data_6guu_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 6guu _Structure_validation_residue.Date_analyzed 2019-10-04 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 413' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.775 0.321 . . . . 180.24 111.266 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 414' ' ' ASP . . . . . 0.524 ' N ' ' OD1' ' A' ' 414' ' ' ASP . 1.1 p30 -82.87 173.07 12.16 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.935 0.874 . . . . 186.95 110.463 179.259 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 415' ' ' HIS . . . . . 0.468 ' NE2' ' O ' ' A' ' 431' ' ' CYS . 20.3 m80 -110.86 165.36 11.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.818 0.818 . . . . 145.72 110.103 179.02 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 416' ' ' MET . . . . . . . . . . . . . 31.6 mtm -64.75 129.84 41.28 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.226 -0.897 . . . . 126.99 110.072 174.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 417' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -85.22 23.72 1.24 Allowed 'General case' 0 C--O 1.237 0.439 0 N-CA-C 112.897 0.703 . . . . 147.95 112.897 176.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 418' ' ' PHE . . . . . . . . . . . . . 33.2 p90 -154.38 146.69 23.87 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.007 -0.738 . . . . 121.76 109.007 -178.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 419' ' ' CYS . . . . . 0.491 ' SG ' ' N ' ' A' ' 439' ' ' HIS . 53.8 t -59.5 129.82 43.85 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.608 -0.723 . . . . 148.88 110.169 177.221 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 1.2 ttm-85 -58.89 -40.89 85.78 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.749 -0.66 . . . . 114.23 111.405 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 21.6 t -76.16 -40.35 36.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 C-N-CA 120.92 -0.312 . . . . 133.41 111.273 -172.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 422' ' ' CYS . . . . . . . . . . . . . 1.5 p -114.8 -0.05 13.64 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 114.473 1.286 . . . . 141.3 114.473 -170.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 3.2 mmtp 65.79 4.34 2.88 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.528 0.731 . . . . 143.58 112.933 171.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -103.88 157.18 17.27 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.582 0.706 . . . . 168.05 110.526 -179.597 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -93.95 -168.41 37.83 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-O 122.343 0.968 . . . . 129.45 112.622 179.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 113.4 -143.09 17.75 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 114.779 -0.71 . . . . 152.07 113.177 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -60.31 105.32 0.41 Allowed 'General case' 0 C--O 1.235 0.295 0 C-N-CA 122.334 0.253 . . . . 193.27 110.474 178.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 428' ' ' LEU . . . . . . . . . . . . . 26.2 mt -119.0 149.2 42.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.422 0.629 . . . . 148.74 111.022 -173.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 429' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -124.75 116.54 22.48 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.307 -1.368 . . . . 163.57 107.307 -179.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 430' ' ' CYS . . . . . . . . . . . . . 9.1 m -104.51 138.01 41.52 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.09 0.471 . . . . 152.32 111.265 -165.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 431' ' ' CYS . . . . . 0.468 ' O ' ' NE2' ' A' ' 415' ' ' HIS . 49.3 t -72.25 143.63 48.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.45 -0.796 . . . . 133.86 110.149 176.949 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -90.38 -5.17 56.49 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 113.348 0.87 . . . . 156.54 113.348 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 433' ' ' ALA . . . . . . . . . . . . . . . -105.55 -22.87 12.9 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 114.011 1.115 . . . . 137.91 114.011 175.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 434' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -145.3 162.81 35.52 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.386 -0.968 . . . . 149.41 108.386 -178.132 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -76.34 15.39 1.01 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 N-CA-C 114.618 0.969 . . . . 110.78 114.618 -173.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 436' ' ' SER . . . . . . . . . . . . . 68.0 m -68.95 153.91 42.98 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.768 0.794 . . . . 124.47 111.185 -177.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 437' ' ' SER . . . . . . . . . . . . . 21.6 m -148.4 135.41 20.13 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.438 -0.949 . . . . 112.33 108.438 179.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 438' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -133.59 156.47 47.78 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.742 0.782 . . . . 145.2 111.021 -172.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 439' ' ' HIS . . . . . 0.491 ' N ' ' SG ' ' A' ' 419' ' ' CYS . 40.2 m170 -93.54 131.27 38.96 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 114.706 -1.134 . . . . 150.51 108.919 169.963 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 440' ' ' LEU . . . . . . . . . . . . . 2.7 mp -57.33 -31.77 66.04 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.601 0.593 . . . . 149.78 112.601 -170.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 441' ' ' HIS . . . . . . . . . . . . . 25.8 p-80 -71.98 -22.52 61.42 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 119.333 -0.947 . . . . 156.21 112.327 173.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 442' ' ' CYS . . . . . 0.424 ' N ' ' O ' ' A' ' 439' ' ' HIS . 91.5 m -79.74 -28.49 40.49 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.682 0.623 . . . . 153.54 112.682 -175.248 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 443' ' ' LEU . . . . . . . . . . . . . 3.9 mp -75.07 156.68 35.86 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 122.116 0.96 . . . . 155.93 111.379 -177.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 444' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -127.94 106.19 20.28 Favored Pre-proline 0 C--O 1.249 1.042 0 CA-C-N 114.754 -1.112 . . . . 163.47 109.083 -176.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -78.06 152.58 91.93 Favored 'Cis proline' 0 C--N 1.341 0.176 0 C-N-CA 125.094 -0.794 . . . . 163.31 113.151 1.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -61.07 144.21 99.28 Favored 'Trans proline' 0 C--N 1.332 -0.308 0 O-C-N 123.491 1.258 . . . . 142.67 111.007 174.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 6.1 mt -96.24 146.9 32.11 Favored Pre-proline 0 C--N 1.346 0.428 0 C-N-CA 118.588 -1.245 . . . . 153.53 110.784 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 448' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -52.59 -60.51 0.71 Allowed 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 120.817 1.011 . . . . 156.83 113.368 178.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -165.46 -171.12 2.03 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 107.926 -1.139 . . . . 197.81 107.926 164.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 450' ' ' ILE . . . . . . . . . . . . . 2.9 mp -46.24 115.15 2.91 Favored Pre-proline 0 C--O 1.239 0.539 0 C-N-CA 125.297 1.439 . . . . 175.92 110.851 -170.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.34 156.51 29.19 Favored 'Trans proline' 0 C--N 1.328 -0.504 0 CA-C-O 122.185 0.827 . . . . 184.72 112.035 -177.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 452' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -69.79 145.63 52.03 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 114.553 -1.203 . . . . 191.63 110.489 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 68.71 -157.04 53.29 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 122.441 1.023 . . . . 169.1 113.136 176.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -64.72 158.9 23.45 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 122.038 0.923 . . . . 199.38 110.792 -178.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 455' ' ' TRP . . . . . . . . . . . . . 63.6 t90 -148.77 124.65 10.6 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 107.717 -1.216 . . . . 148.21 107.717 173.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 456' ' ' LEU . . . . . . . . . . . . . 4.6 mt -104.66 134.1 48.38 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.937 -0.764 . . . . 121.4 108.937 -179.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 20.5 p -72.19 161.74 77.34 Favored Pre-proline 0 N--CA 1.453 -0.313 0 CA-C-N 116.023 -0.535 . . . . 111.89 111.509 -170.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 458' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_exo -56.73 -29.28 79.77 Favored 'Trans proline' 0 C--O 1.237 0.466 0 N-CA-C 114.179 0.8 . . . . 133.42 114.179 -178.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 1.8 ptp180 -83.47 -24.91 31.58 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 118.967 -1.093 . . . . 129.72 111.511 176.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 1.3 m -78.33 -34.37 48.6 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.464 -0.494 . . . . 110.9 111.743 170.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 461' ' ' THR . . . . . . . . . . . . . 5.6 t -72.89 -20.63 61.05 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 119.894 -0.722 . . . . 169.58 112.19 177.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 14.6 t -55.25 133.98 69.23 Favored Pre-proline 0 C--O 1.242 0.687 0 CA-C-N 117.934 0.334 . . . . 140.03 111.405 -171.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.73 148.34 36.47 Favored 'Trans proline' 0 C--O 1.24 0.579 0 C-N-CA 120.59 0.86 . . . . 138.9 110.782 176.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 464' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.46 166.69 29.08 Favored 'Trans proline' 0 C--N 1.328 -0.507 0 CA-C-O 122.185 0.827 . . . . 137.1 110.952 177.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 18.5 mt -84.77 155.84 21.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.055 -0.975 . . . . 128.54 110.833 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 466' ' ' LYS . . . . . . . . . . . . . 1.6 tttp -66.16 -35.6 80.9 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 115.06 -0.973 . . . . 153.29 111.598 178.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -151.33 -153.25 6.12 Favored Glycine 0 N--CA 1.444 -0.803 0 N-CA-C 110.06 -1.216 . . . . 132.99 110.06 174.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 468' ' ' LYS . . . . . . . . . . . . . 7.3 tttt -103.66 129.65 51.0 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.831 -0.803 . . . . 134.61 108.831 175.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 2.7 m -82.58 136.01 23.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 N-CA-C 109.143 -0.688 . . . . 114.56 109.143 -174.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 470' ' ' GLN . . . . . 0.402 ' N ' ' O ' ' A' ' 514' ' ' LYS . 16.8 tt0 -92.41 -41.76 10.14 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.202 -0.454 . . . . 139.87 112.064 -177.976 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 6.2 ttp180 -155.5 138.48 15.43 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.217 -0.66 . . . . 128.19 109.217 -177.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 71.4 mt -89.73 125.46 42.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 108.085 -1.08 . . . . 106.95 108.085 174.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 11.2 mt -99.52 -42.26 7.01 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 113.322 0.86 . . . . 147.35 113.322 -174.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 474' ' ' HIS . . . . . 0.426 ' O ' ' N ' ' A' ' 512' ' ' PHE . 44.1 t-80 -159.91 160.31 33.39 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.164 -1.05 . . . . 144.54 108.164 -169.07 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 475' ' ' TRP . . . . . . . . . . . . . 15.7 p-90 -142.03 155.51 45.41 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.549 0.69 . . . . 149.9 110.341 174.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 476' ' ' ARG . . . . . 0.586 ' NH1' ' OE2' ' A' ' 510' ' ' GLU . 4.5 mtm105 -141.97 162.61 35.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 114.802 -1.09 . . . . 165.79 109.588 -169.846 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 477' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -91.98 159.84 15.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.74 0.781 . . . . 149.57 110.241 171.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 478' ' ' THR . . . . . 0.615 ' CG2' ' CG ' ' A' ' 508' ' ' GLU . 10.2 t -143.94 169.99 16.76 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.225 -0.898 . . . . 173.27 109.43 -171.407 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 56.1 mp0 -85.84 140.11 35.27 Favored Pre-proline 0 C--O 1.236 0.354 0 C-N-CA 115.245 -2.582 . . . . 203.61 110.508 -174.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -60.42 148.48 90.44 Favored 'Trans proline' 0 C--O 1.245 0.844 0 O-C-N 122.618 0.799 . . . . 201.59 110.775 -175.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.41 160.87 43.49 Favored 'Trans proline' 0 C--N 1.33 -0.41 0 CA-C-O 122.149 0.812 . . . . 181.21 111.584 179.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -83.87 128.65 62.32 Favored Pre-proline 0 C--O 1.236 0.39 0 CA-C-N 114.87 -1.059 . . . . 213.13 110.239 -175.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo . . . . . 0 C--N 1.341 0.175 0 C-N-CA 123.578 2.852 . . . . 199.89 112.383 176.853 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 506' ' ' ILE . . . . . . . . . . . . . 6.4 tp . . . . . 0 CA--C 1.536 0.428 0 N-CA-C 109.626 -0.509 . . . . 198.58 109.626 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 507' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -65.55 132.1 29.95 Favored 'Trans proline' 0 N--CA 1.473 0.281 0 O-C-N 122.379 0.673 . . . . 179.04 111.768 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 508' ' ' GLU . . . . . 0.615 ' CG ' ' CG2' ' A' ' 478' ' ' THR . 13.3 pt-20 -74.5 -161.6 0.13 Allowed 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 123.839 0.855 . . . . 209.22 110.396 174.733 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 7.8 ttm180 -154.83 139.94 17.46 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 119.756 -0.778 . . . . 168.62 110.779 179.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' GLU . . . . . 0.586 ' OE2' ' NH1' ' A' ' 476' ' ' ARG . 4.8 pt-20 -119.63 152.3 37.31 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.401 0.619 . . . . 160.98 110.264 175.992 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -123.41 138.89 54.5 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.052 -0.976 . . . . 116.06 109.453 -177.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' PHE . . . . . 0.426 ' N ' ' O ' ' A' ' 474' ' ' HIS . 1.3 t80 -86.36 122.43 30.31 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 108.476 -0.935 . . . . 117.64 108.476 173.735 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' VAL . . . . . . . . . . . . . 25.0 m -120.85 147.92 24.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-O 121.645 0.736 . . . . 114.98 110.122 -170.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' LYS . . . . . 0.402 ' O ' ' N ' ' A' ' 470' ' ' GLN . 20.7 tptp -98.91 123.62 43.3 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 107.311 -1.366 . . . . 105.33 107.311 165.767 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 515' ' ' TRP . . . . . . . . . . . . . 70.5 m95 -86.13 140.18 30.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.89 0.376 . . . . 125.35 110.124 -176.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -69.59 129.03 38.53 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.842 -0.617 . . . . 108.72 109.964 178.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 94.5 -25.76 21.25 Favored Glycine 0 N--CA 1.442 -0.923 0 N-CA-C 115.095 0.798 . . . . 92.54 115.095 178.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 4.6 mt -110.48 152.46 26.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 118.152 0.976 . . . . 113.33 109.678 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 519' ' ' SER . . . . . . . . . . . . . 94.6 p -78.0 -175.33 3.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.996 0.903 . . . . 110.87 110.185 -171.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 520' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -72.21 -13.5 61.55 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 113.3 0.852 . . . . 125.25 113.3 -178.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -67.67 -15.51 63.68 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 118.757 0.708 . . . . 128.35 111.909 173.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' HIS . . . . . . . . . . . . . 30.2 m-70 -104.29 9.79 35.8 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 112.689 0.626 . . . . 117.62 112.689 -179.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 75.2 m -60.38 120.88 10.73 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 118.246 0.475 . . . . 109.44 110.287 176.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 28.8 t -118.71 -179.78 3.9 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.615 0.721 . . . . 143.38 109.923 -173.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 525' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -109.98 137.32 47.92 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.534 -0.757 . . . . 129.21 109.551 173.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 526' ' ' VAL . . . . . . . . . . . . . 11.4 m -129.15 159.25 41.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 N-CA-C 108.959 -0.756 . . . . 112.39 108.959 -179.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 527' ' ' LYS . . . . . . . . . . . . . 56.5 mttt -79.66 145.39 33.03 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.295 -0.866 . . . . 135.05 110.401 -178.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 528' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -53.31 -46.36 69.38 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.524 -0.762 . . . . 158.41 111.545 -176.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 1.6 tt -70.45 -23.23 62.67 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 112.344 0.498 . . . . 122.62 112.344 -176.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -60.79 -47.61 85.55 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.188 -0.605 . . . . 122.57 110.806 169.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 531' ' ' LEU . . . . . . . . . . . . . 19.2 mt -60.37 -49.26 78.28 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.829 -0.348 . . . . 118.37 111.152 -179.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.08 -36.8 78.19 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.526 -0.47 . . . . 157.51 111.326 -179.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 533' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -74.48 -38.25 62.96 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.571 -0.451 . . . . 126.51 111.856 -176.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 534' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -113.14 -15.46 12.77 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 114.267 1.21 . . . . 135.98 114.267 -170.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 535' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -138.88 54.43 1.74 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 108.417 -0.957 . . . . 104.02 108.417 178.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 10.6 m -54.52 -65.97 0.48 Allowed 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.57 -0.741 . . . . 97.97 111.442 -173.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 537' ' ' VAL . . . . . 0.661 ' O ' ' ND2' ' A' ' 541' ' ' ASN . 2.3 p -53.14 -46.19 55.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 121.169 0.509 . . . . 136.83 110.565 -174.163 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 538' ' ' MET . . . . . . . . . . . . . 3.7 ttm -59.1 -42.75 91.23 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 121.922 -0.486 . . . . 116.45 111.373 174.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 539' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -63.41 -51.06 67.36 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.712 0.292 . . . . 130.67 111.102 -179.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -67.73 -29.19 68.37 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.365 -0.534 . . . . 153.13 111.885 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 541' ' ' ASN . . . . . 0.661 ' ND2' ' O ' ' A' ' 537' ' ' VAL . 7.0 m-80 -62.31 -45.53 92.82 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.05 -0.66 . . . . 137.56 110.621 175.092 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 542' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -59.29 -45.53 91.03 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.755 -0.378 . . . . 132.77 110.609 173.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 543' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -50.33 -50.79 49.94 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.122 0.487 . . . . 143.66 111.423 178.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 3.8 ttt-85 -60.9 -32.03 71.51 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.585 -0.446 . . . . 147.02 111.763 -175.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 545' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -82.16 -30.88 30.78 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 113.057 0.762 . . . . 160.08 113.057 -170.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -127.19 178.53 5.97 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.862 0.839 . . . . 173.19 110.765 -165.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -93.59 134.17 36.15 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 114.82 -1.082 . . . . 180.03 109.389 178.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 548' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -112.48 15.99 19.98 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.997 -0.547 . . . . 178.78 112.467 -177.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -95.71 -43.97 7.66 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.143 0.577 . . . . 173.86 112.26 168.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -116.46 133.04 23.03 Favored Pre-proline 0 C--O 1.24 0.578 0 C-N-CA 125.062 1.345 . . . . 172.13 109.056 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -60.65 154.98 50.87 Favored 'Trans proline' 0 C--O 1.241 0.646 0 C-N-CA 120.531 0.821 . . . . 169.26 110.942 -179.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 552' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.7 155.78 67.68 Favored 'Trans proline' 0 C--O 1.241 0.633 0 C-N-CA 120.399 0.733 . . . . 142.56 110.531 176.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 553' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.48 154.63 68.6 Favored 'Trans proline' 0 C--N 1.329 -0.476 0 CA-C-O 121.708 0.628 . . . . 155.97 111.317 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 554' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -69.28 141.22 54.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.036 -0.984 . . . . 165.18 109.419 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 555' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' A' ' 584' ' ' ARG . 9.5 t70 -93.43 101.87 14.09 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 108.459 -0.941 . . . . 162.13 108.459 179.643 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 556' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -101.47 5.61 42.04 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 112.685 0.624 . . . . 170.35 112.685 173.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.255 0 CA-C-N 118.164 0.438 . . . . 186.22 113.179 -178.16 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 573' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo . . . . . 0 C--O 1.233 0.26 0 N-CA-C 112.67 0.219 . . . . 166.45 112.67 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 1.3 mp -90.47 16.46 8.85 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 112.45 0.537 . . . . 152.28 112.45 176.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 575' ' ' TYR . . . . . 0.424 ' O ' ' N ' ' A' ' 579' ' ' GLU . 4.3 t80 -57.46 -49.26 76.82 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.799 -0.36 . . . . 150.31 111.223 -176.55 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 576' ' ' ALA . . . . . . . . . . . . . . . -49.6 -34.22 17.32 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 112.324 0.49 . . . . 142.75 112.324 -175.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 577' ' ' LYS . . . . . 0.545 ' O ' ' NZ ' ' A' ' 577' ' ' LYS . 2.2 tptp -84.36 -43.45 14.72 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.621 -0.432 . . . . 154.96 109.913 175.466 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 578' ' ' MET . . . . . . . . . . . . . 25.5 mmt -56.15 -34.28 66.0 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 119.731 -0.787 . . . . 136.56 111.169 176.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 579' ' ' GLU . . . . . 0.424 ' N ' ' O ' ' A' ' 575' ' ' TYR . 34.2 tt0 -65.29 -32.4 74.04 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 120.322 -0.551 . . . . 172.88 111.022 171.963 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 580' ' ' GLU . . . . . 0.401 ' O ' ' NE ' ' A' ' 584' ' ' ARG . 45.4 tt0 -69.94 -58.26 4.06 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.752 0.31 . . . . 153.32 111.44 -176.731 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 581' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.4 -26.93 62.97 Favored 'General case' 0 C--O 1.237 0.434 0 O-C-N 121.853 -0.529 . . . . 166.06 112.4 -176.536 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 582' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -131.01 -64.88 0.8 Allowed 'General case' 0 C--O 1.234 0.287 0 C-N-CA 119.275 -0.97 . . . . 129.21 113.285 -164.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 583' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -59.67 -38.3 81.14 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 112.18 0.437 . . . . 125.14 112.18 -159.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 584' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 555' ' ' ASP . 11.3 ptt180 -67.17 -27.43 67.28 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.289 -0.564 . . . . 152.95 111.928 -177.418 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 585' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -76.25 -12.24 60.05 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 113.242 0.83 . . . . 134.9 113.242 -177.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 586' ' ' GLY . . . . . . . . . . . . . . . 124.82 11.95 4.22 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.818 -0.706 . . . . 117.14 113.325 176.