-C-N 120.21 1.368 . . . . 116.27 109.54 177.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 59.2 mt -85.67 -72.4 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 108.769 -0.826 . . . . 129.16 108.769 175.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 420' ' ' ALA . . . . . . . . . . . . . . . -140.18 149.29 57.67 Favored Pre-proline 0 C--O 1.238 0.461 0 N-CA-C 109.13 -0.692 . . . . 128.89 109.13 178.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 421' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -77.29 173.41 57.97 Favored 'Cis proline' 0 CA--C 1.515 -0.458 0 C-N-CA 125.931 -0.446 . . . . 129.22 111.671 -4.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 422' ' ' LEU . . . . . . . . . . . . . 84.5 mt -101.91 -12.39 18.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.775 0.658 . . . . 159.03 112.775 176.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 423' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -164.37 152.0 12.06 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 108.918 -0.771 . . . . 148.36 108.918 -178.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 424' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -157.76 163.42 38.11 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.702 0.763 . . . . 113.97 109.882 178.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 425' ' ' GLU . . . . . . . . . . . . . 29.8 tp10 -86.51 118.11 25.73 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 114.934 -1.03 . . . . 147.84 109.842 175.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 426' ' ' ALA . . . . . . . . . . . . . . . -108.02 -27.59 10.06 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 114.045 1.128 . . . . 99.62 114.045 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 427' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 68.07 167.55 0.26 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.252 0.549 . . . . 98.87 111.394 -177.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 428' ' ' HIS . . . . . 0.41 ' HB3' HD22 ' A' ' 405' ' ' LEU . 8.9 p80 -152.62 166.59 31.61 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.282 -1.377 . . . . 128.91 107.282 173.363 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 73.4 m -108.22 142.62 38.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.819 -0.628 . . . . 98.52 109.78 -177.556 -63.095 -67.758 -84.026 103.825 2.044 104.275 -80.146 -58.35 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 430' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -163.3 136.3 5.54 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.175 -1.046 . . . . 182.98 108.175 -178.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 431' ' ' GLY . . . . . 0.498 ' HA3' ' HA ' ' A' ' 400' ' ' CYS . . . 149.62 167.12 13.83 Favored Glycine 0 N--CA 1.451 -0.301 0 CA-C-O 122.342 0.968 . . . . 112.07 111.647 175.044 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 56.7 mt -75.86 141.81 42.32 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.331 -0.935 . . . . 126.02 111.014 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 433' ' ' CYS . . . . . . . . . . . . . 30.7 m -118.29 77.0 1.12 Allowed 'General case' 0 C--O 1.232 0.16 0 N-CA-C 107.937 -1.134 . . . . 155.94 107.937 177.18 -78.727 -77.901 -88.603 104.272 2.052 104.954 -80.419 -62.209 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 434' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -116.84 168.2 10.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.809 0.814 . . . . 182.92 110.128 -179.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 435' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -78.26 135.34 61.9 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.069 -0.969 . . . . 177.07 110.359 -175.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 436' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -90.45 170.16 27.86 Favored 'Cis proline' 0 C--N 1.347 0.483 0 CA-C-N 118.36 0.45 . . . . 139.11 112.773 -1.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 437' ' ' LEU . . . . . . . . . . . . . 51.7 mt -96.31 143.21 27.58 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.947 -0.39 . . . . 154.83 109.947 -178.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 438' ' ' ARG . . . . . . . . . . . . . 34.1 ttp180 -78.4 161.68 26.97 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 121.803 0.811 . . . . 185.69 110.84 -174.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 439' ' ' SER . . . . . . . . . . . . . 30.8 t -62.56 -45.17 94.17 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.22 -0.9 . . . . 204.16 111.451 -177.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 440' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -67.77 -12.66 61.05 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 112.965 0.728 . . . . 218.84 112.965 -177.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 45.3 mt -75.1 -26.55 59.36 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.095 -0.642 . . . . 158.35 111.564 175.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 31.96 68.6 0.85 Allowed Pre-proline 0 C--N 1.353 0.726 0 C-N-CA 128.795 2.838 . . . . 148.29 113.186 179.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 443' ' ' PRO . . . . . 0.539 ' HA ' ' NH1' ' A' ' 501' ' ' ARG . 37.2 Cg_endo -91.93 -178.23 1.04 Allowed 'Trans proline' 0 C--N 1.331 -0.372 0 C-N-CA 120.166 0.577 . . . . 