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 587' ' ' ILE . . . . . . . . . . . . . 81.5 mt -92.27 106.25 17.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 108.038 -1.097 . . . . 134.31 108.038 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 588' ' ' LYS . . . . . . . . . . . . . 7.2 tttp -59.74 126.64 83.55 Favored Pre-proline 0 C--O 1.239 0.552 0 N-CA-C 109.086 -0.709 . . . . 140.45 109.086 173.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 589' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.48 -19.46 51.92 Favored 'Trans proline' 0 N--CA 1.475 0.436 0 N-CA-C 114.757 1.022 . . . . 117.48 114.757 -167.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 590' ' ' GLU . . . . . 0.545 ' N ' ' OE1' ' A' ' 590' ' ' GLU . 16.8 mp0 -69.53 -27.08 64.85 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 118.983 0.811 . . . . 146.31 111.404 177.875 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 591' ' ' TRP . . . . . 0.504 ' CD1' ' CD1' ' A' ' 617' ' ' LEU . 28.1 m0 -66.02 -16.75 64.18 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.162 0.43 . . . . 108.8 112.162 -176.817 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 592' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -103.65 6.8 37.31 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 122.919 0.488 . . . . 116.7 112.307 177.197 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 593' ' ' MET . . . . . . . . . . . . . 6.0 mtm -101.58 139.91 36.59 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.065 0.546 . . . . 124.3 109.719 177.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 594' ' ' ILE . . . . . . . . . . . . . 84.9 mt -81.29 128.86 38.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 109.571 -0.529 . . . . 112.53 109.571 -178.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 595' ' ' HIS . . . . . . . . . . . . . 13.3 t-160 -94.89 -52.06 4.41 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.169 -0.469 . . . . 125.62 111.144 172.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 66.3 mtp180 -145.56 150.79 37.05 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.198 -0.667 . . . . 112.7 109.198 -177.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 40.8 mt -101.92 116.77 46.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 107.23 -1.396 . . . . 96.79 107.23 166.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 598' ' ' LEU . . . . . . . . . . . . . 49.6 mt -93.5 -38.86 11.18 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 113.056 0.762 . . . . 111.55 113.056 -170.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 599' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -160.43 171.81 18.38 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.568 -0.901 . . . . 120.88 108.568 -176.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 600' ' ' HIS . . . . . . . . . . . . . 48.1 p-80 -127.72 159.55 34.42 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.166 -0.924 . . . . 105.45 109.322 178.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 601' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -151.17 150.69 30.93 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.573 -0.74 . . . . 112.86 109.533 -179.497 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 602' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -117.81 133.65 55.72 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.268 -0.878 . . . . 112.57 109.126 176.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 28.5 p-10 -100.63 -170.16 1.82 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.511 0.672 . . . . 131.39 110.578 -175.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 604' ' ' LYS . . . . . . . . . . . . . 5.8 ptpt -52.65 -51.89 58.09 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 115.627 -0.715 . . . . 140.77 111.501 178.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 605' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -72.95 -32.07 65.0 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.19 -0.604 . . . . 164.65 111.432 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . 107.47 -5.87 35.71 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-O 118.617 -1.102 . . . . 131.64 115.621 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 607' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -59.52 124.12 19.04 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 119.105 1.453 . . . . 151.68 109.687 170.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 608' ' ' VAL . . . . . . . . . . . . . 12.1 p -72.75 141.19 16.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 C-N-CA 120.235 -0.586 . . . . 124.43 110.908 -174.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 609' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -114.19 144.72 42.73 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 108.467 -0.938 . . . . 107.55 108.467 171.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 610' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -116.42 140.5 49.28 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.723 -0.671 . . . . 116.0 109.309 175.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 4.0 tp -93.3 110.1 21.64 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.315 -0.994 . . . . 107.15 108.315 177.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 612' ' ' ILE . . . . . . . . . . . . . 1.9 mp -103.47 132.46 49.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 109.689 -0.485 . . . . 115.21 109.689 -171.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 613' ' ' LYS . . . . . 0.569 ' NZ ' ' O ' ' A' ' 617' ' ' LEU . 8.0 tmtm? -87.48 125.13 34.12 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.067 -1.086 . . . . 116.09 108.067 165.424 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 614' ' ' TRP . . . . . . . . . . . . . 83.9 m95 -97.11 146.34 25.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.413 0.625 . . . . 119.46 111.096 -175.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 615' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -70.57 137.47 50.08 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.34 -0.845 . . . . 133.03 111.684 -173.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 616' ' ' ASP . . . . . . . . . . . . . 16.5 t0 55.54 34.49 23.24 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.777 0.831 . . . . 153.28 111.113 -174.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 617' ' ' LEU . . . . . 0.569 ' O ' ' NZ ' ' A' ' 613' ' ' LYS . 1.9 mp -141.9 123.02 8.68 Favored Pre-proline 0 C--N 1.326 -0.444 0 N-CA-C 108.065 -1.087 . . . . 112.45 108.065 173.917 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 618' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -67.48 165.68 26.37 Favored 'Trans proline' 0 C--N 1.332 -0.294 0 CA-C-O 122.031 0.763 . . . . 108.32 112.401 -169.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 619' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -61.82 -31.56 71.81 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.878 -1.056 . . . . 136.87 112.077 -170.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 620' ' ' ASP . . . . . 0.566 ' N ' ' OD1' ' A' ' 620' ' ' ASP . 11.0 p-10 -52.63 -20.85 3.35 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 112.917 0.71 . . . . 164.46 112.917 176.277 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 621' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -114.22 29.79 7.76 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 122.949 0.499 . . . . 138.95 112.071 -179.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 622' ' ' CYS . . . . . . . . . . . . . 87.0 m -58.89 161.29 5.03 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.709 0.766 . . . . 106.18 109.206 165.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 5.2 m -143.02 134.84 26.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.666 -0.697 . . . . 123.55 110.076 -171.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 624' ' ' TRP . . . . . . . . . . . . . 87.3 m95 -77.26 115.87 17.41 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.082 -0.71 . . . . 93.78 109.082 169.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 625' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -108.02 152.99 23.75 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.368 0.604 . . . . 126.21 111.191 -176.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 626' ' ' ILE . . . . . . . . . . . . . 6.0 tp -73.59 157.58 6.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 122.206 1.003 . . . . 140.69 110.038 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 627' ' ' ASP . . . . . 0.61 ' OD1' ' NZ ' ' A' ' 638' ' ' LYS . 44.6 t0 -67.7 -50.04 59.56 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.367 -0.833 . . . . 142.96 111.203 176.834 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -93.27 80.8 4.44 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 122.416 1.103 . . . . 181.26 109.626 -172.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 11.3 tt -149.54 134.02 9.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 107.076 -1.453 . . . . 112.19 107.076 170.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 630' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -89.39 75.69 7.63 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 122.493 1.139 . . . . 160.26 109.255 -172.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 631' ' ' ILE . . . . . . . . . . . . . 3.5 mm -71.37 141.43 85.73 Favored Pre-proline 0 C--O 1.245 0.823 0 CA-C-N 114.853 -1.067 . . . . 135.31 108.276 164.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 632' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -50.74 131.9 35.02 Favored 'Trans proline' 0 C--N 1.33 -0.434 0 CA-C-N 119.696 0.927 . . . . 105.47 110.038 165.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 633' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 76.62 -13.47 0.92 Allowed 'General case' 0 C--O 1.232 0.167 0 C-N-CA 125.732 1.613 . . . . 159.99 113.326 174.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 634' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -42.72 -61.8 1.16 Allowed 'General case' 0 C--O 1.236 0.345 0 N-CA-C 114.152 1.167 . . . . 122.73 114.152 -163.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 635' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -67.07 -21.76 65.87 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.063 -1.055 . . . . 158.03 112.589 -175.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 636' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -65.3 -40.6 94.02 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 119.954 -0.699 . . . . 153.76 110.77 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 637' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -73.78 -28.74 61.81 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.411 -0.516 . . . . 134.94 112.028 174.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 638' ' ' LYS . . . . . 0.61 ' NZ ' ' OD1' ' A' ' 627' ' ' ASP . 36.2 mttt -59.4 -43.77 92.94 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.424 -0.51 . . . . 113.72 111.248 172.43 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 639' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -67.94 -37.74 81.99 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.875 -0.73 . . . . 162.88 111.094 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -59.03 -46.54 87.96 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.527 -0.469 . . . . 106.08 110.84 175.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 641' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -59.93 -43.46 94.93 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.576 -0.284 . . . . 104.3 111.403 -179.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 642' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -84.66 -27.38 27.15 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.295 0.48 . . . . 106.43 112.295 -175.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 643' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.306 0 N-CA-C 114.746 0.658 . . . . 133.59 114.746 -174.201 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 413' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.344 0 N-CA-C 112.406 0.521 . . . . 184.8 112.406 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 414' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.31 -155.68 0.39 Allowed 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 109.557 -0.535 . . . . 199.95 109.557 -175.847 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 415' ' ' HIS . . . . . . . . . . . . . 2.4 m80 -87.19 152.41 22.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.212 0.53 . . . . 138.03 110.824 -178.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 416' ' ' MET . . . . . . . . . . . . . 3.3 mtm -73.21 131.63 42.23 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.73 -0.668 . . . . 135.33 110.904 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 417' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -89.99 14.53 12.01 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.575 0.583 . . . . 139.75 112.575 173.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 418' ' ' PHE . . . . . . . . . . . . . 11.4 p90 -132.1 163.26 28.86 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.451 0.643 . . . . 132.31 109.336 173.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 419' ' ' CYS . . . . . . . . . . . . . 23.3 t -81.54 145.23 30.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.435 -0.802 . . . . 119.75 110.533 -179.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 420' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.76 -8.0 55.07 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.38 0.881 . . . . 133.18 113.38 -179.006 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 421' ' ' VAL . . . . . . . . . . . . . 51.7 t -113.81 -45.9 4.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 118.504 0.593 . . . . 157.76 111.405 -172.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 422' ' ' CYS . . . . . 0.406 ' SG ' ' ND1' ' B' ' 439' ' ' HIS . 16.1 p -106.34 -9.38 16.8 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 113.529 0.937 . . . . 119.76 113.529 179.327 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 423' ' ' LYS . . . . . . . . . . . . . 6.9 mmtm 58.51 38.53 25.46 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.735 0.814 . . . . 125.47 111.927 177.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 424' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -120.51 165.53 14.86 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.608 0.718 . . . . 166.79 109.85 175.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 425' ' ' GLY . . . . . . . . . . . . . . . -96.85 -168.15 33.52 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-O 122.192 0.885 . . . . 156.24 112.589 178.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 426' ' ' GLY . . . . . . . . . . . . . . . 125.59 -137.72 10.45 Favored Glycine 0 C--N 1.332 0.314 0 CA-C-N 114.936 -0.632 . . . . 189.14 113.233 178.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 427' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -79.29 139.34 37.88 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.85 -0.796 . . . . 204.17 108.85 163.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 428' ' ' LEU . . . . . . . . . . . . . 5.6 mp -149.69 142.2 24.4 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 120.315 -0.554 . . . . 144.81 109.998 -179.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 429' ' ' LEU . . . . . . . . . . . . . 25.9 tp -97.35 120.97 38.7 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 108.572 -0.899 . . . . 119.77 108.572 176.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 430' ' ' CYS . . . . . . . . . . . . . 34.6 m -101.64 133.75 45.86 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 122.668 0.387 . . . . 118.51 110.645 -172.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 431' ' ' CYS . . . . . . . . . . . . . 45.9 t -64.09 148.1 50.64 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.515 0.674 . . . . 141.17 110.727 178.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 432' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -89.69 -17.34 28.52 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.474 -0.784 . . . . 134.66 112.977 -176.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 433' ' ' ALA . . . . . . . . . . . . . . . -105.28 -16.14 14.85 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 113.285 0.846 . . . . 142.73 113.285 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 434' ' ' CYS . . . . . 0.749 ' SG ' 'ZN ' ' B' ' 702' ' ' ' ZN' . 13.9 p -147.15 162.25 33.45 Favored Pre-proline 0 C--O 1.237 0.405 0 N-CA-C 108.567 -0.901 . . . . 150.29 108.567 -174.784 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 435' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -75.86 15.96 0.85 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 N-CA-C 115.11 1.158 . . . . 114.22 115.11 -173.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 436' ' ' SER . . . . . . . . . . . . . 67.6 m -72.94 152.22 41.51 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.784 0.802 . . . . 122.45 111.179 -177.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 437' ' ' SER . . . . . . . . . . . . . 2.6 m -150.1 131.43 14.63 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 107.818 -1.178 . . . . 129.61 107.818 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 438' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -131.19 153.92 48.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.2 0.524 . . . . 148.65 110.21 -173.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 439' ' ' HIS . . . . . 0.406 ' ND1' ' SG ' ' B' ' 422' ' ' CYS . 51.6 m170 -79.71 134.91 36.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.416 -0.811 . . . . 162.35 109.067 165.662 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 440' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.49 -40.73 83.61 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 115.939 -0.573 . . . . 156.38 111.425 -173.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 441' ' ' HIS . . . . . . . . . . . . . 43.1 p-80 -70.82 -15.69 62.67 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.168 0.433 . . . . 187.87 112.168 175.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 9.8 m -90.82 5.14 49.61 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 113.114 0.783 . . . . 148.35 113.114 -179.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 443' ' ' LEU . . . . . . . . . . . . . 9.9 mp -84.48 172.2 11.9 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 122.003 0.906 . . . . 133.92 110.281 173.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 444' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -146.57 101.38 4.01 Favored Pre-proline 0 C--O 1.242 0.702 0 N-CA-C 108.038 -1.097 . . . . 128.41 108.038 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 445' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -79.41 149.88 83.57 Favored 'Cis proline' 0 C--N 1.343 0.286 0 C-N-CA 123.842 -1.316 . . . . 119.06 113.138 4.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 446' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -61.32 141.96 94.43 Favored 'Trans proline' 0 C--N 1.333 -0.242 0 O-C-N 123.546 1.288 . . . . 144.91 110.699 176.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 447' ' ' LEU . . . . . . . . . . . . . 17.7 mt -89.82 156.99 46.86 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-N 115.599 -0.728 . . . . 131.54 110.465 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 448' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -69.65 -48.61 0.7 Allowed 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 119.762 0.308 . . . . 157.36 111.704 178.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 449' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -170.56 -176.99 2.25 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.937 -1.134 . . . . 192.06 107.937 172.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 450' ' ' ILE . . . . . . . . . . . . . 3.7 mp -52.23 121.27 19.8 Favored Pre-proline 0 C--O 1.24 0.587 0 C-N-CA 124.16 0.984 . . . . 142.89 111.692 -169.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 451' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -72.24 157.7 53.23 Favored 'Trans proline' 0 C--N 1.331 -0.355 0 CA-C-O 122.085 0.785 . . . . 175.62 111.683 178.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 452' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.55 -65.11 0.73 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 114.796 -1.093 . . . . 186.43 112.021 -175.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 453' ' ' GLY . . . . . . . . . . . . . . . -78.3 -158.72 11.88 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-O 122.028 0.793 . . . . 164.42 112.779 -175.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 454' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -71.91 139.54 48.8 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.059 -0.57 . . . . 164.12 110.431 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 455' ' ' TRP . . . . . . . . . . . . . 66.7 t90 -122.01 131.56 54.06 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 108.408 -0.96 . . . . 143.54 108.408 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 456' ' ' LEU . . . . . . . . . . . . . 3.0 mp -114.75 135.66 53.93 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.269 -0.641 . . . . 135.3 109.269 178.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 457' ' ' CYS . . . . . . . . . . . . . 12.2 p -69.47 158.81 85.9 Favored Pre-proline 0 N--CA 1.45 -0.471 0 CA-C-N 115.86 -0.609 . . . . 121.35 111.046 -170.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 458' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -51.69 -29.46 33.37 Favored 'Trans proline' 0 C--O 1.237 0.464 0 N-CA-C 114.312 0.851 . . . . 130.57 114.312 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 459' ' ' ARG . . . . . . . . . . . . . 68.0 mtp85 -64.76 -38.38 90.81 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 118.645 0.657 . . . . 116.53 111.232 173.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 460' ' ' CYS . . . . . . . . . . . . . 83.5 m -77.82 -31.62 51.78 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 112.106 0.41 . . . . 102.76 112.106 176.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 5.0 p -74.2 -28.86 61.47 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.341 -0.544 . . . . 130.79 111.696 177.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 462' ' ' CYS . . . . . . . . . . . . . 47.6 t -52.47 119.24 14.71 Favored Pre-proline 0 C--O 1.241 0.626 0 C-N-CA 123.268 0.627 . . . . 129.95 110.653 -172.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 463' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -68.46 154.21 72.27 Favored 'Trans proline' 0 C--O 1.245 0.826 0 N-CA-C 110.624 -0.568 . . . . 118.1 110.624 -177.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 464' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.19 163.95 36.66 Favored 'Trans proline' 0 C--N 1.33 -0.397 0 CA-C-O 122.023 0.76 . . . . 114.67 111.287 176.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 465' ' ' LEU . . . . . . . . . . . . . 19.2 mt -87.36 145.8 26.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.945 -1.025 . . . . 106.17 110.251 177.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 466' ' ' LYS . . . . . . . . . . . . . 13.7 pttp -67.23 -27.15 66.99 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.608 -0.723 . . . . 143.48 111.854 -178.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 467' ' ' GLY . . . . . . . . . . . . . . . -145.57 -168.38 13.06 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 117.882 0.31 . . . . 107.93 113.681 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 468' ' ' LYS . . . . . . . . . . . . . 4.3 mtpp -100.9 122.87 44.21 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 108.542 -0.911 . . . . 133.99 108.542 176.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 469' ' ' VAL . . . . . . . . . . . . . 2.2 p -78.96 132.52 32.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 109.211 -0.663 . . . . 98.84 109.211 178.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 470' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -92.04 -33.27 14.87 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 112.494 0.553 . . . . 119.91 112.494 178.944 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 471' ' ' ARG . . . . . 0.522 ' NH1' ' OH ' ' B' ' 520' ' ' TYR . 4.4 ttp-105 -153.7 141.42 20.0 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 109.742 -0.466 . . . . 105.14 109.742 -176.787 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 472' ' ' ILE . . . . . . . . . . . . . 2.5 mt -91.26 127.74 43.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 108.51 -0.922 . . . . 108.64 108.51 171.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 473' ' ' LEU . . . . . . . . . . . . . 10.3 mp -100.5 -42.29 6.64 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.084 0.772 . . . . 98.25 113.084 -173.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 474' ' ' HIS . . . . . 0.524 ' O ' ' N ' ' B' ' 512' ' ' PHE . 29.8 t-80 -164.1 163.24 23.18 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.274 -1.01 . . . . 130.25 108.274 -171.239 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 33.0 p-90 -146.71 145.52 30.01 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.57 -0.741 . . . . 131.7 109.334 175.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 33.4 ptt180 -140.18 163.71 32.01 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.383 -0.826 . . . . 117.36 109.142 179.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 477' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -82.29 155.54 24.77 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.395 -0.82 . . . . 119.88 110.51 176.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 478' ' ' THR . . . . . . . . . . . . . 3.1 t -137.9 170.94 15.17 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.371 -0.831 . . . . 145.53 109.204 176.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -61.47 150.92 79.21 Favored Pre-proline 0 C--O 1.236 0.345 0 CA-C-N 115.219 -0.9 . . . . 194.5 110.368 -177.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 480' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -71.16 148.09 55.35 Favored 'Trans proline' 0 C--O 1.245 0.828 0 N-CA-C 110.353 -0.672 . . . . 156.1 110.353 170.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 481' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -65.49 159.77 46.18 Favored 'Trans proline' 0 C--N 1.33 -0.401 0 CA-C-O 122.1 0.792 . . . . 156.58 111.729 178.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 482' ' ' ALA . . . . . . . . . . . . . . . -82.83 131.68 53.67 Favored Pre-proline 0 C--O 1.235 0.322 0 CA-C-N 114.908 -1.042 . . . . 189.01 110.336 -175.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 483' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo . . . . . 0 C--N 1.341 0.172 0 C-N-CA 123.674 2.916 . . . . 174.06 112.427 178.566 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 503' ' ' LEU . . . . . . . . . . . . . 8.6 tp . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.772 0.32 . . . . 170.96 110.557 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 504' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -79.52 179.8 7.27 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.907 0.861 . . . . 206.35 110.833 -172.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 505' ' ' GLY . . . . . . . . . . . . . . . -124.35 177.04 16.89 Favored Glycine 0 N--CA 1.444 -0.8 0 CA-C-O 122.151 0.862 . . . . 172.1 113.333 -173.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 506' ' ' ILE . . . . . . . . . . . . . 4.1 tp -87.39 144.89 36.45 Favored Pre-proline 0 C--O 1.24 0.595 0 N-CA-C 108.104 -1.072 . . . . 141.48 108.104 -176.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 507' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -66.96 137.77 45.82 Favored 'Trans proline' 0 C--O 1.234 0.291 0 CA-C-N 119.389 0.817 . . . . 134.64 111.831 177.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 508' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -96.38 172.75 7.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.331 -0.849 . . . . 151.22 110.266 176.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 509' ' ' ARG . . . . . . . . . . . . . 6.9 ptp85 -127.9 140.78 51.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.419 -0.81 . . . . 128.16 109.75 -179.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -118.38 149.22 41.57 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.062 -0.517 . . . . 133.36 109.65 177.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 511' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -111.02 138.26 47.65 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.04 -0.527 . . . . 106.2 110.884 -173.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 512' ' ' PHE . . . . . 0.524 ' N ' ' O ' ' B' ' 474' ' ' HIS . 2.4 t80 -84.44 122.98 29.73 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.44 -0.948 . . . . 109.61 108.44 173.354 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 513' ' ' VAL . . . . . . . . . . . . . 22.0 m -119.4 155.43 21.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 121.5 0.667 . . . . 116.52 109.988 -171.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -105.38 119.48 39.19 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 107.762 -1.199 . . . . 114.7 107.762 165.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 515' ' ' TRP . . . . . . . . . . . . . 90.0 m95 -76.14 133.94 40.09 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.221 -0.592 . . . . 103.69 109.8 -178.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 516' ' ' ALA . . . . . . . . . . . . . . . -65.33 142.16 58.34 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.026 -0.67 . . . . 108.32 109.571 174.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 517' ' ' GLY . . . . . . . . . . . . . . . 75.79 -19.71 2.57 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 115.052 0.781 . . . . 91.25 115.052 -178.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 518' ' ' LEU . . . . . . . . . . . . . 21.4 mt -103.75 154.1 19.94 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.277 1.038 . . . . 99.34 109.648 173.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 519' ' ' SER . . . . . . . . . . . . . 13.2 p -73.36 -173.98 1.51 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.891 0.853 . . . . 102.72 110.361 -177.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 520' ' ' TYR . . . . . 0.522 ' OH ' ' NH1' ' B' ' 471' ' ' ARG . 41.7 m-85 -78.65 -9.33 59.35 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.812 0.671 . . . . 102.13 112.812 176.0 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 521' ' ' TRP . . . . . . . . . . . . . 90.0 m95 -68.89 -29.59 67.9 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 119.327 -0.949 . . . . 102.81 111.178 174.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 522' ' ' HIS . . . . . 0.568 ' NE2' ' OE1' ' B' ' 625' ' ' GLU . 90.6 m-70 -88.86 0.92 56.13 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.038 0.755 . . . . 110.23 113.038 -178.178 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 523' ' ' CYS . . . . . . . . . . . . . 71.7 m -50.34 122.62 7.21 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 118.451 0.568 . . . . 88.82 110.886 172.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 524' ' ' SER . . . . . . . . . . . . . 20.2 p -134.01 -178.74 5.16 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.36 -0.837 . . . . 89.89 108.919 -175.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 525' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -102.47 145.87 28.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.728 -0.669 . . . . 113.65 110.387 179.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 526' ' ' VAL . . . . . . . . . . . . . 33.5 m -137.63 153.82 28.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 121.641 0.734 . . . . 90.37 109.216 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -73.06 144.65 47.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.119 -0.946 . . . . 125.94 110.619 -179.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 528' ' ' GLU . . . . . 0.4 ' OE1' ' OH ' ' B' ' 539' ' ' TYR . 44.9 tt0 -58.87 -43.77 90.96 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 115.624 -0.716 . . . . 125.74 111.185 -177.759 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 529' ' ' LEU . . . . . . . . . . . . . 34.2 tp -57.41 -37.36 72.63 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.709 -0.397 . . . . 103.82 111.203 178.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -58.65 -41.32 85.8 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.473 -0.491 . . . . 120.46 111.128 175.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 531' ' ' LEU . . . . . . . . . . . . . 11.9 mt -65.79 -45.0 84.05 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.682 -0.407 . . . . 98.31 111.183 179.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -64.55 -35.61 81.53 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 120.387 -0.525 . . . . 138.43 111.587 -176.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 533' ' ' LEU . . . . . . . . . . . . . 22.9 mt -76.77 -48.09 19.71 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 119.94 -0.704 . . . . 108.05 111.752 -176.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 534' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -103.07 -9.8 19.43 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 114.053 1.131 . . . . 119.56 114.053 -170.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 535' ' ' HIS . . . . . . . . . . . . . 70.9 m80 -142.9 57.26 1.41 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 122.08 0.943 . . . . 100.82 109.262 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 536' ' ' THR . . . . . . . . . . . . . 3.1 m -59.77 -49.77 76.42 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.003 -0.544 . . . . 115.98 111.592 -173.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 537' ' ' VAL . . . . . . . . . . . . . 8.1 p -64.42 -40.87 90.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 C-N-CA 119.891 -0.724 . . . . 141.47 110.656 -172.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 538' ' ' MET . . . . . . . . . . . . . 24.4 ttm -67.31 -34.38 77.26 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.044 -0.663 . . . . 126.28 111.168 175.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 539' ' ' TYR . . . . . 0.4 ' OH ' ' OE1' ' B' ' 528' ' ' GLU . 43.3 t80 -68.28 -51.33 46.18 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 120.643 0.258 . . . . 139.9 111.2 179.262 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 540' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -62.57 -38.22 89.24 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.593 -0.443 . . . . 151.4 111.402 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 541' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -57.66 -50.59 72.66 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.584 -0.447 . . . . 117.69 110.992 175.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 542' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -57.28 -53.41 58.39 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.115 0.484 . . . . 114.37 110.879 176.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 543' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -48.31 -41.64 28.78 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 112.469 0.544 . . . . 141.57 112.469 -177.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 544' ' ' ARG . . . . . . . . . . . . . 2.7 ttp-105 -74.73 -30.71 61.6 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.53 -0.468 . . . . 176.6 110.376 -177.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 545' ' ' LYS . . . . . . . . . . . . . 15.8 mttt -70.8 -31.19 67.86 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.591 -0.844 . . . . 149.44 112.117 -172.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 546' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -147.25 155.91 42.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 118.649 0.659 . . . . 137.95 110.135 178.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 547' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -75.08 153.58 38.28 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.632 -0.713 . . . . 183.33 111.074 -173.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 548' ' ' MET . . . . . . . . . . . . . 64.6 mmm -115.14 20.61 14.85 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.38 -0.827 . . . . 128.92 112.951 -169.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 549' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -88.69 -48.79 7.27 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 117.834 0.288 . . . . 164.75 111.139 170.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 550' ' ' GLU . . . . . . . . . . . . . 52.1 tt0 -107.76 127.2 28.17 Favored Pre-proline 0 N--CA 1.45 -0.469 0 C-N-CA 125.524 1.53 . . . . 174.16 109.261 -178.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 551' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -61.24 152.91 68.84 Favored 'Trans proline' 0 C--O 1.248 0.987 0 CA-C-N 119.009 0.682 . . . . 137.87 110.769 178.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -69.53 153.88 69.38 Favored 'Trans proline' 0 C--O 1.244 0.784 0 N-CA-C 110.686 -0.544 . . . . 129.49 110.686 -178.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 553' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -68.23 160.1 50.34 Favored 'Trans proline' 0 C--N 1.33 -0.406 0 CA-C-O 122.165 0.819 . . . . 133.58 111.281 -179.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -75.68 139.71 42.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.802 -1.09 . . . . 168.14 109.63 179.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 555' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -87.07 70.16 10.22 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 122.586 1.184 . . . . 164.63 109.286 176.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 556' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 114.596 -1.184 . . . . 184.97 109.99 173.603 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 571' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? . . . . . 0 C--O 1.232 0.17 0 CA-C-O 121.005 0.431 . . . . 193.83 110.808 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 572' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -79.36 170.99 13.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.711 -0.677 . . . . 185.15 109.49 176.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 573' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -60.76 -38.46 70.71 Favored 'Trans proline' 0 C--O 1.236 0.379 0 N-CA-C 113.798 0.653 . . . . 167.87 113.798 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 574' ' ' LEU . . . . . . . . . . . . . 37.5 tp -60.18 -41.52 93.09 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.016 -0.673 . . . . 156.71 111.229 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 575' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -69.12 -33.07 72.88 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.308 -0.557 . . . . 126.55 111.541 173.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -63.05 -51.42 66.81 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.67 -0.412 . . . . 118.57 111.275 -175.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 577' ' ' LYS . . . . . . . . . . . . . 3.6 pttp -70.57 -31.43 68.46 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 119.179 -1.008 . . . . 156.2 111.329 177.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 578' ' ' MET . . . . . . . . . . . . . 10.0 tpp -63.55 -42.28 98.38 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.232 -0.587 . . . . 133.74 110.986 173.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 579' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -61.4 -44.66 96.76 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.641 -0.824 . . . . 141.91 110.565 172.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 580' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -64.17 -36.04 82.74 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.618 -0.433 . . . . 148.58 111.458 -179.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 581' ' ' ARG . . . . . . . . . . . . . 6.9 mtp180 -79.88 -35.45 38.07 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.049 -0.66 . . . . 143.38 112.198 -174.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 582' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -132.77 -62.74 0.8 Allowed 'General case' 0 C--O 1.237 0.438 0 N-CA-C 113.704 1.001 . . . . 116.16 113.704 -169.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 583' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -52.47 -37.36 56.92 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.438 0.533 . . . . 112.89 112.438 -163.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 584' ' ' ARG . . . . . . . . . . . . . 1.7 ptm180 -62.59 -31.04 71.79 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 119.936 -0.706 . . . . 149.46 111.979 -173.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 585' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -82.67 2.98 30.86 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.85 0.685 . . . . 118.86 112.85 -178.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 586' ' ' GLY . . . . . . . . . . . . . . . 110.29 29.28 3.76 Favored Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 114.508 0.563 . . . . 109.07 114.508 172.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 587' ' ' ILE . . . . . . . . . . . . . 58.8 mt -102.79 110.86 30.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 107.913 -1.143 . . . . 102.04 107.913 176.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 588' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -58.08 124.7 71.42 Favored Pre-proline 0 C--O 1.241 0.65 0 N-CA-C 108.827 -0.805 . . . . 113.09 108.827 173.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 589' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -56.1 -27.75 66.56 Favored 'Trans proline' 0 C--O 1.238 0.497 0 N-CA-C 114.119 0.776 . . . . 108.56 114.119 -173.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 590' ' ' GLU . . . . . 0.475 ' OE1' ' N ' ' B' ' 590' ' ' GLU . 45.0 mp0 -62.76 -29.0 70.37 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 118.164 0.438 . . . . 99.88 111.763 178.539 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 591' ' ' TRP . . . . . . . . . . . . . 52.0 m0 -66.71 -18.66 65.49 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.545 0.572 . . . . 89.5 112.545 -176.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 592' ' ' MET . . . . . . . . . . . . . 6.3 mtp -101.03 0.68 38.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.151 0.432 . . . . 94.89 112.134 175.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 593' ' ' MET . . . . . . . . . . . . . 5.8 mtt -85.72 129.09 34.92 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 109.276 -0.638 . . . . 102.14 109.276 174.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 594' ' ' ILE . . . . . . . . . . . . . 14.7 mt -69.19 126.84 30.05 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 109.442 -0.577 . . . . 108.86 109.442 175.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 595' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -94.66 -50.54 5.13 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.342 -0.39 . . . . 96.27 111.155 172.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 69.3 mtp180 -145.5 147.4 32.11 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.666 -0.864 . . . . 146.82 108.666 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 597' ' ' ILE . . . . . . . . . . . . . 14.3 mt -100.48 117.66 46.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 106.595 -1.631 . . . . 99.61 106.595 164.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 598' ' ' LEU . . . . . . . . . . . . . 16.4 mt -92.26 -47.06 7.4 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.131 0.419 . . . . 93.45 112.131 -171.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 599' ' ' ASN . . . . . 0.548 ' ND2' ' O ' ' B' ' 600' ' ' HIS . 3.9 t30 -158.97 159.24 34.63 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.531 0.681 . . . . 155.07 109.477 176.239 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 600' ' ' HIS . . . . . 0.548 ' O ' ' ND2' ' B' ' 599' ' ' ASN . 42.2 p-80 -102.4 167.11 10.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.87 -1.059 . . . . 107.11 110.052 175.239 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 601' ' ' SER . . . . . . . . . . . . . 33.5 t -147.3 123.28 10.71 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.043 -1.095 . . . . 103.32 108.043 173.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 602' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -89.4 99.79 12.71 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 107.862 -1.162 . . . . 121.45 107.862 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 603' ' ' ASP . . . . . 0.461 ' OD2' ' N ' ' B' ' 604' ' ' LYS . 46.5 t0 -52.51 146.14 10.39 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.477 0.656 . . . . 175.88 110.483 178.026 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 604' ' ' LYS . . . . . 0.461 ' N ' ' OD2' ' B' ' 603' ' ' ASP . 20.8 mmtt -64.87 -25.88 68.09 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.625 -0.716 . . . . 159.6 111.411 178.221 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 605' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -66.94 -27.25 67.32 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.51 -0.476 . . . . 154.82 111.619 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 606' ' ' GLY . . . . . . . . . . . . . . . 122.64 -0.32 10.16 Favored Glycine 0 C--O 1.238 0.391 0 CA-C-O 119.031 -0.872 . . . . 135.29 114.597 -177.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 607' ' ' ASP . . . . . 0.414 ' O ' ' N ' ' B' ' 603' ' ' ASP . 5.0 m-20 -91.81 157.49 16.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 119.32 1.56 . . . . 139.42 110.062 177.209 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 608' ' ' VAL . . . . . . . . . . . . . 5.4 p -113.88 133.27 60.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 N-CA-C 108.357 -0.979 . . . . 110.92 108.357 175.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 609' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -116.0 152.2 33.99 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.573 -0.899 . . . . 109.26 108.573 173.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 610' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -120.94 122.74 40.83 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.454 -0.943 . . . . 93.98 108.454 178.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 611' ' ' LEU . . . . . . . . . . . . . 9.9 tp -78.1 111.61 14.19 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.392 -1.336 . . . . 98.85 107.392 172.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 612' ' ' ILE . . . . . 0.476 ' CD1' ' CE2' ' B' ' 614' ' ' TRP . 2.2 pp -107.06 165.8 4.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.04 -0.726 . . . . 120.38 109.04 -175.252 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 613' ' ' LYS . . . . . 0.481 ' NZ ' ' O ' ' B' ' 617' ' ' LEU . 9.2 tptp -115.5 128.54 56.07 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 107.847 -1.168 . . . . 101.1 107.847 169.428 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 614' ' ' TRP . . . . . 0.476 ' CE2' ' CD1' ' B' ' 612' ' ' ILE . 86.3 m95 -89.16 150.21 22.8 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.383 0.611 . . . . 112.34 110.557 -177.321 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 615' ' ' LYS . . . . . . . . . . . . . 18.3 mttt -68.98 137.99 54.17 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.535 -0.757 . . . . 113.93 110.344 177.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 616' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 59.35 28.23 17.52 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.553 0.741 . . . . 137.07 111.993 178.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 617' ' ' LEU . . . . . 0.481 ' O ' ' NZ ' ' B' ' 613' ' ' LYS . 19.7 mt -134.09 130.94 20.57 Favored Pre-proline 0 C--O 1.243 0.739 0 N-CA-C 105.869 -1.901 . . . . 99.15 105.869 175.0 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 618' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -67.61 172.16 10.86 Favored 'Trans proline' 0 C--N 1.328 -0.525 0 CA-C-O 122.254 0.856 . . . . 79.75 111.592 -174.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 619' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -68.31 -36.84 79.91 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 114.815 -1.084 . . . . 124.02 111.712 -173.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 620' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' B' ' 620' ' ' ASP . 9.6 p-10 -59.3 -16.56 22.68 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 119.912 -0.715 . . . . 133.5 111.944 176.932 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 621' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -97.13 13.66 28.47 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 123.45 0.7 . . . . 156.38 112.595 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 622' ' ' CYS . . . . . . . . . . . . . 84.3 m -65.31 145.13 56.6 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.266 0.555 . . . . 88.59 110.154 172.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 623' ' ' THR . . . . . . . . . . . . . 2.0 p -132.14 156.15 46.89 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.574 0.702 . . . . 83.15 109.945 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 624' ' ' TRP . . . . . . . . . . . . . 86.6 m95 -82.18 129.35 34.81 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.121 -0.945 . . . . 93.44 109.207 170.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 625' ' ' GLU . . . . . 0.568 ' OE1' ' NE2' ' B' ' 522' ' ' HIS . 3.2 tp10 -117.18 146.19 43.38 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.315 0.578 . . . . 130.13 110.338 -178.803 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 626' ' ' ILE . . . . . . . . . . . . . 36.9 pt -71.55 161.19 4.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 CA-C-O 122.26 1.028 . . . . 97.88 110.226 -177.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 627' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -70.35 -46.01 65.0 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.204 -0.907 . . . . 120.18 111.174 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 628' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -99.33 78.87 2.25 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 122.135 0.969 . . . . 126.0 110.019 -168.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 629' ' ' ILE . . . . . . . . . . . . . 5.8 tp -149.81 133.06 7.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 107.889 -1.152 . . . . 136.91 107.889 168.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 630' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -82.94 85.07 7.21 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.87 0.843 . . . . 151.92 109.468 -170.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 631' ' ' ILE . . . . . . . . . . . . . 51.4 mt -99.48 139.21 20.73 Favored Pre-proline 0 C--O 1.241 0.64 0 N-CA-C 107.661 -1.237 . . . . 104.16 107.661 172.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 632' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.81 137.67 79.29 Favored 'Trans proline' 0 C--O 1.234 0.303 0 CA-C-N 119.205 0.752 . . . . 103.55 111.263 177.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 633' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 63.15 11.89 5.63 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 125.301 1.44 . . . . 107.07 113.403 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 634' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -65.01 -45.55 85.1 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.652 -0.819 . . . . 109.81 111.223 -176.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 635' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -76.5 -28.71 56.52 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.759 -0.777 . . . . 163.12 111.791 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 636' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -58.22 -56.24 24.66 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.27 -0.572 . . . . 114.87 110.23 171.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 637' ' ' LEU . . . . . . . . . . . . . 59.8 mt -67.86 -30.2 69.52 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.635 -0.426 . . . . 97.94 111.735 -179.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 638' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -58.51 -50.76 72.59 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 119.983 -0.687 . . . . 94.9 110.631 171.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 639' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -65.07 -33.63 76.49 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.186 -0.605 . . . . 117.05 111.797 -179.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 640' ' ' ALA . . . . . . . . . . . . . . . -69.02 -42.01 76.95 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.557 -0.457 . . . . 90.78 111.138 177.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 641' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -61.46 -48.71 79.89 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.879 0.371 . . . . 121.19 110.746 178.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 642' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -65.78 -34.07 77.31 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.479 -0.488 . . . . 110.48 111.652 176.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 643' ' ' GLY . . . . . . . . . . . . . . . -57.74 -57.21 21.01 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 121.098 -0.572 . . . . 97.33 112.263 176.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 644' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -59.65 -35.48 74.49 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.553 -0.459 . . . . 157.43 110.93 177.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 645' ' ' ARG . . . . . . . . . . . . . 36.1 ttt-85 -61.78 -30.7 70.97 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.237 -0.585 . . . . 124.95 111.664 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 646' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -70.86 -35.14 72.26 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.023 -0.671 . . . . 120.25 111.001 171.