121.73 113.298 -164.822 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 80.3 p -85.86 152.27 23.13 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.411 0.624 . . . . 99.99 110.134 179.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 445' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -49.46 -46.3 47.77 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 115.255 -0.884 . . . . 102.52 111.1 177.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 446' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -57.21 -43.74 83.04 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.93 -0.308 . . . . 120.73 111.612 173.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -59.98 -41.4 91.94 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 119.386 -0.925 . . . . 79.75 110.97 178.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 448' ' ' VAL . . . . . . . . . . . . . 86.3 t -60.7 -49.17 85.6 Favored 'Isoleucine or valine' 0 C--O 1.239 0.539 0 CA-C-O 121.417 0.627 . . . . 104.93 110.1 178.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 97.7 mt -64.81 -44.1 96.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 116.083 -0.508 . . . . 103.59 110.813 -175.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -64.57 -39.18 93.27 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 121.944 -0.473 . . . . 101.84 111.031 179.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 56.9 m -63.27 -45.94 89.17 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 119.134 -1.026 . . . . 109.17 110.815 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 65.5 tp -61.27 -41.39 96.85 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.927 -0.709 . . . . 128.03 111.139 -179.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 453' ' ' MET . . . . . . . . . . . . . 54.2 mtm -67.58 -38.58 84.26 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.256 -0.577 . . . . 141.2 111.691 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 454' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -61.88 -36.87 82.53 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.749 -0.781 . . . . 141.42 110.545 175.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 455' ' ' SER . . . . . . . . . . . . . 29.9 t -64.95 -40.83 95.62 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.416 -0.513 . . . . 132.91 111.156 176.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 456' ' ' MET . . . . . . . . . . . . . 78.0 mtp -65.46 -50.86 63.78 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.697 -0.401 . . . . 167.79 111.525 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -145.1 99.63 4.6 Favored Pre-proline 0 C--O 1.242 0.691 0 N-CA-C 108.115 -1.069 . . . . 155.23 108.115 -178.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -67.07 -15.46 46.72 Favored 'Trans proline' 0 C--O 1.238 0.508 0 N-CA-C 113.585 0.571 . . . . 138.55 113.585 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 459' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -77.24 -31.81 55.35 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.441 0.564 . . . . 194.07 112.103 178.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 460' ' ' SER . . . . . . . . . . . . . 80.8 p -95.47 -14.73 23.47 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.229 0.825 . . . . 151.16 113.229 -177.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 461' ' ' THR . . . . . . . . . . . . . 2.9 m -143.56 124.9 8.18 Favored Pre-proline 0 C--O 1.247 0.968 0 N-CA-C 109.648 -0.501 . . . . 127.22 109.648 -179.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -84.75 154.25 11.66 Favored 'Trans proline' 0 C--O 1.241 0.675 0 C-N-CA 120.659 0.906 . . . . 127.97 110.55 176.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.3 157.25 59.91 Favored 'Trans proline' 0 C--O 1.236 0.391 0 CA-C-O 121.884 0.702 . . . . 121.79 111.623 -178.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 33.2 p -66.88 177.18 1.76 Allowed 'General case' 0 C--O 1.239 0.527 0 CA-C-N 114.708 -1.133 . . . . 115.32 110.013 172.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 465' ' ' CYS . . . . . . . . . . . . . 49.0 t -121.67 156.25 33.44 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 122.15 0.976 . . . . 158.74 111.452 -174.661 -174.15 0.0 0.0 0.0 0.0 0.0 0.0 -174.15 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 466' ' ' CYS . . . . . . . . . . . . . 46.8 t -89.78 110.64 21.54 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.423 -0.954 . . . . 111.44 108.423 -179.131 -177.23 69.363 76.771 105.474 2.047 104.779 61.774 168.221 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 35.5 m -137.81 166.29 27.39 Favored Pre-proline 0 C--O 1.239 0.501 0 CA-C-O 121.538 0.685 . . . . 103.55 109.96 -175.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 468' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -68.95 127.89 15.94 Favored 'Trans proline' 0 CA--C 1.517 -0.362 0 C-N-CA 120.264 0.643 . . . . 92.42 111.504 176.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 469' ' ' THR . . . . . . . . . . . . . 29.9 p -107.64 -18.91 13.71 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 114.058 1.132 . . . . 103.1 114.058 175.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -137.06 134.89 37.0 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.218 0.917 . . . . 175.72 108.899 169.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 6.2 mp -129.39 158.38 39.31 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.825 0.822 . . . . 94.55 110.098 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 472' ' ' SER . . . . . . . . . . . . . 