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 647' ' ' LEU . . . . . . . . . . . . . 7.5 mt -60.95 -27.09 67.99 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 111.932 0.345 . . . . 130.07 111.932 -175.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 648' ' ' MET . . . . . . . . . . . . . 2.3 mtm -87.81 25.28 1.55 Allowed 'General case' 0 C--O 1.239 0.512 0 N-CA-C 112.485 0.55 . . . . 186.51 112.485 171.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 649' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 C--N 1.331 -0.208 0 C-N-CA 123.121 0.568 . . . . 163.3 111.948 176.346 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 702' ' ' ' ZN' . . . . . 0.749 'ZN ' ' SG ' ' B' ' 434' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 413' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.775 0.321 . . . . 180.24000000000001 111.266 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -82.87 173.07 12.16 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.935 0.874 . . . . 186.94999999999999 110.463 179.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 415' ' ' HIS . . . . . 0.613 ' CD2' ' HB3' ' A' ' 430' ' ' CYS . 20.3 m80 -110.86 165.36 11.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.818 0.818 . . . . 145.72 110.103 179.02 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 416' ' ' MET . . . . . 0.458 ' HG3' ' O ' ' A' ' 435' ' ' PRO . 31.6 mtm -64.75 129.84 41.28 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.226 -0.897 . . . . 126.98999999999999 110.072 174.92 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 417' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -85.22 23.72 1.24 Allowed 'General case' 0 C--O 1.237 0.439 0 N-CA-C 112.897 0.703 . . . . 147.94999999999999 112.897 176.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 418' ' ' PHE . . . . . . . . . . . . . 33.2 p90 -154.38 146.69 23.87 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.007 -0.738 . . . . 121.76000000000001 109.007 -178.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 419' ' ' CYS . . . . . 0.444 ' SG ' ' N ' ' A' ' 439' ' ' HIS . 53.8 t -59.5 129.82 43.85 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.608 -0.723 . . . . 148.88 110.169 177.221 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 1.2 ttm-85 -58.89 -40.89 85.78 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.749 -0.66 . . . . 114.23 111.405 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 21.6 t -76.16 -40.35 36.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 C-N-CA 120.92 -0.312 . . . . 133.41 111.273 -172.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 422' ' ' CYS . . . . . . . . . . . . . 1.5 p -114.8 -0.05 13.64 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 114.473 1.286 . . . . 141.30000000000001 114.473 -170.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 3.2 mmtp 65.79 4.34 2.88 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.528 0.731 . . . . 143.58000000000001 112.933 171.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -103.88 157.18 17.27 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.582 0.706 . . . . 168.05000000000001 110.526 -179.597 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -93.95 -168.41 37.83 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-O 122.343 0.968 . . . . 129.44999999999999 112.622 179.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 113.4 -143.09 17.75 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 114.779 -0.71 . . . . 152.06999999999999 113.177 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -60.31 105.32 0.41 Allowed 'General case' 0 C--O 1.235 0.295 0 C-N-CA 122.334 0.253 . . . . 193.27000000000001 110.474 178.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 428' ' ' LEU . . . . . . . . . . . . . 26.2 mt -119.0 149.2 42.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.422 0.629 . . . . 148.74000000000001 111.022 -173.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 429' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -124.75 116.54 22.48 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.307 -1.368 . . . . 163.56999999999999 107.307 -179.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 430' ' ' CYS . . . . . 0.613 ' HB3' ' CD2' ' A' ' 415' ' ' HIS . 9.1 m -104.51 138.01 41.52 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.09 0.471 . . . . 152.31999999999999 111.265 -165.698 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 431' ' ' CYS . . . . . 0.659 ' HB2' ' HB3' ' A' ' 457' ' ' CYS . 49.3 t -72.25 143.63 48.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.45 -0.796 . . . . 133.86000000000001 110.149 176.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -90.38 -5.17 56.49 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 113.348 0.87 . . . . 156.53999999999999 113.348 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 433' ' ' ALA . . . . . . . . . . . . . . . -105.55 -22.87 12.9 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 114.011 1.115 . . . . 137.91 114.011 175.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 434' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -145.3 162.81 35.52 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.386 -0.968 . . . . 149.41 108.386 -178.132 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 435' ' ' PRO . . . . . 0.458 ' O ' ' HG3' ' A' ' 416' ' ' MET . 13.3 Cg_exo -76.34 15.39 1.01 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 N-CA-C 114.618 0.969 . . . . 110.78 114.618 -173.965 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 436' ' ' SER . . . . . . . . . . . . . 68.0 m -68.95 153.91 42.98 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.768 0.794 . . . . 124.47 111.185 -177.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 437' ' ' SER . . . . . . . . . . . . . 21.6 m -148.4 135.41 20.13 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.438 -0.949 . . . . 112.33 108.438 179.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 438' ' ' TYR . . . . . 0.481 ' CE2' ' HB2' ' A' ' 457' ' ' CYS . 67.7 m-85 -133.59 156.47 47.78 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.742 0.782 . . . . 145.19999999999999 111.021 -172.659 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 439' ' ' HIS . . . . . 0.499 ' HB3' ' CE1' ' A' ' 441' ' ' HIS . 40.2 m170 -93.54 131.27 38.96 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 114.706 -1.134 . . . . 150.50999999999999 108.919 169.963 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 440' ' ' LEU . . . . . . . . . . . . . 2.7 mp -57.33 -31.77 66.04 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.601 0.593 . . . . 149.78 112.601 -170.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 441' ' ' HIS . . . . . 0.499 ' CE1' ' HB3' ' A' ' 439' ' ' HIS . 25.8 p-80 -71.98 -22.52 61.42 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 119.333 -0.947 . . . . 156.21000000000001 112.327 173.29 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 442' ' ' CYS . . . . . 0.417 ' SG ' ' HB2' ' A' ' 439' ' ' HIS . 91.5 m -79.74 -28.49 40.49 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.682 0.623 . . . . 153.53999999999999 112.682 -175.248 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 443' ' ' LEU . . . . . 0.466 HD12 ' O ' ' A' ' 439' ' ' HIS . 3.9 mp -75.07 156.68 35.86 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 122.116 0.96 . . . . 155.93000000000001 111.379 -177.624 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 444' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -127.94 106.19 20.28 Favored Pre-proline 0 C--O 1.249 1.042 0 CA-C-N 114.754 -1.112 . . . . 163.47 109.083 -176.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -78.06 152.58 91.93 Favored 'Cis proline' 0 C--N 1.341 0.176 0 C-N-CA 125.094 -0.794 . . . . 163.31 113.151 1.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -61.07 144.21 99.28 Favored 'Trans proline' 0 C--N 1.332 -0.308 0 O-C-N 123.491 1.258 . . . . 142.66999999999999 111.007 174.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 6.1 mt -96.24 146.9 32.11 Favored Pre-proline 0 C--N 1.346 0.428 0 C-N-CA 118.588 -1.245 . . . . 153.53 110.784 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 448' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -52.59 -60.51 0.71 Allowed 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 120.817 1.011 . . . . 156.83000000000001 113.368 178.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -165.46 -171.12 2.03 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 107.926 -1.139 . . . . 197.81 107.926 164.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 450' ' ' ILE . . . . . . . . . . . . . 2.9 mp -46.24 115.15 2.91 Favored Pre-proline 0 C--O 1.239 0.539 0 C-N-CA 125.297 1.439 . . . . 175.91999999999999 110.851 -170.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.34 156.51 29.19 Favored 'Trans proline' 0 C--N 1.328 -0.504 0 CA-C-O 122.185 0.827 . . . . 184.72 112.035 -177.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 452' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -69.79 145.63 52.03 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 114.553 -1.203 . . . . 191.63 110.489 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 68.71 -157.04 53.29 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 122.441 1.023 . . . . 169.09999999999999 113.136 176.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -64.72 158.9 23.45 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 122.038 0.923 . . . . 199.38 110.792 -178.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 455' ' ' TRP . . . . . 0.438 ' CH2' ' HA ' ' A' ' 457' ' ' CYS . 63.6 t90 -148.77 124.65 10.6 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 107.717 -1.216 . . . . 148.21000000000001 107.717 173.49 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 456' ' ' LEU . . . . . . . . . . . . . 4.6 mt -104.66 134.1 48.38 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.937 -0.764 . . . . 121.40000000000001 108.937 -179.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 457' ' ' CYS . . . . . 0.659 ' HB3' ' HB2' ' A' ' 431' ' ' CYS . 20.5 p -72.19 161.74 77.34 Favored Pre-proline 0 N--CA 1.453 -0.313 0 CA-C-N 116.023 -0.535 . . . . 111.89 111.509 -170.327 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 458' ' ' PRO . . . . . 0.582 ' HA ' HG22 ' A' ' 461' ' ' THR . 95.4 Cg_exo -56.73 -29.28 79.77 Favored 'Trans proline' 0 C--O 1.237 0.466 0 N-CA-C 114.179 0.8 . . . . 133.41999999999999 114.179 -178.504 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 1.8 ptp180 -83.47 -24.91 31.58 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 118.967 -1.093 . . . . 129.72 111.511 176.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 1.3 m -78.33 -34.37 48.6 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.464 -0.494 . . . . 110.90000000000001 111.743 170.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 461' ' ' THR . . . . . 0.582 HG22 ' HA ' ' A' ' 458' ' ' PRO . 5.6 t -72.89 -20.63 61.05 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 119.894 -0.722 . . . . 169.58000000000001 112.19 177.004 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 462' ' ' CYS . . . . . 0.452 ' HB2' HD21 ' A' ' 529' ' ' LEU . 14.6 t -55.25 133.98 69.23 Favored Pre-proline 0 C--O 1.242 0.687 0 CA-C-N 117.934 0.334 . . . . 140.03 111.405 -171.159 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.73 148.34 36.47 Favored 'Trans proline' 0 C--O 1.24 0.579 0 C-N-CA 120.59 0.86 . . . . 138.90000000000001 110.782 176.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 464' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.46 166.69 29.08 Favored 'Trans proline' 0 C--N 1.328 -0.507 0 CA-C-O 122.185 0.827 . . . . 137.09999999999999 110.952 177.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 18.5 mt -84.77 155.84 21.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.055 -0.975 . . . . 128.53999999999999 110.833 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 466' ' ' LYS . . . . . . . . . . . . . 1.6 tttp -66.16 -35.6 80.9 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 115.06 -0.973 . . . . 153.28999999999999 111.598 178.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -151.33 -153.25 6.12 Favored Glycine 0 N--CA 1.444 -0.803 0 N-CA-C 110.06 -1.216 . . . . 132.99000000000001 110.06 174.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 468' ' ' LYS . . . . . . . . . . . . . 7.3 tttt -103.66 129.65 51.0 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.831 -0.803 . . . . 134.61000000000001 108.831 175.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 469' ' ' VAL . . . . . 0.417 HG22 ' CE1' ' A' ' 535' ' ' HIS . 2.7 m -82.58 136.01 23.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 N-CA-C 109.143 -0.688 . . . . 114.56 109.143 -174.953 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 470' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -92.41 -41.76 10.14 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.202 -0.454 . . . . 139.87 112.064 -177.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 471' ' ' ARG . . . . . 0.529 ' HA ' ' HE1' ' A' ' 538' ' ' MET . 6.2 ttp180 -155.5 138.48 15.43 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.217 -0.66 . . . . 128.19 109.217 -177.235 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 71.4 mt -89.73 125.46 42.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 108.085 -1.08 . . . . 106.95 108.085 174.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 11.2 mt -99.52 -42.26 7.01 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 113.322 0.86 . . . . 147.34999999999999 113.322 -174.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 44.1 t-80 -159.91 160.31 33.39 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.164 -1.05 . . . . 144.53999999999999 108.164 -169.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 475' ' ' TRP . . . . . 0.505 ' CE3' ' HD3' ' A' ' 509' ' ' ARG . 15.7 p-90 -142.03 155.51 45.41 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.549 0.69 . . . . 149.90000000000001 110.341 174.344 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 476' ' ' ARG . . . . . 0.501 HH11 ' HB3' ' A' ' 476' ' ' ARG . 4.5 mtm105 -141.97 162.61 35.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 114.802 -1.09 . . . . 165.78999999999999 109.588 -169.846 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 477' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -91.98 159.84 15.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.74 0.781 . . . . 149.56999999999999 110.241 171.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 478' ' ' THR . . . . . 1.094 ' CG2' ' HG3' ' A' ' 508' ' ' GLU . 10.2 t -143.94 169.99 16.76 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.225 -0.898 . . . . 173.27000000000001 109.43 -171.407 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 56.1 mp0 -85.84 140.11 35.27 Favored Pre-proline 0 C--O 1.236 0.354 0 C-N-CA 115.245 -2.582 . . . . 203.61000000000001 110.508 -174.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -60.42 148.48 90.44 Favored 'Trans proline' 0 C--O 1.245 0.844 0 O-C-N 122.618 0.799 . . . . 201.59 110.775 -175.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.41 160.87 43.49 Favored 'Trans proline' 0 C--N 1.33 -0.41 0 CA-C-O 122.149 0.812 . . . . 181.21000000000001 111.584 179.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -83.87 128.65 62.32 Favored Pre-proline 0 C--O 1.236 0.39 0 CA-C-N 114.87 -1.059 . . . . 213.13 110.239 -175.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo . . . . . 0 C--N 1.341 0.175 0 C-N-CA 123.578 2.852 . . . . 199.88999999999999 112.383 176.853 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 506' ' ' ILE . . . . . . . . . . . . . 6.4 tp . . . . . 0 CA--C 1.536 0.428 0 N-CA-C 109.626 -0.509 . . . . 198.58000000000001 109.626 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 507' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -65.55 132.1 29.95 Favored 'Trans proline' 0 N--CA 1.473 0.281 0 O-C-N 122.379 0.673 . . . . 179.03999999999999 111.768 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 508' ' ' GLU . . . . . 1.094 ' HG3' ' CG2' ' A' ' 478' ' ' THR . 13.3 pt-20 -74.5 -161.6 0.13 Allowed 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 123.839 0.855 . . . . 209.22 110.396 174.733 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 509' ' ' ARG . . . . . 0.662 HH12 ' HB3' ' A' ' 548' ' ' MET . 7.8 ttm180 -154.83 139.94 17.46 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 119.756 -0.778 . . . . 168.62 110.779 179.529 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 510' ' ' GLU . . . . . 0.466 ' OE2' ' NH1' ' A' ' 476' ' ' ARG . 4.8 pt-20 -119.63 152.3 37.31 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.401 0.619 . . . . 160.97999999999999 110.264 175.992 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -123.41 138.89 54.5 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.052 -0.976 . . . . 116.06 109.453 -177.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 512' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -86.36 122.43 30.31 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 108.476 -0.935 . . . . 117.64 108.476 173.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 513' ' ' VAL . . . . . . . . . . . . . 25.0 m -120.85 147.92 24.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-O 121.645 0.736 . . . . 114.98 110.122 -170.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 20.7 tptp -98.91 123.62 43.3 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 107.311 -1.366 . . . . 105.33 107.311 165.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 515' ' ' TRP . . . . . 0.416 ' HE1' ' HB3' ' A' ' 524' ' ' SER . 70.5 m95 -86.13 140.18 30.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.89 0.376 . . . . 125.34999999999999 110.124 -176.733 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -69.59 129.03 38.53 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.842 -0.617 . . . . 108.72 109.964 178.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 94.5 -25.76 21.25 Favored Glycine 0 N--CA 1.442 -0.923 0 N-CA-C 115.095 0.798 . . . . 92.540000000000006 115.095 178.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 4.6 mt -110.48 152.46 26.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 118.152 0.976 . . . . 113.33 109.678 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 519' ' ' SER . . . . . 0.416 ' N ' HG21 ' A' ' 623' ' ' THR . 94.6 p -78.0 -175.33 3.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.996 0.903 . . . . 110.87 110.185 -171.839 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 520' ' ' TYR . . . . . 0.447 ' HE2' HD21 ' A' ' 617' ' ' LEU . 68.4 m-85 -72.21 -13.5 61.55 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 113.3 0.852 . . . . 125.25 113.3 -178.465 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -67.67 -15.51 63.68 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 118.757 0.708 . . . . 128.34999999999999 111.909 173.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 522' ' ' HIS . . . . . . . . . . . . . 30.2 m-70 -104.29 9.79 35.8 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 112.689 0.626 . . . . 117.62 112.689 -179.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 75.2 m -60.38 120.88 10.73 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 118.246 0.475 . . . . 109.44 110.287 176.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 524' ' ' SER . . . . . 0.416 ' HB3' ' HE1' ' A' ' 515' ' ' TRP . 28.8 t -118.71 -179.78 3.9 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.615 0.721 . . . . 143.38 109.923 -173.537 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 525' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -109.98 137.32 47.92 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.534 -0.757 . . . . 129.21000000000001 109.551 173.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 526' ' ' VAL . . . . . . . . . . . . . 11.4 m -129.15 159.25 41.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 N-CA-C 108.959 -0.756 . . . . 112.39 108.959 -179.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 527' ' ' LYS . . . . . . . . . . . . . 56.5 mttt -79.66 145.39 33.03 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.295 -0.866 . . . . 135.05000000000001 110.401 -178.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 528' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -53.31 -46.36 69.38 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.524 -0.762 . . . . 158.41 111.545 -176.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 529' ' ' LEU . . . . . 0.452 HD21 ' HB2' ' A' ' 462' ' ' CYS . 1.6 tt -70.45 -23.23 62.67 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 112.344 0.498 . . . . 122.62 112.344 -176.877 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -60.79 -47.61 85.55 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.188 -0.605 . . . . 122.56999999999999 110.806 169.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 531' ' ' LEU . . . . . . . . . . . . . 19.2 mt -60.37 -49.26 78.28 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.829 -0.348 . . . . 118.37 111.152 -179.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 532' ' ' GLU . . . . . 0.408 ' HB2' ' CE1' ' A' ' 539' ' ' TYR . 21.1 tt0 -60.08 -36.8 78.19 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.526 -0.47 . . . . 157.50999999999999 111.326 -179.565 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 533' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -74.48 -38.25 62.96 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.571 -0.451 . . . . 126.51000000000001 111.856 -176.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 534' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -113.14 -15.46 12.77 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 114.267 1.21 . . . . 135.97999999999999 114.267 -170.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 535' ' ' HIS . . . . . 0.417 ' CE1' HG22 ' A' ' 469' ' ' VAL . 91.4 m-70 -138.88 54.43 1.74 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 108.417 -0.957 . . . . 104.02 108.417 178.946 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 10.6 m -54.52 -65.97 0.48 Allowed 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.57 -0.741 . . . . 97.969999999999999 111.442 -173.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 537' ' ' VAL . . . . . 0.458 ' O ' ' ND2' ' A' ' 541' ' ' ASN . 2.3 p -53.14 -46.19 55.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 121.169 0.509 . . . . 136.83000000000001 110.565 -174.163 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 538' ' ' MET . . . . . 0.529 ' HE1' ' HA ' ' A' ' 471' ' ' ARG . 3.7 ttm -59.1 -42.75 91.23 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 121.922 -0.486 . . . . 116.45 111.373 174.749 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 539' ' ' TYR . . . . . 0.408 ' CE1' ' HB2' ' A' ' 532' ' ' GLU . 32.4 t80 -63.41 -51.06 67.36 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.712 0.292 . . . . 130.66999999999999 111.102 -179.022 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -67.73 -29.19 68.37 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.365 -0.534 . . . . 153.13 111.885 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 541' ' ' ASN . . . . . 0.458 ' ND2' ' O ' ' A' ' 537' ' ' VAL . 7.0 m-80 -62.31 -45.53 92.82 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.05 -0.66 . . . . 137.56 110.621 175.092 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 542' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -59.29 -45.53 91.03 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.755 -0.378 . . . . 132.77000000000001 110.609 173.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 543' ' ' GLN . . . . . 0.503 ' O ' ' HE1' ' A' ' 548' ' ' MET . 9.8 mt-30 -50.33 -50.79 49.94 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.122 0.487 . . . . 143.66 111.423 178.14 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 3.8 ttt-85 -60.9 -32.03 71.51 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.585 -0.446 . . . . 147.02000000000001 111.763 -175.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 545' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -82.16 -30.88 30.78 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 113.057 0.762 . . . . 160.08000000000001 113.057 -170.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -127.19 178.53 5.97 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.862 0.839 . . . . 173.19 110.765 -165.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -93.59 134.17 36.15 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 114.82 -1.082 . . . . 180.03 109.389 178.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 548' ' ' MET . . . . . 0.662 ' HB3' HH12 ' A' ' 509' ' ' ARG . 1.8 mpp? -112.48 15.99 19.98 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.997 -0.547 . . . . 178.78 112.467 -177.114 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -95.71 -43.97 7.66 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.143 0.577 . . . . 173.86000000000001 112.26 168.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -116.46 133.04 23.03 Favored Pre-proline 0 C--O 1.24 0.578 0 C-N-CA 125.062 1.345 . . . . 172.13 109.056 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -60.65 154.98 50.87 Favored 'Trans proline' 0 C--O 1.241 0.646 0 C-N-CA 120.531 0.821 . . . . 169.25999999999999 110.942 -179.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 552' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.7 155.78 67.68 Favored 'Trans proline' 0 C--O 1.241 0.633 0 C-N-CA 120.399 0.733 . . . . 142.56 110.531 176.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 553' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.48 154.63 68.6 Favored 'Trans proline' 0 C--N 1.329 -0.476 0 CA-C-O 121.708 0.628 . . . . 155.97 111.317 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 554' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -69.28 141.22 54.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.036 -0.984 . . . . 165.18000000000001 109.419 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 555' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -93.43 101.87 14.09 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 108.459 -0.941 . . . . 162.13 108.459 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 556' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -101.47 5.61 42.04 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 112.685 0.624 . . . . 170.34999999999999 112.685 173.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.255 0 CA-C-N 118.164 0.438 . . . . 186.22 113.179 -178.16 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 573' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo . . . . . 0 C--O 1.233 0.26 0 N-CA-C 112.67 0.219 . . . . 166.44999999999999 112.67 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 1.3 mp -90.47 16.46 8.85 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 112.45 0.537 . . . . 152.28 112.45 176.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -57.46 -49.26 76.82 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.799 -0.36 . . . . 150.31 111.223 -176.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 576' ' ' ALA . . . . . . . . . . . . . . . -49.6 -34.22 17.32 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 112.324 0.49 . . . . 142.75 112.324 -175.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 577' ' ' LYS . . . . . 0.566 ' NZ ' ' HB2' ' A' ' 581' ' ' ARG . 2.2 tptp -84.36 -43.45 14.72 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.621 -0.432 . . . . 154.96000000000001 109.913 175.466 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 578' ' ' MET . . . . . . . . . . . . . 25.5 mmt -56.15 -34.28 66.0 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 119.731 -0.787 . . . . 136.56 111.169 176.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 579' ' ' GLU . . . . . 0.654 ' HA ' ' HB2' ' A' ' 583' ' ' TYR . 34.2 tt0 -65.29 -32.4 74.04 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 120.322 -0.551 . . . . 172.88 111.022 171.963 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -69.94 -58.26 4.06 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.752 0.31 . . . . 153.31999999999999 111.44 -176.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 581' ' ' ARG . . . . . 0.566 ' HB2' ' NZ ' ' A' ' 577' ' ' LYS . 0.8 OUTLIER -71.4 -26.93 62.97 Favored 'General case' 0 C--O 1.237 0.434 0 O-C-N 121.853 -0.529 . . . . 166.06 112.4 -176.536 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 582' ' ' PHE . . . . . 0.416 ' CD2' ' HB3' ' A' ' 581' ' ' ARG . 84.5 m-85 -131.01 -64.88 0.8 Allowed 'General case' 0 C--O 1.234 0.287 0 C-N-CA 119.275 -0.97 . . . . 129.21000000000001 113.285 -164.696 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 583' ' ' TYR . . . . . 0.654 ' HB2' ' HA ' ' A' ' 579' ' ' GLU . 21.9 m-30 -59.67 -38.3 81.14 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 112.18 0.437 . . . . 125.14 112.18 -159.528 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 584' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -67.17 -27.43 67.28 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.289 -0.564 . . . . 152.94999999999999 111.928 -177.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 585' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -76.25 -12.24 60.05 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 113.242 0.83 . . . . 134.90000000000001 113.242 -177.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 586' ' ' GLY . . . . . . . . . . . . . . . 124.82 11.95 4.22 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.818 -0.706 . . . . 117.14 113.325 176.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 587' ' ' ILE . . . . . . . . . . . . . 81.5 mt -92.27 106.25 17.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 108.038 -1.097 . . . . 134.31 108.038 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 588' ' ' LYS . . . . . 0.478 ' HB3' ' CE2' ' A' ' 591' ' ' TRP . 7.2 tttp -59.74 126.64 83.55 Favored Pre-proline 0 C--O 1.239 0.552 0 N-CA-C 109.086 -0.709 . . . . 140.44999999999999 109.086 173.62 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 589' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.48 -19.46 51.92 Favored 'Trans proline' 0 N--CA 1.475 0.436 0 N-CA-C 114.757 1.022 . . . . 117.48 114.757 -167.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 590' ' ' GLU . . . . . 0.545 ' N ' ' OE1' ' A' ' 590' ' ' GLU . 16.8 mp0 -69.53 -27.08 64.85 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 118.983 0.811 . . . . 146.31 111.404 177.875 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 591' ' ' TRP . . . . . 0.806 ' CD1' HD13 ' A' ' 617' ' ' LEU . 28.1 m0 -66.02 -16.75 64.18 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.162 0.43 . . . . 108.8 112.162 -176.817 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 592' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -103.65 6.8 37.31 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 122.919 0.488 . . . . 116.7 112.307 177.197 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 593' ' ' MET . . . . . 0.443 ' HE3' ' HG3' ' A' ' 590' ' ' GLU . 6.0 mtm -101.58 139.91 36.59 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.065 0.546 . . . . 124.3 109.719 177.566 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 594' ' ' ILE . . . . . . . . . . . . . 84.9 mt -81.29 128.86 38.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 109.571 -0.529 . . . . 112.53 109.571 -178.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 595' ' ' HIS . . . . . 0.657 ' HB2' ' HG2' ' A' ' 615' ' ' LYS . 13.3 t-160 -94.89 -52.06 4.41 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.169 -0.469 . . . . 125.62 111.144 172.205 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 66.3 mtp180 -145.56 150.79 37.05 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.198 -0.667 . . . . 112.7 109.198 -177.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 40.8 mt -101.92 116.77 46.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 107.23 -1.396 . . . . 96.790000000000006 107.23 166.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 598' ' ' LEU . . . . . . . . . . . . . 49.6 mt -93.5 -38.86 11.18 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 113.056 0.762 . . . . 111.55 113.056 -170.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 599' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -160.43 171.81 18.38 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.568 -0.901 . . . . 120.88 108.568 -176.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 600' ' ' HIS . . . . . . . . . . . . . 48.1 p-80 -127.72 159.55 34.42 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.166 -0.924 . . . . 105.45 109.322 178.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 601' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -151.17 150.69 30.93 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.573 -0.74 . . . . 112.86 109.533 -179.497 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 602' ' ' PHE . . . . . 0.538 ' HE2' ' HB ' ' A' ' 608' ' ' VAL . 18.8 m-85 -117.81 133.65 55.72 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.268 -0.878 . . . . 112.56999999999999 109.126 176.956 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 28.5 p-10 -100.63 -170.16 1.82 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.511 0.672 . . . . 131.38999999999999 110.578 -175.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 604' ' ' LYS . . . . . . . . . . . . . 5.8 ptpt -52.65 -51.89 58.09 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 115.627 -0.715 . . . . 140.77000000000001 111.501 178.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 605' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -72.95 -32.07 65.0 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.19 -0.604 . . . . 164.65000000000001 111.432 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . 107.47 -5.87 35.71 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-O 118.617 -1.102 . . . . 131.63999999999999 115.621 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 607' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -59.52 124.12 19.04 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 119.105 1.453 . . . . 151.68000000000001 109.687 170.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 608' ' ' VAL . . . . . 0.538 ' HB ' ' HE2' ' A' ' 602' ' ' PHE . 12.1 p -72.75 141.19 16.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 C-N-CA 120.235 -0.586 . . . . 124.43000000000001 110.908 -174.028 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 609' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -114.19 144.72 42.73 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 108.467 -0.938 . . . . 107.55 108.467 171.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 610' ' ' TYR . . . . . 0.407 ' HB2' HD11 ' A' ' 612' ' ' ILE . 90.5 m-85 -116.42 140.5 49.28 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.723 -0.671 . . . . 116.0 109.309 175.516 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 4.0 tp -93.3 110.1 21.64 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.315 -0.994 . . . . 107.15000000000001 108.315 177.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 612' ' ' ILE . . . . . 0.487 ' N ' HD12 ' A' ' 612' ' ' ILE . 1.9 mp -103.47 132.46 49.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 109.689 -0.485 . . . . 115.20999999999999 109.689 -171.31 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 613' ' ' LYS . . . . . 0.569 ' NZ ' ' O ' ' A' ' 617' ' ' LEU . 8.0 tmtm? -87.48 125.13 34.12 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.067 -1.086 . . . . 116.09 108.067 165.424 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 614' ' ' TRP . . . . . 0.769 ' HE1' ' HB ' ' A' ' 623' ' ' THR . 83.9 m95 -97.11 146.34 25.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.413 0.625 . . . . 119.45999999999999 111.096 -175.478 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 615' ' ' LYS . . . . . 0.657 ' HG2' ' HB2' ' A' ' 595' ' ' HIS . 6.0 mttt -70.57 137.47 50.08 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.34 -0.845 . . . . 133.03 111.684 -173.476 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 616' ' ' ASP . . . . . 0.477 ' O ' HD12 ' A' ' 617' ' ' LEU . 16.5 t0 55.54 34.49 23.24 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.777 0.831 . . . . 153.28 111.113 -174.545 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 617' ' ' LEU . . . . . 0.806 HD13 ' CD1' ' A' ' 591' ' ' TRP . 1.9 mp -141.9 123.02 8.68 Favored Pre-proline 0 C--N 1.326 -0.444 0 N-CA-C 108.065 -1.087 . . . . 112.45 108.065 173.917 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 618' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -67.48 165.68 26.37 Favored 'Trans proline' 0 C--N 1.332 -0.294 0 CA-C-O 122.031 0.763 . . . . 108.31999999999999 112.401 -169.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 619' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -61.82 -31.56 71.81 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.878 -1.056 . . . . 136.87 112.077 -170.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 620' ' ' ASP . . . . . 0.566 ' N ' ' OD1' ' A' ' 620' ' ' ASP . 11.0 p-10 -52.63 -20.85 3.35 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 112.917 0.71 . . . . 164.46000000000001 112.917 176.277 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 621' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -114.22 29.79 7.76 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 122.949 0.499 . . . . 138.94999999999999 112.071 -179.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 622' ' ' CYS . . . . . . . . . . . . . 87.0 m -58.89 161.29 5.03 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.709 0.766 . . . . 106.18000000000001 109.206 165.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 623' ' ' THR . . . . . 0.769 ' HB ' ' HE1' ' A' ' 614' ' ' TRP . 5.2 m -143.02 134.84 26.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.666 -0.697 . . . . 123.55 110.076 -171.317 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 624' ' ' TRP . . . . . . . . . . . . . 87.3 m95 -77.26 115.87 17.41 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.082 -0.71 . . . . 93.780000000000001 109.082 169.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 625' ' ' GLU . . . . . 0.481 ' HB2' HD13 ' A' ' 612' ' ' ILE . 17.2 mm-40 -108.02 152.99 23.75 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.368 0.604 . . . . 126.20999999999999 111.191 -176.796 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 626' ' ' ILE . . . . . . . . . . . . . 6.0 tp -73.59 157.58 6.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 122.206 1.003 . . . . 140.69 110.038 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 627' ' ' ASP . . . . . 0.592 ' OD1' ' NZ ' ' A' ' 638' ' ' LYS . 44.6 t0 -67.7 -50.04 59.56 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.367 -0.833 . . . . 142.96000000000001 111.203 176.834 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -93.27 80.8 4.44 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 122.416 1.103 . . . . 181.25999999999999 109.626 -172.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 11.3 tt -149.54 134.02 9.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 107.076 -1.453 . . . . 112.19 107.076 170.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 630' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -89.39 75.69 7.63 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 122.493 1.139 . . . . 160.25999999999999 109.255 -172.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 631' ' ' ILE . . . . . 0.664 ' HB ' ' HB2' ' A' ' 634' ' ' TYR . 3.5 mm -71.37 141.43 85.73 Favored Pre-proline 0 C--O 1.245 0.823 0 CA-C-N 114.853 -1.067 . . . . 135.31 108.276 164.691 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 632' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -50.74 131.9 35.02 Favored 'Trans proline' 0 C--N 1.33 -0.434 0 CA-C-N 119.696 0.927 . . . . 105.47 110.038 165.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 633' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 76.62 -13.47 0.92 Allowed 'General case' 0 C--O 1.232 0.167 0 C-N-CA 125.732 1.613 . . . . 159.99000000000001 113.326 174.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 634' ' ' TYR . . . . . 0.664 ' HB2' ' HB ' ' A' ' 631' ' ' ILE . 1.1 t80 -42.72 -61.8 1.16 Allowed 'General case' 0 C--O 1.236 0.345 0 N-CA-C 114.152 1.167 . . . . 122.73 114.152 -163.148 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 635' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -67.07 -21.76 65.87 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.063 -1.055 . . . . 158.03 112.589 -175.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 636' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -65.3 -40.6 94.02 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 119.954 -0.699 . . . . 153.75999999999999 110.77 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 637' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -73.78 -28.74 61.81 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.411 -0.516 . . . . 134.94 112.028 174.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 638' ' ' LYS . . . . . 0.592 ' NZ ' ' OD1' ' A' ' 627' ' ' ASP . 36.2 mttt -59.4 -43.77 92.94 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.424 -0.51 . . . . 113.72 111.248 172.43 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 639' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -67.94 -37.74 81.99 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.875 -0.73 . . . . 162.88 111.094 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -59.03 -46.54 87.96 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.527 -0.469 . . . . 106.08 110.84 175.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 641' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -59.93 -43.46 94.93 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.576 -0.284 . . . . 104.3 111.403 -179.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 642' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -84.66 -27.38 27.15 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.295 0.48 . . . . 106.43000000000001 112.295 -175.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 643' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.306 0 N-CA-C 114.746 0.658 . . . . 133.59 114.746 -174.201 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 413' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.344 0 N-CA-C 112.406 0.521 . . . . 184.80000000000001 112.406 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 414' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.31 -155.68 0.39 Allowed 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 109.557 -0.535 . . . . 199.94999999999999 109.557 -175.847 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 415' ' ' HIS . . . . . 0.665 ' CD2' ' HB3' ' B' ' 430' ' ' CYS . 2.4 m80 -87.19 152.41 22.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.212 0.53 . . . . 138.03 110.824 -178.231 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 416' ' ' MET . . . . . 0.48 ' HE1' ' CG ' ' B' ' 420' ' ' ARG . 3.3 mtm -73.21 131.63 42.23 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.73 -0.668 . . . . 135.33000000000001 110.904 179.881 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 417' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -89.99 14.53 12.01 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.575 0.583 . . . . 139.75 112.575 173.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 418' ' ' PHE . . . . . . . . . . . . . 11.4 p90 -132.1 163.26 28.86 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.451 0.643 . . . . 132.31 109.336 173.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 419' ' ' CYS . . . . . . . . . . . . . 23.3 t -81.54 145.23 30.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.435 -0.802 . . . . 119.75 110.533 -179.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 420' ' ' ARG . . . . . 0.48 ' CG ' ' HE1' ' B' ' 416' ' ' MET . 0.3 OUTLIER -74.76 -8.0 55.07 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.38 0.881 . . . . 133.18000000000001 113.38 -179.006 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 421' ' ' VAL . . . . . . . . . . . . . 51.7 t -113.81 -45.9 4.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 118.504 0.593 . . . . 157.75999999999999 111.405 -172.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 422' ' ' CYS . . . . . 0.406 ' SG ' ' ND1' ' B' ' 439' ' ' HIS . 16.1 p -106.34 -9.38 16.8 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 113.529 0.937 . . . . 119.76000000000001 113.529 179.327 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 423' ' ' LYS . . . . . 0.404 ' HE3' ' O ' ' B' ' 420' ' ' ARG . 6.9 mmtm 58.51 38.53 25.46 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.735 0.814 . . . . 125.47 111.927 177.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 424' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -120.51 165.53 14.86 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.608 0.718 . . . . 166.78999999999999 109.85 175.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 425' ' ' GLY . . . . . . . . . . . . . . . -96.85 -168.15 33.52 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-O 122.192 0.885 . . . . 156.24000000000001 112.589 178.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 426' ' ' GLY . . . . . . . . . . . . . . . 125.59 -137.72 10.45 Favored Glycine 0 C--N 1.332 0.314 0 CA-C-N 114.936 -0.632 . . . . 189.13999999999999 113.233 178.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 427' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -79.29 139.34 37.88 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.85 -0.796 . . . . 204.16999999999999 108.85 163.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 428' ' ' LEU . . . . . . . . . . . . . 5.6 mp -149.69 142.2 24.4 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 120.315 -0.554 . . . . 144.81 109.998 -179.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 429' ' ' LEU . . . . . . . . . . . . . 25.9 tp -97.35 120.97 38.7 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 108.572 -0.899 . . . . 119.77 108.572 176.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 430' ' ' CYS . . . . . 0.665 ' HB3' ' CD2' ' B' ' 415' ' ' HIS . 34.6 m -101.64 133.75 45.86 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 122.668 0.387 . . . . 118.51000000000001 110.645 -172.023 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 431' ' ' CYS . . . . . 0.528 ' HB2' ' HB3' ' B' ' 457' ' ' CYS . 45.9 t -64.09 148.1 50.64 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.515 0.674 . . . . 141.16999999999999 110.727 178.314 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 432' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -89.69 -17.34 28.52 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.474 -0.784 . . . . 134.66 112.977 -176.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 433' ' ' ALA . . . . . . . . . . . . . . . -105.28 -16.14 14.85 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 113.285 0.846 . . . . 142.72999999999999 113.285 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 434' ' ' CYS . . . . . 0.902 ' HG ' 'ZN ' ' B' ' 702' ' ' ' ZN' . 13.9 p -147.15 162.25 33.45 Favored Pre-proline 0 C--O 1.237 0.405 0 N-CA-C 108.567 -0.901 . . . . 150.28999999999999 108.567 -174.784 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 435' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -75.86 15.96 0.85 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 N-CA-C 115.11 1.158 . . . . 114.22 115.11 -173.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 436' ' ' SER . . . . . 0.479 ' HB3' ' CE1' ' B' ' 438' ' ' TYR . 67.6 m -72.94 152.22 41.51 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.784 0.802 . . . . 122.45 111.179 -177.037 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 437' ' ' SER . . . . . . . . . . . . . 2.6 m -150.1 131.43 14.63 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 107.818 -1.178 . . . . 129.61000000000001 107.818 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 438' ' ' TYR . . . . . 0.547 ' CE1' ' HB2' ' B' ' 457' ' ' CYS . 1.4 m-85 -131.19 153.92 48.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.2 0.524 . . . . 148.65000000000001 110.21 -173.66 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 439' ' ' HIS . . . . . 0.406 ' ND1' ' SG ' ' B' ' 422' ' ' CYS . 51.6 m170 -79.71 134.91 36.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.416 -0.811 . . . . 162.34999999999999 109.067 165.662 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 440' ' ' LEU . . . . . 0.502 HD23 ' HA ' ' B' ' 449' ' ' GLU . 10.6 mp -58.49 -40.73 83.61 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 115.939 -0.573 . . . . 156.38 111.425 -173.694 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 441' ' ' HIS . . . . . . . . . . . . . 43.1 p-80 -70.82 -15.69 62.67 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.168 0.433 . . . . 187.87 112.168 175.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 9.8 m -90.82 5.14 49.61 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 113.114 0.783 . . . . 148.34999999999999 113.114 -179.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 443' ' ' LEU . . . . . . . . . . . . . 9.9 mp -84.48 172.2 11.9 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 122.003 0.906 . . . . 133.91999999999999 110.281 173.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 444' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -146.57 101.38 4.01 Favored Pre-proline 0 C--O 1.242 0.702 0 N-CA-C 108.038 -1.097 . . . . 128.41 108.038 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 445' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -79.41 149.88 83.57 Favored 'Cis proline' 0 C--N 1.343 0.286 0 C-N-CA 123.842 -1.316 . . . . 119.06 113.138 4.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 446' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -61.32 141.96 94.43 Favored 'Trans proline' 0 C--N 1.333 -0.242 0 O-C-N 123.546 1.288 . . . . 144.91 110.699 176.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 447' ' ' LEU . . . . . . . . . . . . . 17.7 mt -89.82 156.99 46.86 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-N 115.599 -0.728 . . . . 131.53999999999999 110.465 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 448' ' ' PRO . . . . . 0.479 ' HB2' ' OE2' ' B' ' 449' ' ' GLU . 22.8 Cg_exo -69.65 -48.61 0.7 Allowed 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 119.762 0.308 . . . . 157.36000000000001 111.704 178.772 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 449' ' ' GLU . . . . . 0.502 ' HA ' HD23 ' B' ' 440' ' ' LEU . 3.9 pm0 -170.56 -176.99 2.25 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.937 -1.134 . . . . 192.06 107.937 172.615 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 450' ' ' ILE . . . . . . . . . . . . . 3.7 mp -52.23 121.27 19.8 Favored Pre-proline 0 C--O 1.24 0.587 0 C-N-CA 124.16 0.984 . . . . 142.88999999999999 111.692 -169.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 451' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -72.24 157.7 53.23 Favored 'Trans proline' 0 C--N 1.331 -0.355 0 CA-C-O 122.085 0.785 . . . . 175.62 111.683 178.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 452' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.55 -65.11 0.73 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 114.796 -1.093 . . . . 186.43000000000001 112.021 -175.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 453' ' ' GLY . . . . . . . . . . . . . . . -78.3 -158.72 11.88 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-O 122.028 0.793 . . . . 164.41999999999999 112.779 -175.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 454' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -71.91 139.54 48.8 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.059 -0.57 . . . . 164.12 110.431 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 455' ' ' TRP . . . . . . . . . . . . . 66.7 t90 -122.01 131.56 54.06 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 108.408 -0.96 . . . . 143.53999999999999 108.408 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 456' ' ' LEU . . . . . . . . . . . . . 3.0 mp -114.75 135.66 53.93 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.269 -0.641 . . . . 135.30000000000001 109.269 178.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 457' ' ' CYS . . . . . 0.547 ' HB2' ' CE1' ' B' ' 438' ' ' TYR . 12.2 p -69.47 158.81 85.9 Favored Pre-proline 0 N--CA 1.45 -0.471 0 CA-C-N 115.86 -0.609 . . . . 121.34999999999999 111.046 -170.449 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 458' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -51.69 -29.46 33.37 Favored 'Trans proline' 0 C--O 1.237 0.464 0 N-CA-C 114.312 0.851 . . . . 130.56999999999999 114.312 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 459' ' ' ARG . . . . . . . . . . . . . 68.0 mtp85 -64.76 -38.38 90.81 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 118.645 0.657 . . . . 116.53 111.232 173.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 460' ' ' CYS . . . . . . . . . . . . . 83.5 m -77.82 -31.62 51.78 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 112.106 0.41 . . . . 102.76000000000001 112.106 176.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 461' ' ' THR . . . . . 0.466 HG23 ' O ' ' B' ' 457' ' ' CYS . 5.0 p -74.2 -28.86 61.47 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.341 -0.544 . . . . 130.78999999999999 111.696 177.142 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 462' ' ' CYS . . . . . . . . . . . . . 47.6 t -52.47 119.24 14.71 Favored Pre-proline 0 C--O 1.241 0.626 0 C-N-CA 123.268 0.627 . . . . 129.94999999999999 110.653 -172.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 463' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -68.46 154.21 72.27 Favored 'Trans proline' 0 C--O 1.245 0.826 0 N-CA-C 110.624 -0.568 . . . . 118.09999999999999 110.624 -177.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 464' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.19 163.95 36.66 Favored 'Trans proline' 0 C--N 1.33 -0.397 0 CA-C-O 122.023 0.76 . . . . 114.67 111.287 176.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 465' ' ' LEU . . . . . . . . . . . . . 19.2 mt -87.36 145.8 26.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.945 -1.025 . . . . 106.17 110.251 177.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 466' ' ' LYS . . . . . . . . . . . . . 13.7 pttp -67.23 -27.15 66.99 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.608 -0.723 . . . . 143.47999999999999 111.854 -178.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 467' ' ' GLY . . . . . . . . . . . . . . . -145.57 -168.38 13.06 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 117.882 0.31 . . . . 107.93000000000001 113.681 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 468' ' ' LYS . . . . . . . . . . . . . 