68.9 m -118.05 159.86 41.32 Favored Pre-proline 0 N--CA 1.447 -0.587 0 CA-C-N 114.841 -1.072 . . . . 97.74 109.309 174.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 473' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -89.69 168.62 4.8 Favored 'Trans proline' 0 C--N 1.33 -0.412 0 C-N-CA 120.554 0.836 . . . . 103.9 111.031 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 9.8 pt -134.88 157.09 40.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 108.377 -0.971 . . . . 108.33 108.377 162.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 475' ' ' SER . . . . . . . . . . . . . 38.3 m -103.04 123.54 46.82 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.151 -0.932 . . . . 156.31 108.941 -178.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 476' ' ' ILE . . . . . . . . . . . . . 27.3 mt -114.84 141.46 31.36 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 123.91 0.884 . . . . 108.48 109.153 -179.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 8.1 tp -109.31 123.63 49.61 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.898 -1.149 . . . . 109.72 107.898 176.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 478' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -147.17 174.48 11.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.778 0.799 . . . . 123.93 110.434 -174.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 479' ' ' ILE . . . . . . . . . . . . . 54.5 mt -113.28 118.13 57.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 N-CA-C 107.942 -1.133 . . . . 146.03 107.942 175.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 50.3 p-10 -84.7 -153.91 0.17 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.123 0.487 . . . . 143.24 111.654 -175.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 481' ' ' SER . . . . . 0.458 ' HB3' ' O ' ' B' ' 91' ' ' ARG . 2.5 p -66.82 -50.76 61.58 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.423 -0.808 . . . . 163.82 111.663 -177.945 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -77.54 19.71 0.35 Allowed 'General case' 0 C--O 1.236 0.382 0 N-CA-C 113.405 0.891 . . . . 192.67 113.405 -173.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 483' ' ' ASN . . . . . . . . . . . . . 64.3 t30 56.97 46.61 19.16 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.902 0.858 . . . . 183.07 110.9 -179.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 484' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -120.31 134.37 55.28 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.367 -0.833 . . . . 141.4 108.869 179.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 485' ' ' VAL . . . . . . . . . . . . . 21.7 t -83.79 128.33 38.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 N-CA-C 109.362 -0.607 . . . . 122.47 109.362 177.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 486' ' ' VAL . . . . . . . . . . . . . 66.7 t -127.67 127.16 68.21 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 C-N-CA 123.919 0.887 . . . . 106.76 109.267 -170.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -98.68 105.57 17.73 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 108.173 -1.047 . . . . 164.37 108.173 169.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -120.86 139.43 53.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.849 0.356 . . . . 144.44 110.698 -173.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 489' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -90.97 98.12 11.59 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.128 -1.064 . . . . 133.44 108.128 174.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -78.62 130.5 35.97 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 109.866 -0.42 . . . . 140.43 109.866 173.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 491' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -89.7 164.86 14.53 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.577 0.703 . . . . 119.74 110.832 -177.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 48.7 62.39 2.59 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.011 -0.995 . . . . 107.37 110.96 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 89.0 mmm -115.82 -31.98 5.61 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 114.636 -1.165 . . . . 120.75 113.862 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 94.2 t -120.72 114.92 45.36 Favored 'Isoleucine or valine' 0 C--O 1.24 0.597 0 N-CA-C 108.635 -0.876 . . . . 93.12 108.635 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 60.3 t -61.2 128.88 23.24 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 C-N-CA 120.449 -0.501 . . . . 93.21 110.03 174.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -117.45 -22.16 8.31 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 114.195 1.183 . . . . 118.98 114.195 179.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 77.9 p -150.8 150.14 30.6 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 108.301 -1.0 . . . . 124.95 108.301 166.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 69.5 m -108.31 158.68 17.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.561 -0.745 . . . . 98.34 109.772 174.505 -58.35 -80.146 -84.026 104.275 2.044 103.825 -67.758 -63.095 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . -161.54 -176.14 33.32 Favored Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 108.92 -1.672 . . . . 116.68 108.92 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 500' ' ' CYS . . . . . . . . . . . . . 