4.3 mtpp -100.9 122.87 44.21 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 108.542 -0.911 . . . . 133.99000000000001 108.542 176.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 469' ' ' VAL . . . . . 0.431 HG12 ' CE1' ' B' ' 535' ' ' HIS . 2.2 p -78.96 132.52 32.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 109.211 -0.663 . . . . 98.840000000000003 109.211 178.496 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 470' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -92.04 -33.27 14.87 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 112.494 0.553 . . . . 119.91 112.494 178.944 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 471' ' ' ARG . . . . . 0.507 ' NH1' ' OH ' ' B' ' 520' ' ' TYR . 4.4 ttp-105 -153.7 141.42 20.0 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 109.742 -0.466 . . . . 105.14 109.742 -176.787 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 472' ' ' ILE . . . . . 0.488 ' HB ' ' CD2' ' B' ' 542' ' ' TYR . 2.5 mt -91.26 127.74 43.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 108.51 -0.922 . . . . 108.64 108.51 171.321 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 473' ' ' LEU . . . . . . . . . . . . . 10.3 mp -100.5 -42.29 6.64 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.084 0.772 . . . . 98.25 113.084 -173.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 474' ' ' HIS . . . . . . . . . . . . . 29.8 t-80 -164.1 163.24 23.18 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.274 -1.01 . . . . 130.25 108.274 -171.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 33.0 p-90 -146.71 145.52 30.01 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.57 -0.741 . . . . 131.69999999999999 109.334 175.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 33.4 ptt180 -140.18 163.71 32.01 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.383 -0.826 . . . . 117.36 109.142 179.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 477' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -82.29 155.54 24.77 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.395 -0.82 . . . . 119.88 110.51 176.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 478' ' ' THR . . . . . . . . . . . . . 3.1 t -137.9 170.94 15.17 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.371 -0.831 . . . . 145.53 109.204 176.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -61.47 150.92 79.21 Favored Pre-proline 0 C--O 1.236 0.345 0 CA-C-N 115.219 -0.9 . . . . 194.5 110.368 -177.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 480' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -71.16 148.09 55.35 Favored 'Trans proline' 0 C--O 1.245 0.828 0 N-CA-C 110.353 -0.672 . . . . 156.09999999999999 110.353 170.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 481' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -65.49 159.77 46.18 Favored 'Trans proline' 0 C--N 1.33 -0.401 0 CA-C-O 122.1 0.792 . . . . 156.58000000000001 111.729 178.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 482' ' ' ALA . . . . . . . . . . . . . . . -82.83 131.68 53.67 Favored Pre-proline 0 C--O 1.235 0.322 0 CA-C-N 114.908 -1.042 . . . . 189.00999999999999 110.336 -175.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 483' ' ' PRO . . . . . 0.427 ' HG3' ' HA ' ' B' ' 504' ' ' GLU . 24.1 Cg_exo . . . . . 0 C--N 1.341 0.172 0 C-N-CA 123.674 2.916 . . . . 174.06 112.427 178.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 503' ' ' LEU . . . . . . . . . . . . . 8.6 tp . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.772 0.32 . . . . 170.96000000000001 110.557 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 504' ' ' GLU . . . . . 0.427 ' HA ' ' HG3' ' B' ' 483' ' ' PRO . 16.3 mt-10 -79.52 179.8 7.27 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.907 0.861 . . . . 206.34999999999999 110.833 -172.65 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 505' ' ' GLY . . . . . . . . . . . . . . . -124.35 177.04 16.89 Favored Glycine 0 N--CA 1.444 -0.8 0 CA-C-O 122.151 0.862 . . . . 172.09999999999999 113.333 -173.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 506' ' ' ILE . . . . . . . . . . . . . 4.1 tp -87.39 144.89 36.45 Favored Pre-proline 0 C--O 1.24 0.595 0 N-CA-C 108.104 -1.072 . . . . 141.47999999999999 108.104 -176.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 507' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -66.96 137.77 45.82 Favored 'Trans proline' 0 C--O 1.234 0.291 0 CA-C-N 119.389 0.817 . . . . 134.63999999999999 111.831 177.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 508' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -96.38 172.75 7.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.331 -0.849 . . . . 151.22 110.266 176.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 509' ' ' ARG . . . . . . . . . . . . . 6.9 ptp85 -127.9 140.78 51.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.419 -0.81 . . . . 128.16 109.75 -179.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -118.38 149.22 41.57 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.062 -0.517 . . . . 133.36000000000001 109.65 177.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 511' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -111.02 138.26 47.65 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.04 -0.527 . . . . 106.2 110.884 -173.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -84.44 122.98 29.73 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.44 -0.948 . . . . 109.61 108.44 173.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 513' ' ' VAL . . . . . . . . . . . . . 22.0 m -119.4 155.43 21.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 121.5 0.667 . . . . 116.52 109.988 -171.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 514' ' ' LYS . . . . . 0.521 ' HG3' ' CE1' ' B' ' 520' ' ' TYR . 12.4 tmtt? -105.38 119.48 39.19 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 107.762 -1.199 . . . . 114.7 107.762 165.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 515' ' ' TRP . . . . . . . . . . . . . 90.0 m95 -76.14 133.94 40.09 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.221 -0.592 . . . . 103.69 109.8 -178.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 516' ' ' ALA . . . . . . . . . . . . . . . -65.33 142.16 58.34 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.026 -0.67 . . . . 108.31999999999999 109.571 174.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 517' ' ' GLY . . . . . . . . . . . . . . . 75.79 -19.71 2.57 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 115.052 0.781 . . . . 91.25 115.052 -178.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 518' ' ' LEU . . . . . . . . . . . . . 21.4 mt -103.75 154.1 19.94 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.277 1.038 . . . . 99.340000000000003 109.648 173.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 519' ' ' SER . . . . . . . . . . . . . 13.2 p -73.36 -173.98 1.51 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.891 0.853 . . . . 102.72 110.361 -177.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 520' ' ' TYR . . . . . 0.521 ' CE1' ' HG3' ' B' ' 514' ' ' LYS . 41.7 m-85 -78.65 -9.33 59.35 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.812 0.671 . . . . 102.13 112.812 176.0 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 521' ' ' TRP . . . . . . . . . . . . . 90.0 m95 -68.89 -29.59 67.9 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 119.327 -0.949 . . . . 102.81 111.178 174.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 522' ' ' HIS . . . . . 0.531 ' NE2' ' OE1' ' B' ' 625' ' ' GLU . 90.6 m-70 -88.86 0.92 56.13 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.038 0.755 . . . . 110.23 113.038 -178.178 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 523' ' ' CYS . . . . . . . . . . . . . 71.7 m -50.34 122.62 7.21 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 118.451 0.568 . . . . 88.819999999999993 110.886 172.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 524' ' ' SER . . . . . . . . . . . . . 20.2 p -134.01 -178.74 5.16 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.36 -0.837 . . . . 89.890000000000001 108.919 -175.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 525' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -102.47 145.87 28.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.728 -0.669 . . . . 113.65000000000001 110.387 179.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 526' ' ' VAL . . . . . . . . . . . . . 33.5 m -137.63 153.82 28.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 121.641 0.734 . . . . 90.370000000000005 109.216 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -73.06 144.65 47.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.119 -0.946 . . . . 125.94 110.619 -179.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 528' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -58.87 -43.77 90.96 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 115.624 -0.716 . . . . 125.73999999999999 111.185 -177.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 529' ' ' LEU . . . . . . . . . . . . . 34.2 tp -57.41 -37.36 72.63 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.709 -0.397 . . . . 103.81999999999999 111.203 178.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -58.65 -41.32 85.8 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.473 -0.491 . . . . 120.45999999999999 111.128 175.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 531' ' ' LEU . . . . . . . . . . . . . 11.9 mt -65.79 -45.0 84.05 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.682 -0.407 . . . . 98.310000000000002 111.183 179.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -64.55 -35.61 81.53 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 120.387 -0.525 . . . . 138.43000000000001 111.587 -176.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 533' ' ' LEU . . . . . . . . . . . . . 22.9 mt -76.77 -48.09 19.71 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 119.94 -0.704 . . . . 108.05 111.752 -176.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 534' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -103.07 -9.8 19.43 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 114.053 1.131 . . . . 119.56 114.053 -170.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 535' ' ' HIS . . . . . 0.431 ' CE1' HG12 ' B' ' 469' ' ' VAL . 70.9 m80 -142.9 57.26 1.41 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 122.08 0.943 . . . . 100.81999999999999 109.262 178.054 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 536' ' ' THR . . . . . . . . . . . . . 3.1 m -59.77 -49.77 76.42 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.003 -0.544 . . . . 115.98 111.592 -173.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 537' ' ' VAL . . . . . . . . . . . . . 8.1 p -64.42 -40.87 90.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 C-N-CA 119.891 -0.724 . . . . 141.47 110.656 -172.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 538' ' ' MET . . . . . . . . . . . . . 24.4 ttm -67.31 -34.38 77.26 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.044 -0.663 . . . . 126.28 111.168 175.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 539' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -68.28 -51.33 46.18 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 120.643 0.258 . . . . 139.90000000000001 111.2 179.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 540' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -62.57 -38.22 89.24 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.593 -0.443 . . . . 151.40000000000001 111.402 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 541' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -57.66 -50.59 72.66 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.584 -0.447 . . . . 117.69 110.992 175.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 542' ' ' TYR . . . . . 0.488 ' CD2' ' HB ' ' B' ' 472' ' ' ILE . 1.9 t80 -57.28 -53.41 58.39 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.115 0.484 . . . . 114.37 110.879 176.612 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 543' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -48.31 -41.64 28.78 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 112.469 0.544 . . . . 141.56999999999999 112.469 -177.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 544' ' ' ARG . . . . . . . . . . . . . 2.7 ttp-105 -74.73 -30.71 61.6 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.53 -0.468 . . . . 176.59999999999999 110.376 -177.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 545' ' ' LYS . . . . . . . . . . . . . 15.8 mttt -70.8 -31.19 67.86 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.591 -0.844 . . . . 149.44 112.117 -172.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 546' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -147.25 155.91 42.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 118.649 0.659 . . . . 137.94999999999999 110.135 178.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 547' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -75.08 153.58 38.28 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.632 -0.713 . . . . 183.33000000000001 111.074 -173.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 548' ' ' MET . . . . . . . . . . . . . 64.6 mmm -115.14 20.61 14.85 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.38 -0.827 . . . . 128.91999999999999 112.951 -169.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 549' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -88.69 -48.79 7.27 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 117.834 0.288 . . . . 164.75 111.139 170.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 550' ' ' GLU . . . . . . . . . . . . . 52.1 tt0 -107.76 127.2 28.17 Favored Pre-proline 0 N--CA 1.45 -0.469 0 C-N-CA 125.524 1.53 . . . . 174.16 109.261 -178.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 551' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -61.24 152.91 68.84 Favored 'Trans proline' 0 C--O 1.248 0.987 0 CA-C-N 119.009 0.682 . . . . 137.87 110.769 178.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -69.53 153.88 69.38 Favored 'Trans proline' 0 C--O 1.244 0.784 0 N-CA-C 110.686 -0.544 . . . . 129.49000000000001 110.686 -178.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 553' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -68.23 160.1 50.34 Favored 'Trans proline' 0 C--N 1.33 -0.406 0 CA-C-O 122.165 0.819 . . . . 133.58000000000001 111.281 -179.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -75.68 139.71 42.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.802 -1.09 . . . . 168.13999999999999 109.63 179.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 555' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -87.07 70.16 10.22 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 122.586 1.184 . . . . 164.63 109.286 176.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 556' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 114.596 -1.184 . . . . 184.97 109.99 173.603 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 571' ' ' LYS . . . . . 0.424 ' HB2' ' HE2' ' B' ' 571' ' ' LYS . 1.6 mppt? . . . . . 0 C--O 1.232 0.17 0 CA-C-O 121.005 0.431 . . . . 193.83000000000001 110.808 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 572' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -79.36 170.99 13.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.711 -0.677 . . . . 185.15000000000001 109.49 176.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 573' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -60.76 -38.46 70.71 Favored 'Trans proline' 0 C--O 1.236 0.379 0 N-CA-C 113.798 0.653 . . . . 167.87 113.798 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 574' ' ' LEU . . . . . 0.409 ' HA ' ' NZ ' ' B' ' 577' ' ' LYS . 37.5 tp -60.18 -41.52 93.09 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.016 -0.673 . . . . 156.71000000000001 111.229 179.971 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 575' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -69.12 -33.07 72.88 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.308 -0.557 . . . . 126.55 111.541 173.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -63.05 -51.42 66.81 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.67 -0.412 . . . . 118.56999999999999 111.275 -175.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 577' ' ' LYS . . . . . 0.409 ' NZ ' ' HA ' ' B' ' 574' ' ' LEU . 3.6 pttp -70.57 -31.43 68.46 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 119.179 -1.008 . . . . 156.19999999999999 111.329 177.951 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 578' ' ' MET . . . . . . . . . . . . . 10.0 tpp -63.55 -42.28 98.38 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.232 -0.587 . . . . 133.74000000000001 110.986 173.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 579' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -61.4 -44.66 96.76 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.641 -0.824 . . . . 141.91 110.565 172.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 580' ' ' GLU . . . . . 0.654 ' HA ' ' HD3' ' B' ' 584' ' ' ARG . 10.9 tt0 -64.17 -36.04 82.74 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.618 -0.433 . . . . 148.58000000000001 111.458 -179.164 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 581' ' ' ARG . . . . . . . . . . . . . 6.9 mtp180 -79.88 -35.45 38.07 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.049 -0.66 . . . . 143.38 112.198 -174.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 582' ' ' PHE . . . . . 0.422 ' HB3' HD12 ' B' ' 587' ' ' ILE . 73.2 m-85 -132.77 -62.74 0.8 Allowed 'General case' 0 C--O 1.237 0.438 0 N-CA-C 113.704 1.001 . . . . 116.16 113.704 -169.26 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 583' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -52.47 -37.36 56.92 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.438 0.533 . . . . 112.89 112.438 -163.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 584' ' ' ARG . . . . . 0.654 ' HD3' ' HA ' ' B' ' 580' ' ' GLU . 1.7 ptm180 -62.59 -31.04 71.79 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 119.936 -0.706 . . . . 149.46000000000001 111.979 -173.423 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 585' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -82.67 2.98 30.86 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.85 0.685 . . . . 118.86 112.85 -178.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 586' ' ' GLY . . . . . . . . . . . . . . . 110.29 29.28 3.76 Favored Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 114.508 0.563 . . . . 109.06999999999999 114.508 172.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 587' ' ' ILE . . . . . 0.422 HD12 ' HB3' ' B' ' 582' ' ' PHE . 58.8 mt -102.79 110.86 30.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 107.913 -1.143 . . . . 102.04000000000001 107.913 176.633 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 588' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -58.08 124.7 71.42 Favored Pre-proline 0 C--O 1.241 0.65 0 N-CA-C 108.827 -0.805 . . . . 113.09 108.827 173.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 589' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -56.1 -27.75 66.56 Favored 'Trans proline' 0 C--O 1.238 0.497 0 N-CA-C 114.119 0.776 . . . . 108.56 114.119 -173.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 590' ' ' GLU . . . . . 0.51 ' HA ' ' HG3' ' B' ' 593' ' ' MET . 45.0 mp0 -62.76 -29.0 70.37 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 118.164 0.438 . . . . 99.879999999999995 111.763 178.539 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 591' ' ' TRP . . . . . . . . . . . . . 52.0 m0 -66.71 -18.66 65.49 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.545 0.572 . . . . 89.5 112.545 -176.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 592' ' ' MET . . . . . . . . . . . . . 6.3 mtp -101.03 0.68 38.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.151 0.432 . . . . 94.890000000000001 112.134 175.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 593' ' ' MET . . . . . 0.51 ' HG3' ' HA ' ' B' ' 590' ' ' GLU . 5.8 mtt -85.72 129.09 34.92 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 109.276 -0.638 . . . . 102.14 109.276 174.286 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 594' ' ' ILE . . . . . . . . . . . . . 14.7 mt -69.19 126.84 30.05 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 109.442 -0.577 . . . . 108.86 109.442 175.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 595' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -94.66 -50.54 5.13 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.342 -0.39 . . . . 96.269999999999996 111.155 172.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 69.3 mtp180 -145.5 147.4 32.11 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.666 -0.864 . . . . 146.81999999999999 108.666 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 597' ' ' ILE . . . . . . . . . . . . . 14.3 mt -100.48 117.66 46.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 106.595 -1.631 . . . . 99.609999999999999 106.595 164.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 598' ' ' LEU . . . . . . . . . . . . . 16.4 mt -92.26 -47.06 7.4 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.131 0.419 . . . . 93.450000000000003 112.131 -171.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 599' ' ' ASN . . . . . 0.548 ' ND2' ' O ' ' B' ' 600' ' ' HIS . 3.9 t30 -158.97 159.24 34.63 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.531 0.681 . . . . 155.06999999999999 109.477 176.239 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 600' ' ' HIS . . . . . 0.548 ' O ' ' ND2' ' B' ' 599' ' ' ASN . 42.2 p-80 -102.4 167.11 10.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.87 -1.059 . . . . 107.11 110.052 175.239 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 601' ' ' SER . . . . . . . . . . . . . 33.5 t -147.3 123.28 10.71 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.043 -1.095 . . . . 103.31999999999999 108.043 173.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 602' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -89.4 99.79 12.71 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 107.862 -1.162 . . . . 121.45 107.862 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 603' ' ' ASP . . . . . 0.461 ' OD2' ' N ' ' B' ' 604' ' ' LYS . 46.5 t0 -52.51 146.14 10.39 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.477 0.656 . . . . 175.88 110.483 178.026 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 604' ' ' LYS . . . . . 0.461 ' N ' ' OD2' ' B' ' 603' ' ' ASP . 20.8 mmtt -64.87 -25.88 68.09 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.625 -0.716 . . . . 159.59999999999999 111.411 178.221 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 605' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -66.94 -27.25 67.32 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.51 -0.476 . . . . 154.81999999999999 111.619 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 606' ' ' GLY . . . . . . . . . . . . . . . 122.64 -0.32 10.16 Favored Glycine 0 C--O 1.238 0.391 0 CA-C-O 119.031 -0.872 . . . . 135.28999999999999 114.597 -177.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 607' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -91.81 157.49 16.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 119.32 1.56 . . . . 139.41999999999999 110.062 177.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 608' ' ' VAL . . . . . 0.431 HG13 ' HB2' ' B' ' 627' ' ' ASP . 5.4 p -113.88 133.27 60.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 N-CA-C 108.357 -0.979 . . . . 110.92 108.357 175.473 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 609' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -116.0 152.2 33.99 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.573 -0.899 . . . . 109.26000000000001 108.573 173.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 610' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -120.94 122.74 40.83 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.454 -0.943 . . . . 93.980000000000004 108.454 178.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 611' ' ' LEU . . . . . . . . . . . . . 9.9 tp -78.1 111.61 14.19 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.392 -1.336 . . . . 98.849999999999994 107.392 172.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 612' ' ' ILE . . . . . 0.882 HD11 ' CE2' ' B' ' 614' ' ' TRP . 2.2 pp -107.06 165.8 4.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.04 -0.726 . . . . 120.38 109.04 -175.252 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 613' ' ' LYS . . . . . . . . . . . . . 9.2 tptp -115.5 128.54 56.07 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 107.847 -1.168 . . . . 101.09999999999999 107.847 169.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 614' ' ' TRP . . . . . 0.882 ' CE2' HD11 ' B' ' 612' ' ' ILE . 86.3 m95 -89.16 150.21 22.8 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.383 0.611 . . . . 112.34 110.557 -177.321 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 615' ' ' LYS . . . . . . . . . . . . . 18.3 mttt -68.98 137.99 54.17 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.535 -0.757 . . . . 113.93000000000001 110.344 177.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 616' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 59.35 28.23 17.52 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.553 0.741 . . . . 137.06999999999999 111.993 178.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 617' ' ' LEU . . . . . . . . . . . . . 19.7 mt -134.09 130.94 20.57 Favored Pre-proline 0 C--O 1.243 0.739 0 N-CA-C 105.869 -1.901 . . . . 99.150000000000006 105.869 175.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 618' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -67.61 172.16 10.86 Favored 'Trans proline' 0 C--N 1.328 -0.525 0 CA-C-O 122.254 0.856 . . . . 79.75 111.592 -174.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 619' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -68.31 -36.84 79.91 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 114.815 -1.084 . . . . 124.02 111.712 -173.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 620' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' B' ' 620' ' ' ASP . 9.6 p-10 -59.3 -16.56 22.68 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 119.912 -0.715 . . . . 133.5 111.944 176.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 621' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -97.13 13.66 28.47 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 123.45 0.7 . . . . 156.38 112.595 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 622' ' ' CYS . . . . . . . . . . . . . 84.3 m -65.31 145.13 56.6 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.266 0.555 . . . . 88.590000000000003 110.154 172.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 623' ' ' THR . . . . . . . . . . . . . 2.0 p -132.14 156.15 46.89 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.574 0.702 . . . . 83.150000000000006 109.945 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 624' ' ' TRP . . . . . . . . . . . . . 86.6 m95 -82.18 129.35 34.81 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.121 -0.945 . . . . 93.439999999999998 109.207 170.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 625' ' ' GLU . . . . . 0.531 ' OE1' ' NE2' ' B' ' 522' ' ' HIS . 3.2 tp10 -117.18 146.19 43.38 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.315 0.578 . . . . 130.13 110.338 -178.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 626' ' ' ILE . . . . . . . . . . . . . 36.9 pt -71.55 161.19 4.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 CA-C-O 122.26 1.028 . . . . 97.879999999999995 110.226 -177.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 627' ' ' ASP . . . . . 0.431 ' HB2' HG13 ' B' ' 608' ' ' VAL . 39.0 t70 -70.35 -46.01 65.0 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.204 -0.907 . . . . 120.18000000000001 111.174 -179.405 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 628' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -99.33 78.87 2.25 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 122.135 0.969 . . . . 126.0 110.019 -168.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 629' ' ' ILE . . . . . . . . . . . . . 5.8 tp -149.81 133.06 7.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 107.889 -1.152 . . . . 136.91 107.889 168.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 630' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -82.94 85.07 7.21 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.87 0.843 . . . . 151.91999999999999 109.468 -170.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 631' ' ' ILE . . . . . . . . . . . . . 51.4 mt -99.48 139.21 20.73 Favored Pre-proline 0 C--O 1.241 0.64 0 N-CA-C 107.661 -1.237 . . . . 104.16 107.661 172.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 632' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.81 137.67 79.29 Favored 'Trans proline' 0 C--O 1.234 0.303 0 CA-C-N 119.205 0.752 . . . . 103.55 111.263 177.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 633' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 63.15 11.89 5.63 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 125.301 1.44 . . . . 107.06999999999999 113.403 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 634' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -65.01 -45.55 85.1 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.652 -0.819 . . . . 109.81 111.223 -176.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 635' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -76.5 -28.71 56.52 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.759 -0.777 . . . . 163.12 111.791 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 636' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -58.22 -56.24 24.66 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.27 -0.572 . . . . 114.87 110.23 171.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 637' ' ' LEU . . . . . . . . . . . . . 59.8 mt -67.86 -30.2 69.52 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.635 -0.426 . . . . 97.939999999999998 111.735 -179.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 638' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -58.51 -50.76 72.59 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 119.983 -0.687 . . . . 94.900000000000006 110.631 171.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 639' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -65.07 -33.63 76.49 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.186 -0.605 . . . . 117.05 111.797 -179.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 640' ' ' ALA . . . . . . . . . . . . . . . -69.02 -42.01 76.95 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.557 -0.457 . . . . 90.780000000000001 111.138 177.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 641' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -61.46 -48.71 79.89 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.879 0.371 . . . . 121.19 110.746 178.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 642' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -65.78 -34.07 77.31 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.479 -0.488 . . . . 110.48 111.652 176.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 643' ' ' GLY . . . . . . . . . . . . . . . -57.74 -57.21 21.01 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 121.098 -0.572 . . . . 97.329999999999998 112.263 176.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 644' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -59.65 -35.48 74.49 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.553 -0.459 . . . . 157.43000000000001 110.93 177.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 645' ' ' ARG . . . . . . . . . . . . . 36.1 ttt-85 -61.78 -30.7 70.97 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.237 -0.585 . . . . 124.95 111.664 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 646' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -70.86 -35.14 72.26 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.023 -0.671 . . . . 120.25 111.001 171.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 647' ' ' LEU . . . . . . . . . . . . . 7.5 mt -60.95 -27.09 67.99 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 111.932 0.345 . . . . 130.06999999999999 111.932 -175.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 648' ' ' MET . . . . . . . . . . . . . 2.3 mtm -87.81 25.28 1.55 Allowed 'General case' 0 C--O 1.239 0.512 0 N-CA-C 112.485 0.55 . . . . 186.50999999999999 112.485 171.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 649' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 C--N 1.331 -0.208 0 C-N-CA 123.121 0.568 . . . . 163.30000000000001 111.948 176.346 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 702' ' ' ' ZN' . . . . . 0.902 'ZN ' ' HG ' ' B' ' 434' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 413' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.775 0.321 . . . . 180.24 111.266 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 414' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -82.87 173.07 12.16 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.935 0.874 . . . . 186.95 110.463 179.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 415' ' ' HIS . . . . . 0.613 ' CD2' ' HB3' ' A' ' 430' ' ' CYS . 20.3 m80 -110.86 165.36 11.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.818 0.818 . . . . 145.72 110.103 179.02 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 416' ' ' MET . . . . . 0.458 ' HG3' ' O ' ' A' ' 435' ' ' PRO . 31.6 mtm -64.75 129.84 41.28 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.226 -0.897 . . . . 126.99 110.072 174.92 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 417' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -85.22 23.72 1.24 Allowed 'General case' 0 C--O 1.237 0.439 0 N-CA-C 112.897 0.703 . . . . 147.95 112.897 176.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 418' ' ' PHE . . . . . . . . . . . . . 33.2 p90 -154.38 146.69 23.87 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.007 -0.738 . . . . 121.76 109.007 -178.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 419' ' ' CYS . . . . . 0.444 ' SG ' ' N ' ' A' ' 439' ' ' HIS . 53.8 t -59.5 129.82 43.85 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.608 -0.723 . . . . 148.88 110.169 177.221 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 1.2 ttm-85 -58.89 -40.89 85.78 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.749 -0.66 . . . . 114.23 111.405 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 421' ' ' VAL . . . . . . . . . . . . . 21.6 t -76.16 -40.35 36.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 C-N-CA 120.92 -0.312 . . . . 133.41 111.273 -172.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 422' ' ' CYS . . . . . . . . . . . . . 1.5 p -114.8 -0.05 13.64 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 114.473 1.286 . . . . 141.3 114.473 -170.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 423' ' ' LYS . . . . . . . . . . . . . 3.2 mmtp 65.79 4.34 2.88 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.528 0.731 . . . . 143.58 112.933 171.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 424' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -103.88 157.18 17.27 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.582 0.706 . . . . 168.05 110.526 -179.597 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -93.95 -168.41 37.83 Favored Glycine 0 N--CA 1.444 -0.792 0 CA-C-O 122.343 0.968 . . . . 129.45 112.622 179.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 113.4 -143.09 17.75 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 114.779 -0.71 . . . . 152.07 113.177 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 427' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -60.31 105.32 0.41 Allowed 'General case' 0 C--O 1.235 0.295 0 C-N-CA 122.334 0.253 . . . . 193.27 110.474 178.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 428' ' ' LEU . . . . . . . . . . . . . 26.2 mt -119.0 149.2 42.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.422 0.629 . . . . 148.74 111.022 -173.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 429' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -124.75 116.54 22.48 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.307 -1.368 . . . . 163.57 107.307 -179.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 430' ' ' CYS . . . . . 0.613 ' HB3' ' CD2' ' A' ' 415' ' ' HIS . 9.1 m -104.51 138.01 41.52 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.09 0.471 . . . . 152.32 111.265 -165.698 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 431' ' ' CYS . . . . . 0.659 ' HB2' ' HB3' ' A' ' 457' ' ' CYS . 49.3 t -72.25 143.63 48.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.45 -0.796 . . . . 133.86 110.149 176.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -90.38 -5.17 56.49 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 113.348 0.87 . . . . 156.54 113.348 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 433' ' ' ALA . . . . . . . . . . . . . . . -105.55 -22.87 12.9 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 114.011 1.115 . . . . 137.91 114.011 175.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 434' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -145.3 162.81 35.52 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.386 -0.968 . . . . 149.41 108.386 -178.132 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 435' ' ' PRO . . . . . 0.458 ' O ' ' HG3' ' A' ' 416' ' ' MET . 13.3 Cg_exo -76.34 15.39 1.01 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 N-CA-C 114.618 0.969 . . . . 110.78 114.618 -173.965 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 436' ' ' SER . . . . . . . . . . . . . 68.0 m -68.95 153.91 42.98 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.768 0.794 . . . . 124.47 111.185 -177.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 437' ' ' SER . . . . . . . . . . . . . 21.6 m -148.4 135.41 20.13 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.438 -0.949 . . . . 112.33 108.438 179.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 438' ' ' TYR . . . . . 0.481 ' CE2' ' HB2' ' A' ' 457' ' ' CYS . 67.7 m-85 -133.59 156.47 47.78 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.742 0.782 . . . . 145.2 111.021 -172.659 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 439' ' ' HIS . . . . . 0.499 ' HB3' ' CE1' ' A' ' 441' ' ' HIS . 40.2 m170 -93.54 131.27 38.96 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 114.706 -1.134 . . . . 150.51 108.919 169.963 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 440' ' ' LEU . . . . . . . . . . . . . 2.7 mp -57.33 -31.77 66.04 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.601 0.593 . . . . 149.78 112.601 -170.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 441' ' ' HIS . . . . . 0.499 ' CE1' ' HB3' ' A' ' 439' ' ' HIS . 25.8 p-80 -71.98 -22.52 61.42 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 119.333 -0.947 . . . . 156.21 112.327 173.29 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 442' ' ' CYS . . . . . 0.417 ' SG ' ' HB2' ' A' ' 439' ' ' HIS . 91.5 m -79.74 -28.49 40.49 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.682 0.623 . . . . 153.54 112.682 -175.248 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 443' ' ' LEU . . . . . 0.466 HD12 ' O ' ' A' ' 439' ' ' HIS . 3.9 mp -75.07 156.68 35.86 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 122.116 0.96 . . . . 155.93 111.379 -177.624 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 444' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -127.94 106.19 20.28 Favored Pre-proline 0 C--O 1.249 1.042 0 CA-C-N 114.754 -1.112 . . . . 163.47 109.083 -176.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -78.06 152.58 91.93 Favored 'Cis proline' 0 C--N 1.341 0.176 0 C-N-CA 125.094 -0.794 . . . . 163.31 113.151 1.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -61.07 144.21 99.28 Favored 'Trans proline' 0 C--N 1.332 -0.308 0 O-C-N 123.491 1.258 . . . . 142.67 111.007 174.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 6.1 mt -96.24 146.9 32.11 Favored Pre-proline 0 C--N 1.346 0.428 0 C-N-CA 118.588 -1.245 . . . . 153.53 110.784 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 448' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -52.59 -60.51 0.71 Allowed 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 120.817 1.011 . . . . 156.83 113.368 178.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -165.46 -171.12 2.03 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 107.926 -1.139 . . . . 197.81 107.926 164.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 450' ' ' ILE . . . . . . . . . . . . . 2.9 mp -46.24 115.15 2.91 Favored Pre-proline 0 C--O 1.239 0.539 0 C-N-CA 125.297 1.439 . . . . 175.92 110.851 -170.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.34 156.51 29.19 Favored 'Trans proline' 0 C--N 1.328 -0.504 0 CA-C-O 122.185 0.827 . . . . 184.72 112.035 -177.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 452' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -69.79 145.63 52.03 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 114.553 -1.203 . . . . 191.63 110.489 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 68.71 -157.04 53.29 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 122.441 1.023 . . . . 169.1 113.136 176.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -64.72 158.9 23.45 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 122.038 0.923 . . . . 199.38 110.792 -178.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 455' ' ' TRP . . . . . 0.438 ' CH2' ' HA ' ' A' ' 457' ' ' CYS . 63.6 t90 -148.77 124.65 10.6 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 107.717 -1.216 . . . . 148.21 107.717 173.49 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 456' ' ' LEU . . . . . . . . . . . . . 4.6 mt -104.66 134.1 48.38 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.937 -0.764 . . . . 121.4 108.937 -179.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 457' ' ' CYS . . . . . 0.659 ' HB3' ' HB2' ' A' ' 431' ' ' CYS . 20.5 p -72.19 161.74 77.34 Favored Pre-proline 0 N--CA 1.453 -0.313 0 CA-C-N 116.023 -0.535 . . . . 111.89 111.509 -170.327 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 458' ' ' PRO . . . . . 0.582 ' HA ' HG22 ' A' ' 461' ' ' THR . 95.4 Cg_exo -56.73 -29.28 79.77 Favored 'Trans proline' 0 C--O 1.237 0.466 0 N-CA-C 114.179 0.8 . . . . 133.42 114.179 -178.504 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 1.8 ptp180 -83.47 -24.91 31.58 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 118.967 -1.093 . . . . 129.72 111.511 176.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 1.3 m -78.33 -34.37 48.6 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.464 -0.494 . . . . 110.9 111.743 170.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 461' ' ' THR . . . . . 0.582 HG22 ' HA ' ' A' ' 458' ' ' PRO . 5.6 t -72.89 -20.63 61.05 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 119.894 -0.722 . . . . 169.58 112.19 177.004 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 462' ' ' CYS . . . . . 0.452 ' HB2' HD21 ' A' ' 529' ' ' LEU . 14.6 t -55.25 133.98 69.23 Favored Pre-proline 0 C--O 1.242 0.687 0 CA-C-N 117.934 0.334 . . . . 140.03 111.405 -171.159 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.73 148.34 36.47 Favored 'Trans proline' 0 C--O 1.24 0.579 0 C-N-CA 120.59 0.86 . . . . 138.9 110.782 176.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 464' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.46 166.69 29.08 Favored 'Trans proline' 0 C--N 1.328 -0.507 0 CA-C-O 122.185 0.827 . . . . 137.1 110.952 177.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . 18.5 mt -84.77 155.84 21.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.055 -0.975 . . . . 128.54 110.833 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 466' ' ' LYS . . . . . . . . . . . . . 1.6 tttp -66.16 -35.6 80.9 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 115.06 -0.973 . . . . 153.29 111.598 178.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . -151.33 -153.25 6.12 Favored Glycine 0 N--CA 1.444 -0.803 0 N-CA-C 110.06 -1.216 . . . . 132.99 110.06 174.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 468' ' ' LYS . . . . . . . . . . . . . 7.3 tttt -103.66 129.65 51.0 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.831 -0.803 . . . . 134.61 108.831 175.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 469' ' ' VAL . . . . . 0.417 HG22 ' CE1' ' A' ' 535' ' ' HIS . 2.7 m -82.58 136.01 23.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 N-CA-C 109.143 -0.688 . . . . 114.56 109.143 -174.953 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 470' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -92.41 -41.76 10.14 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.202 -0.454 . . . . 139.87 112.064 -177.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 471' ' ' ARG . . . . . 0.529 ' HA ' ' HE1' ' A' ' 538' ' ' MET . 6.2 ttp180 -155.5 138.48 15.43 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.217 -0.66 . . . . 128.19 109.217 -177.235 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . 71.4 mt -89.73 125.46 42.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 108.085 -1.08 . . . . 106.95 108.085 174.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 11.2 mt -99.52 -42.26 7.01 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 113.322 0.86 . . . . 147.35 113.322 -174.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 44.1 t-80 -159.91 160.31 33.39 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.164 -1.05 . . . . 144.54 108.164 -169.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 475' ' ' TRP . . . . . 0.505 ' CE3' ' HD3' ' A' ' 509' ' ' ARG . 15.7 p-90 -142.03 155.51 45.41 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.549 0.69 . . . . 149.9 110.341 174.344 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.501 HH11 ' HB3' ' A' ' 476' ' ' ARG . 4.5 mtm105 -141.97 162.61 35.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 114.802 -1.09 . . . . 165.79 109.588 -169.846 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 477' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -91.98 159.84 15.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.74 0.781 . . . . 149.57 110.241 171.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 478' ' ' THR . . . . . 1.094 ' CG2' ' HG3' ' A' ' 508' ' ' GLU . 10.2 t -143.94 169.99 16.76 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.225 -0.898 . . . . 173.27 109.43 -171.407 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 56.1 mp0 -85.84 140.11 35.27 Favored Pre-proline 0 C--O 1.236 0.354 0 C-N-CA 115.245 -2.582 . . . . 203.61 110.508 -174.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -60.42 148.48 90.44 Favored 'Trans proline' 0 C--O 1.245 0.844 0 O-C-N 122.618 0.799 . . . . 201.59 110.775 -175.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.41 160.87 43.49 Favored 'Trans proline' 0 C--N 1.33 -0.41 0 CA-C-O 122.149 0.812 . . . . 181.21 111.584 179.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -83.87 128.65 62.32 Favored Pre-proline 0 C--O 1.236 0.39 0 CA-C-N 114.87 -1.059 . . . . 213.13 110.239 -175.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo . . . . . 0 C--N 1.341 0.175 0 C-N-CA 123.578 2.852 . . . . 199.89 112.383 176.853 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 506' ' ' ILE . . . . . . . . . . . . . 6.4 tp . . . . . 0 CA--C 1.536 0.428 0 N-CA-C 109.626 -0.509 . . . . 198.58 109.626 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 507' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -65.55 132.1 29.95 Favored 'Trans proline' 0 N--CA 1.473 0.281 0 O-C-N 122.379 0.673 . . . . 179.04 111.768 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 508' ' ' GLU . . . . . 1.094 ' HG3' ' CG2' ' A' ' 478' ' ' THR . 13.3 pt-20 -74.5 -161.6 0.13 Allowed 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 123.839 0.855 . . . . 209.22 110.396 174.733 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.662 HH12 ' HB3' ' A' ' 548' ' ' MET . 7.8 ttm180 -154.83 139.94 17.46 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 119.756 -0.778 . . . . 168.62 110.779 179.529 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' GLU . . . . . 0.466 ' OE2' ' NH1' ' A' ' 476' ' ' ARG . 4.8 pt-20 -119.63 152.3 37.31 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.401 0.619 . . . . 160.98 110.264 175.992 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -123.41 138.89 54.5 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.052 -0.976 . . . . 116.06 109.453 -177.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -86.36 122.43 30.31 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 108.476 -0.935 . . . . 117.64 108.476 173.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' VAL . . . . . . . . . . . . . 25.0 m -120.85 147.92 24.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-O 121.645 0.736 . . . . 114.98 110.122 -170.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' LYS . . . . . . . . . . . . . 20.7 tptp -98.91 123.62 43.3 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 107.311 -1.366 . . . . 105.33 107.311 165.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 515' ' ' TRP . . . . . 0.416 ' HE1' ' HB3' ' A' ' 524' ' ' SER . 70.5 m95 -86.13 140.18 30.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.89 0.376 . . . . 125.35 110.124 -176.733 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -69.59 129.03 38.53 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.842 -0.617 . . . . 108.72 109.964 178.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 94.5 -25.76 21.25 Favored Glycine 0 N--CA 1.442 -0.923 0 N-CA-C 115.095 0.798 . . . . 92.54 115.095 178.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 4.6 mt -110.48 152.46 26.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 118.152 0.976 . . . . 113.33 109.678 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 519' ' ' SER . . . . . 0.416 ' N ' HG21 ' A' ' 623' ' ' THR . 94.6 p -78.0 -175.33 3.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.996 0.903 . . . . 110.87 110.185 -171.839 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 520' ' ' TYR . . . . . 0.447 ' HE2' HD21 ' A' ' 617' ' ' LEU . 68.4 m-85 -72.21 -13.5 61.55 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 113.3 0.852 . . . . 125.25 113.3 -178.465 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -67.67 -15.51 63.68 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 118.757 0.708 . . . . 128.35 111.909 173.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' HIS . . . . . . . . . . . . . 30.2 m-70 -104.29 9.79 35.8 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 112.689 0.626 . . . . 117.62 112.689 -179.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 523' ' ' CYS . . . . . . . . . . . . . 75.2 m -60.38 120.88 10.73 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 118.246 0.475 . . . . 109.44 110.287 176.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 524' ' ' SER . . . . . 0.416 ' HB3' ' HE1' ' A' ' 515' ' ' TRP . 28.8 t -118.71 -179.78 3.9 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.615 0.721 . . . . 143.38 109.923 -173.537 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 525' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -109.98 137.32 47.92 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.534 -0.757 . . . . 129.21 109.551 173.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 526' ' ' VAL . . . . . . . . . . . . . 11.4 m -129.15 159.25 41.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 N-CA-C 108.959 -0.756 . . . . 112.39 108.959 -179.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 527' ' ' LYS . . . . . . . . . . . . . 56.5 mttt -79.66 145.39 33.03 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.295 -0.866 . . . . 135.05 110.401 -178.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 528' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -53.31 -46.36 69.38 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.524 -0.762 . . . . 158.41 111.545 -176.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.452 HD21 ' HB2' ' A' ' 462' ' ' CYS . 1.6 tt -70.45 -23.23 62.67 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 112.344 0.498 . . . . 122.62 112.344 -176.877 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -60.79 -47.61 85.55 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.188 -0.605 . . . . 122.57 110.806 169.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 531' ' ' LEU . . . . . . . . . . . . . 19.2 mt -60.37 -49.26 78.28 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.829 -0.348 . . . . 118.37 111.152 -179.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.408 ' HB2' ' CE1' ' A' ' 539' ' ' TYR . 21.1 tt0 -60.08 -36.8 78.19 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.526 -0.47 . . . . 157.51 111.326 -179.565 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 533' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -74.48 -38.25 62.96 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.571 -0.451 . . . . 126.51 111.856 -176.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 534' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -113.14 -15.46 12.77 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 114.267 1.21 . . . . 135.98 114.267 -170.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 535' ' ' HIS . . . . . 0.417 ' CE1' HG22 ' A' ' 469' ' ' VAL . 91.4 m-70 -138.88 54.43 1.74 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 108.417 -0.957 . . . . 104.02 108.417 178.946 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 10.6 m -54.52 -65.97 0.48 Allowed 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.57 -0.741 . . . . 97.97 111.442 -173.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 537' ' ' VAL . . . . . 0.458 ' O ' ' ND2' ' A' ' 541' ' ' ASN . 2.3 p -53.14 -46.19 55.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 121.169 0.509 . . . . 136.83 110.565 -174.163 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 538' ' ' MET . . . . . 0.529 ' HE1' ' HA ' ' A' ' 471' ' ' ARG . 3.7 ttm -59.1 -42.75 91.23 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 121.922 -0.486 . . . . 116.45 111.373 174.749 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 539' ' ' TYR . . . . . 0.408 ' CE1' ' HB2' ' A' ' 532' ' ' GLU . 32.4 t80 -63.41 -51.06 67.36 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.712 0.292 . . . . 130.67 111.102 -179.022 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 540' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -67.73 -29.19 68.37 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.365 -0.534 . . . . 153.13 111.885 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 541' ' ' ASN . . . . . 