71.7 m -112.25 132.0 55.18 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 114.887 -0.656 . . . . 114.38 109.778 -177.839 -62.209 -80.419 -88.603 104.954 2.052 104.272 -77.901 -78.727 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' ARG . . . . . 0.539 ' NH1' ' HA ' ' A' ' 443' ' ' PRO . 62.5 mmt-85 . . . . . 0 CA--C 1.541 0.633 0 N-CA-C 113.892 1.071 . . . . 115.76 113.892 -171.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo . . . . . 0 C--O 1.232 0.185 0 N-CA-C 112.622 0.201 . . . . 235.27 112.622 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' CYS . . . . . . . . . . . . . 43.0 t -68.95 144.23 54.21 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.492 0.663 . . . . 302.78 110.347 178.463 176.91 69.334 102.906 104.686 2.032 104.95 -92.362 -54.252 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . . . -144.79 52.58 1.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.613 0.72 . . . . 229.56 110.191 -177.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 2.4 pp -83.97 -18.41 9.93 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 O-C-N 121.71 -0.619 . . . . 241.56 111.798 172.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.55 HD23 HD22 ' B' ' 54' ' ' ASN . 94.0 mt -69.89 -14.08 62.56 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.295 0.48 . . . . 226.06 112.295 179.354 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -77.75 -41.65 36.88 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.338 0.517 . . . . 247.69 111.146 171.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' CYS . . . . . . . . . . . . . 59.4 m -63.42 -31.03 72.08 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.202 -0.599 . . . . 292.21 110.998 171.209 -55.215 -70.605 -88.181 105.503 2.036 105.672 -80.603 -162.041 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ASN . . . . . 0.55 HD22 HD23 ' B' ' 51' ' ' LEU . 95.3 m-20 -71.56 -13.09 61.68 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.681 0.622 . . . . 272.44 112.681 173.115 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 75.3 m -112.75 -1.75 14.63 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 112.589 0.588 . . . . 243.93 112.589 174.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -101.86 -52.9 3.07 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.294 0.638 . . . . 259.22 112.43 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -71.05 -41.47 70.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.612 -0.435 . . . . 293.54 111.101 175.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' TRP . . . . . . . . . . . . . 60.3 t-105 -68.01 -17.93 64.56 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 112.474 0.546 . . . . 325.7 112.474 -178.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 99.4 p -100.97 -8.42 22.43 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 113.309 0.855 . . . . 317.41 113.309 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 118.344 0.52 . . . . 252.2 111.123 179.795 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 pm0 . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.684 0.278 . . . . 249.99 110.794 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -102.71 168.11 9.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.772 0.796 . . . . 261.67 110.189 176.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' CYS . . . . . . . . . . . . . 17.8 m -104.11 29.02 6.25 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.319 -0.855 . . . . 293.94 112.288 -179.699 -47.306 -146.469 -79.792 104.331 2.032 104.389 -68.666 -58.886 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.4 -11.91 60.89 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.563 0.579 . . . . 264.31 112.563 176.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -103.35 -30.44 10.6 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 113.331 0.863 . . . . 263.91 113.331 178.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 56.7 tp -69.46 -36.87 76.98 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.38 -0.528 . . . . 277.49 111.201 178.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 -65.3 -31.89 73.26 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.368 -0.533 . . . . 324.94 111.122 172.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 34.5 t -64.71 -37.56 88.0 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.373 -0.531 . . . . 321.14 111.034 174.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -68.48 -38.98 81.52 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 120.515 -0.474 . . . . 341.76 111.104 175.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.1 -40.94 91.39 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.231 -0.588 . . . . 311.59 111.064 175.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 78.4 mt -68.46 -37.47 80.21 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.56 -0.456 . . . . 346.37 111.436 177.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' CYS . . . . . . . . . . . . . 8.1 t -60.92 -40.22 92.37 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.786 -0.366 . . . . 340.61 111.039 176.656 -162.041 -80.603 -88.181 105.672 2.036 105.503 -70.605 -55.215 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' THR . . . . . . . . . . . . . 18.5 p -75.83 -36.55 59.61 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.447 -0.501 . . . . 307.92 111.871 -179.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 70.2 mtm180 -77.92 -14.84 59.41 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 113.109 0.781 . . . . 287.6 113.109 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . . . -63.99 -22.91 67.13 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 118.741 0.701 . . . . 284.73 111.798 172.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' THR . . . . . . . . . . . . . 77.9 p -121.34 55.08 1.09 Allowed 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.853 -0.425 . . . . 262.09 109.853 173.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' ALA . . . . . . . . . . . . . . . -79.8 8.67 6.33 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 113.444 0.905 . . . . 269.31 113.444 -175.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' ARG . . . . . 0.458 ' O ' ' HB3' ' A' ' 481' ' ' SER . 97.1 mtt180 -129.73 -40.23 1.39 Allowed 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.868 0.692 . . . . 265.32 112.868 178.442 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 70.9 p -65.9 -32.82 74.55 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.474 0.546 . . . . 273.03 112.474 -171.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' CYS . . . . . . . . . . . . . 57.2 m -97.83 30.97 2.79 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.782 0.66 . . . . 330.96 112.782 -172.845 -54.252 -92.362 102.906 104.95 2.032 104.686 69.334 176.91 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' ARG . . . . . . . . . . . . . 2.0 mmt85 -80.63 88.93 5.7 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 108.191 -1.04 . . . . 272.76 108.191 177.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . 149.44 -38.22 0.95 Allowed Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.712 -0.676 . . . . 176.98 112.75 -175.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -66.75 127.55 32.89 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.728 -0.471 . . . . 210.7 109.728 176.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 26.9 mt -63.11 -35.76 81.34 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 120.009 -0.676 . . . . 168.23 111.219 -179.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.33 -29.69 69.94 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.081 0.4 . . . . 179.99 112.081 -176.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -65.6 -53.45 41.64 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.591 -0.444 . . . . 256.79 111.346 178.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 -64.59 -34.22 77.75 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 120.622 -0.431 . . . . 203.4 111.03 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 47.8 t -62.34 -44.3 96.8 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.962 -0.295 . . . . 216.52 111.395 175.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.41 -38.84 81.63 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.582 -0.447 . . . . 214.32 111.358 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 72.3 t -61.58 -48.46 88.66 Favored 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-O 121.202 0.525 . . . . 234.08 110.407 177.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -67.18 -32.62 73.83 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 119.583 -0.847 . . . . 289.28 111.888 -179.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -69.31 -36.67 79.13 Favored Glycine 0 C--N 1.336 0.567 0 C-N-CA 119.932 -1.127 . . . . 285.31 112.677 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 97.7 mt -64.18 -39.9 87.15 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 O-C-N 122.299 -0.53 . . . . 282.28 110.208 173.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -60.18 -42.29 94.69 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.155 -0.618 . . . . 307.89 111.306 174.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -64.22 -48.86 74.22 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.912 0.387 . . . . 355.62 111.227 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.72 -18.31 64.86 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.453 0.538 . . . . 332.65 112.453 179.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' MET . . . . . . . . . . . . . 45.1 tpp -70.78 -34.0 71.33 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 118.29 0.496 . . . . 333.45 111.707 177.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 50.9 m -102.7 29.77 5.12 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 122.942 0.497 . . . . 335.57 112.225 -179.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -118.99 -44.8 2.59 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.167 0.802 . . . . 333.23 113.167 179.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -96.86 14.12 26.39 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 112.739 0.644 . . . . 329.02 112.739 179.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 57.54 81.22 0.15 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 123.542 0.737 . . . . 316.37 111.411 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' CYS . . . . . . . . . . . . . 76.6 m -106.16 60.05 0.65 Allowed 'General case' 0 C--O 1.237 0.411 0 N-CA-C 111.444 0.165 . . . . 296.02 111.444 -179.141 -58.886 -68.666 -79.792 104.389 2.032 104.331 -146.469 -47.306 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 35.6 t . . . . . 0 N--CA 1.463 0.197 0 C-N-CA 123.297 0.639 . . . . 276.15 112.07 179.365 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 601' ' ' CIT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_