0.458 ' ND2' ' O ' ' A' ' 537' ' ' VAL . 7.0 m-80 -62.31 -45.53 92.82 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.05 -0.66 . . . . 137.56 110.621 175.092 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 542' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -59.29 -45.53 91.03 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.755 -0.378 . . . . 132.77 110.609 173.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 543' ' ' GLN . . . . . 0.503 ' O ' ' HE1' ' A' ' 548' ' ' MET . 9.8 mt-30 -50.33 -50.79 49.94 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.122 0.487 . . . . 143.66 111.423 178.14 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 3.8 ttt-85 -60.9 -32.03 71.51 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.585 -0.446 . . . . 147.02 111.763 -175.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 545' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -82.16 -30.88 30.78 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 113.057 0.762 . . . . 160.08 113.057 -170.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -127.19 178.53 5.97 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.862 0.839 . . . . 173.19 110.765 -165.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 547' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -93.59 134.17 36.15 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 114.82 -1.082 . . . . 180.03 109.389 178.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 548' ' ' MET . . . . . 0.662 ' HB3' HH12 ' A' ' 509' ' ' ARG . 1.8 mpp? -112.48 15.99 19.98 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.997 -0.547 . . . . 178.78 112.467 -177.114 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -95.71 -43.97 7.66 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.143 0.577 . . . . 173.86 112.26 168.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -116.46 133.04 23.03 Favored Pre-proline 0 C--O 1.24 0.578 0 C-N-CA 125.062 1.345 . . . . 172.13 109.056 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -60.65 154.98 50.87 Favored 'Trans proline' 0 C--O 1.241 0.646 0 C-N-CA 120.531 0.821 . . . . 169.26 110.942 -179.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 552' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.7 155.78 67.68 Favored 'Trans proline' 0 C--O 1.241 0.633 0 C-N-CA 120.399 0.733 . . . . 142.56 110.531 176.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 553' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.48 154.63 68.6 Favored 'Trans proline' 0 C--N 1.329 -0.476 0 CA-C-O 121.708 0.628 . . . . 155.97 111.317 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 554' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -69.28 141.22 54.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.036 -0.984 . . . . 165.18 109.419 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 555' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -93.43 101.87 14.09 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 108.459 -0.941 . . . . 162.13 108.459 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 556' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -101.47 5.61 42.04 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 112.685 0.624 . . . . 170.35 112.685 173.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 557' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.255 0 CA-C-N 118.164 0.438 . . . . 186.22 113.179 -178.16 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 573' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo . . . . . 0 C--O 1.233 0.26 0 N-CA-C 112.67 0.219 . . . . 166.45 112.67 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 1.3 mp -90.47 16.46 8.85 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 112.45 0.537 . . . . 152.28 112.45 176.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 575' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -57.46 -49.26 76.82 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.799 -0.36 . . . . 150.31 111.223 -176.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 576' ' ' ALA . . . . . . . . . . . . . . . -49.6 -34.22 17.32 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 112.324 0.49 . . . . 142.75 112.324 -175.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 577' ' ' LYS . . . . . 0.566 ' NZ ' ' HB2' ' A' ' 581' ' ' ARG . 2.2 tptp -84.36 -43.45 14.72 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.621 -0.432 . . . . 154.96 109.913 175.466 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 578' ' ' MET . . . . . . . . . . . . . 25.5 mmt -56.15 -34.28 66.0 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 119.731 -0.787 . . . . 136.56 111.169 176.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 579' ' ' GLU . . . . . 0.654 ' HA ' ' HB2' ' A' ' 583' ' ' TYR . 34.2 tt0 -65.29 -32.4 74.04 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 120.322 -0.551 . . . . 172.88 111.022 171.963 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -69.94 -58.26 4.06 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.752 0.31 . . . . 153.32 111.44 -176.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 581' ' ' ARG . . . . . 0.566 ' HB2' ' NZ ' ' A' ' 577' ' ' LYS . 0.8 OUTLIER -71.4 -26.93 62.97 Favored 'General case' 0 C--O 1.237 0.434 0 O-C-N 121.853 -0.529 . . . . 166.06 112.4 -176.536 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 582' ' ' PHE . . . . . 0.416 ' CD2' ' HB3' ' A' ' 581' ' ' ARG . 84.5 m-85 -131.01 -64.88 0.8 Allowed 'General case' 0 C--O 1.234 0.287 0 C-N-CA 119.275 -0.97 . . . . 129.21 113.285 -164.696 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 583' ' ' TYR . . . . . 0.654 ' HB2' ' HA ' ' A' ' 579' ' ' GLU . 21.9 m-30 -59.67 -38.3 81.14 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 112.18 0.437 . . . . 125.14 112.18 -159.528 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 584' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -67.17 -27.43 67.28 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.289 -0.564 . . . . 152.95 111.928 -177.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 585' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -76.25 -12.24 60.05 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 113.242 0.83 . . . . 134.9 113.242 -177.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 586' ' ' GLY . . . . . . . . . . . . . . . 124.82 11.95 4.22 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.818 -0.706 . . . . 117.14 113.325 176.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 587' ' ' ILE . . . . . . . . . . . . . 81.5 mt -92.27 106.25 17.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 108.038 -1.097 . . . . 134.31 108.038 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 588' ' ' LYS . . . . . 0.478 ' HB3' ' CE2' ' A' ' 591' ' ' TRP . 7.2 tttp -59.74 126.64 83.55 Favored Pre-proline 0 C--O 1.239 0.552 0 N-CA-C 109.086 -0.709 . . . . 140.45 109.086 173.62 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 589' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.48 -19.46 51.92 Favored 'Trans proline' 0 N--CA 1.475 0.436 0 N-CA-C 114.757 1.022 . . . . 117.48 114.757 -167.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 590' ' ' GLU . . . . . 0.545 ' N ' ' OE1' ' A' ' 590' ' ' GLU . 16.8 mp0 -69.53 -27.08 64.85 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 118.983 0.811 . . . . 146.31 111.404 177.875 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 591' ' ' TRP . . . . . 0.806 ' CD1' HD13 ' A' ' 617' ' ' LEU . 28.1 m0 -66.02 -16.75 64.18 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.162 0.43 . . . . 108.8 112.162 -176.817 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 592' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -103.65 6.8 37.31 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 122.919 0.488 . . . . 116.7 112.307 177.197 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 593' ' ' MET . . . . . 0.443 ' HE3' ' HG3' ' A' ' 590' ' ' GLU . 6.0 mtm -101.58 139.91 36.59 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.065 0.546 . . . . 124.3 109.719 177.566 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 594' ' ' ILE . . . . . . . . . . . . . 84.9 mt -81.29 128.86 38.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 109.571 -0.529 . . . . 112.53 109.571 -178.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 595' ' ' HIS . . . . . 0.657 ' HB2' ' HG2' ' A' ' 615' ' ' LYS . 13.3 t-160 -94.89 -52.06 4.41 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.169 -0.469 . . . . 125.62 111.144 172.205 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 66.3 mtp180 -145.56 150.79 37.05 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.198 -0.667 . . . . 112.7 109.198 -177.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 40.8 mt -101.92 116.77 46.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 107.23 -1.396 . . . . 96.79 107.23 166.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 598' ' ' LEU . . . . . . . . . . . . . 49.6 mt -93.5 -38.86 11.18 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 113.056 0.762 . . . . 111.55 113.056 -170.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 599' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -160.43 171.81 18.38 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.568 -0.901 . . . . 120.88 108.568 -176.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 600' ' ' HIS . . . . . . . . . . . . . 48.1 p-80 -127.72 159.55 34.42 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.166 -0.924 . . . . 105.45 109.322 178.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 601' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -151.17 150.69 30.93 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.573 -0.74 . . . . 112.86 109.533 -179.497 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 602' ' ' PHE . . . . . 0.538 ' HE2' ' HB ' ' A' ' 608' ' ' VAL . 18.8 m-85 -117.81 133.65 55.72 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.268 -0.878 . . . . 112.57 109.126 176.956 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 28.5 p-10 -100.63 -170.16 1.82 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.511 0.672 . . . . 131.39 110.578 -175.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 604' ' ' LYS . . . . . . . . . . . . . 5.8 ptpt -52.65 -51.89 58.09 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 115.627 -0.715 . . . . 140.77 111.501 178.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 605' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -72.95 -32.07 65.0 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.19 -0.604 . . . . 164.65 111.432 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . 107.47 -5.87 35.71 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-O 118.617 -1.102 . . . . 131.64 115.621 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 607' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -59.52 124.12 19.04 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 119.105 1.453 . . . . 151.68 109.687 170.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 608' ' ' VAL . . . . . 0.538 ' HB ' ' HE2' ' A' ' 602' ' ' PHE . 12.1 p -72.75 141.19 16.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 C-N-CA 120.235 -0.586 . . . . 124.43 110.908 -174.028 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 609' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -114.19 144.72 42.73 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 108.467 -0.938 . . . . 107.55 108.467 171.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 610' ' ' TYR . . . . . 0.407 ' HB2' HD11 ' A' ' 612' ' ' ILE . 90.5 m-85 -116.42 140.5 49.28 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.723 -0.671 . . . . 116.0 109.309 175.516 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 4.0 tp -93.3 110.1 21.64 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.315 -0.994 . . . . 107.15 108.315 177.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 612' ' ' ILE . . . . . 0.487 HD12 ' N ' ' A' ' 612' ' ' ILE . 1.9 mp -103.47 132.46 49.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 109.689 -0.485 . . . . 115.21 109.689 -171.31 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 613' ' ' LYS . . . . . 0.569 ' NZ ' ' O ' ' A' ' 617' ' ' LEU . 8.0 tmtm? -87.48 125.13 34.12 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.067 -1.086 . . . . 116.09 108.067 165.424 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 614' ' ' TRP . . . . . 0.769 ' HE1' ' HB ' ' A' ' 623' ' ' THR . 83.9 m95 -97.11 146.34 25.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.413 0.625 . . . . 119.46 111.096 -175.478 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 615' ' ' LYS . . . . . 0.657 ' HG2' ' HB2' ' A' ' 595' ' ' HIS . 6.0 mttt -70.57 137.47 50.08 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.34 -0.845 . . . . 133.03 111.684 -173.476 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 616' ' ' ASP . . . . . 0.477 ' O ' HD12 ' A' ' 617' ' ' LEU . 16.5 t0 55.54 34.49 23.24 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.777 0.831 . . . . 153.28 111.113 -174.545 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 617' ' ' LEU . . . . . 0.806 HD13 ' CD1' ' A' ' 591' ' ' TRP . 1.9 mp -141.9 123.02 8.68 Favored Pre-proline 0 C--N 1.326 -0.444 0 N-CA-C 108.065 -1.087 . . . . 112.45 108.065 173.917 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 618' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -67.48 165.68 26.37 Favored 'Trans proline' 0 C--N 1.332 -0.294 0 CA-C-O 122.031 0.763 . . . . 108.32 112.401 -169.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 619' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -61.82 -31.56 71.81 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.878 -1.056 . . . . 136.87 112.077 -170.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 620' ' ' ASP . . . . . 0.566 ' N ' ' OD1' ' A' ' 620' ' ' ASP . 11.0 p-10 -52.63 -20.85 3.35 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 112.917 0.71 . . . . 164.46 112.917 176.277 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 621' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -114.22 29.79 7.76 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 122.949 0.499 . . . . 138.95 112.071 -179.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 622' ' ' CYS . . . . . . . . . . . . . 87.0 m -58.89 161.29 5.03 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.709 0.766 . . . . 106.18 109.206 165.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 623' ' ' THR . . . . . 0.769 ' HB ' ' HE1' ' A' ' 614' ' ' TRP . 5.2 m -143.02 134.84 26.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.666 -0.697 . . . . 123.55 110.076 -171.317 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 624' ' ' TRP . . . . . . . . . . . . . 87.3 m95 -77.26 115.87 17.41 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.082 -0.71 . . . . 93.78 109.082 169.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 625' ' ' GLU . . . . . 0.481 ' HB2' HD13 ' A' ' 612' ' ' ILE . 17.2 mm-40 -108.02 152.99 23.75 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.368 0.604 . . . . 126.21 111.191 -176.796 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 626' ' ' ILE . . . . . . . . . . . . . 6.0 tp -73.59 157.58 6.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 122.206 1.003 . . . . 140.69 110.038 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 627' ' ' ASP . . . . . 0.592 ' OD1' ' NZ ' ' A' ' 638' ' ' LYS . 44.6 t0 -67.7 -50.04 59.56 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.367 -0.833 . . . . 142.96 111.203 176.834 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -93.27 80.8 4.44 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 122.416 1.103 . . . . 181.26 109.626 -172.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 11.3 tt -149.54 134.02 9.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 107.076 -1.453 . . . . 112.19 107.076 170.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 630' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -89.39 75.69 7.63 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 122.493 1.139 . . . . 160.26 109.255 -172.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 631' ' ' ILE . . . . . 0.664 ' HB ' ' HB2' ' A' ' 634' ' ' TYR . 3.5 mm -71.37 141.43 85.73 Favored Pre-proline 0 C--O 1.245 0.823 0 CA-C-N 114.853 -1.067 . . . . 135.31 108.276 164.691 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 632' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -50.74 131.9 35.02 Favored 'Trans proline' 0 C--N 1.33 -0.434 0 CA-C-N 119.696 0.927 . . . . 105.47 110.038 165.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 633' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 76.62 -13.47 0.92 Allowed 'General case' 0 C--O 1.232 0.167 0 C-N-CA 125.732 1.613 . . . . 159.99 113.326 174.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 634' ' ' TYR . . . . . 0.664 ' HB2' ' HB ' ' A' ' 631' ' ' ILE . 1.1 t80 -42.72 -61.8 1.16 Allowed 'General case' 0 C--O 1.236 0.345 0 N-CA-C 114.152 1.167 . . . . 122.73 114.152 -163.148 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 635' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -67.07 -21.76 65.87 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.063 -1.055 . . . . 158.03 112.589 -175.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 636' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -65.3 -40.6 94.02 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 119.954 -0.699 . . . . 153.76 110.77 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 637' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -73.78 -28.74 61.81 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.411 -0.516 . . . . 134.94 112.028 174.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 638' ' ' LYS . . . . . 0.592 ' NZ ' ' OD1' ' A' ' 627' ' ' ASP . 36.2 mttt -59.4 -43.77 92.94 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.424 -0.51 . . . . 113.72 111.248 172.43 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 639' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -67.94 -37.74 81.99 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.875 -0.73 . . . . 162.88 111.094 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -59.03 -46.54 87.96 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.527 -0.469 . . . . 106.08 110.84 175.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 641' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -59.93 -43.46 94.93 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.576 -0.284 . . . . 104.3 111.403 -179.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 642' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -84.66 -27.38 27.15 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.295 0.48 . . . . 106.43 112.295 -175.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 643' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.306 0 N-CA-C 114.746 0.658 . . . . 133.59 114.746 -174.201 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 413' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.344 0 N-CA-C 112.406 0.521 . . . . 184.8 112.406 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 414' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.31 -155.68 0.39 Allowed 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 109.557 -0.535 . . . . 199.95 109.557 -175.847 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 415' ' ' HIS . . . . . 0.665 ' CD2' ' HB3' ' B' ' 430' ' ' CYS . 2.4 m80 -87.19 152.41 22.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.212 0.53 . . . . 138.03 110.824 -178.231 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 416' ' ' MET . . . . . 0.48 ' HE1' ' CG ' ' B' ' 420' ' ' ARG . 3.3 mtm -73.21 131.63 42.23 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.73 -0.668 . . . . 135.33 110.904 179.881 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 417' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -89.99 14.53 12.01 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.575 0.583 . . . . 139.75 112.575 173.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 418' ' ' PHE . . . . . . . . . . . . . 11.4 p90 -132.1 163.26 28.86 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.451 0.643 . . . . 132.31 109.336 173.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 419' ' ' CYS . . . . . . . . . . . . . 23.3 t -81.54 145.23 30.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.435 -0.802 . . . . 119.75 110.533 -179.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 420' ' ' ARG . . . . . 0.48 ' CG ' ' HE1' ' B' ' 416' ' ' MET . 0.3 OUTLIER -74.76 -8.0 55.07 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.38 0.881 . . . . 133.18 113.38 -179.006 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 421' ' ' VAL . . . . . . . . . . . . . 51.7 t -113.81 -45.9 4.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 118.504 0.593 . . . . 157.76 111.405 -172.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 422' ' ' CYS . . . . . 0.406 ' SG ' ' ND1' ' B' ' 439' ' ' HIS . 16.1 p -106.34 -9.38 16.8 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 113.529 0.937 . . . . 119.76 113.529 179.327 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 423' ' ' LYS . . . . . 0.404 ' HE3' ' O ' ' B' ' 420' ' ' ARG . 6.9 mmtm 58.51 38.53 25.46 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.735 0.814 . . . . 125.47 111.927 177.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 424' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -120.51 165.53 14.86 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.608 0.718 . . . . 166.79 109.85 175.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 425' ' ' GLY . . . . . . . . . . . . . . . -96.85 -168.15 33.52 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-O 122.192 0.885 . . . . 156.24 112.589 178.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 426' ' ' GLY . . . . . . . . . . . . . . . 125.59 -137.72 10.45 Favored Glycine 0 C--N 1.332 0.314 0 CA-C-N 114.936 -0.632 . . . . 189.14 113.233 178.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 427' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -79.29 139.34 37.88 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.85 -0.796 . . . . 204.17 108.85 163.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 428' ' ' LEU . . . . . . . . . . . . . 5.6 mp -149.69 142.2 24.4 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 120.315 -0.554 . . . . 144.81 109.998 -179.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 429' ' ' LEU . . . . . . . . . . . . . 25.9 tp -97.35 120.97 38.7 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 108.572 -0.899 . . . . 119.77 108.572 176.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 430' ' ' CYS . . . . . 0.665 ' HB3' ' CD2' ' B' ' 415' ' ' HIS . 34.6 m -101.64 133.75 45.86 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 122.668 0.387 . . . . 118.51 110.645 -172.023 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 431' ' ' CYS . . . . . 0.528 ' HB2' ' HB3' ' B' ' 457' ' ' CYS . 45.9 t -64.09 148.1 50.64 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.515 0.674 . . . . 141.17 110.727 178.314 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 432' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -89.69 -17.34 28.52 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.474 -0.784 . . . . 134.66 112.977 -176.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 433' ' ' ALA . . . . . . . . . . . . . . . -105.28 -16.14 14.85 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 113.285 0.846 . . . . 142.73 113.285 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 434' ' ' CYS . . . . . 0.902 ' HG ' 'ZN ' ' B' ' 702' ' ' ' ZN' . 13.9 p -147.15 162.25 33.45 Favored Pre-proline 0 C--O 1.237 0.405 0 N-CA-C 108.567 -0.901 . . . . 150.29 108.567 -174.784 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 435' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -75.86 15.96 0.85 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 N-CA-C 115.11 1.158 . . . . 114.22 115.11 -173.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 436' ' ' SER . . . . . 0.479 ' HB3' ' CE1' ' B' ' 438' ' ' TYR . 67.6 m -72.94 152.22 41.51 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.784 0.802 . . . . 122.45 111.179 -177.037 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 437' ' ' SER . . . . . . . . . . . . . 2.6 m -150.1 131.43 14.63 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 107.818 -1.178 . . . . 129.61 107.818 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 438' ' ' TYR . . . . . 0.547 ' CE1' ' HB2' ' B' ' 457' ' ' CYS . 1.4 m-85 -131.19 153.92 48.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.2 0.524 . . . . 148.65 110.21 -173.66 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 439' ' ' HIS . . . . . 0.406 ' ND1' ' SG ' ' B' ' 422' ' ' CYS . 51.6 m170 -79.71 134.91 36.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.416 -0.811 . . . . 162.35 109.067 165.662 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 440' ' ' LEU . . . . . 0.502 HD23 ' HA ' ' B' ' 449' ' ' GLU . 10.6 mp -58.49 -40.73 83.61 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 115.939 -0.573 . . . . 156.38 111.425 -173.694 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 441' ' ' HIS . . . . . . . . . . . . . 43.1 p-80 -70.82 -15.69 62.67 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.168 0.433 . . . . 187.87 112.168 175.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 9.8 m -90.82 5.14 49.61 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 113.114 0.783 . . . . 148.35 113.114 -179.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 443' ' ' LEU . . . . . . . . . . . . . 9.9 mp -84.48 172.2 11.9 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 122.003 0.906 . . . . 133.92 110.281 173.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 444' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -146.57 101.38 4.01 Favored Pre-proline 0 C--O 1.242 0.702 0 N-CA-C 108.038 -1.097 . . . . 128.41 108.038 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 445' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -79.41 149.88 83.57 Favored 'Cis proline' 0 C--N 1.343 0.286 0 C-N-CA 123.842 -1.316 . . . . 119.06 113.138 4.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 446' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -61.32 141.96 94.43 Favored 'Trans proline' 0 C--N 1.333 -0.242 0 O-C-N 123.546 1.288 . . . . 144.91 110.699 176.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 447' ' ' LEU . . . . . . . . . . . . . 17.7 mt -89.82 156.99 46.86 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-N 115.599 -0.728 . . . . 131.54 110.465 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 448' ' ' PRO . . . . . 0.479 ' HB2' ' OE2' ' B' ' 449' ' ' GLU . 22.8 Cg_exo -69.65 -48.61 0.7 Allowed 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 119.762 0.308 . . . . 157.36 111.704 178.772 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 449' ' ' GLU . . . . . 0.502 ' HA ' HD23 ' B' ' 440' ' ' LEU . 3.9 pm0 -170.56 -176.99 2.25 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.937 -1.134 . . . . 192.06 107.937 172.615 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 450' ' ' ILE . . . . . . . . . . . . . 3.7 mp -52.23 121.27 19.8 Favored Pre-proline 0 C--O 1.24 0.587 0 C-N-CA 124.16 0.984 . . . . 142.89 111.692 -169.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 451' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -72.24 157.7 53.23 Favored 'Trans proline' 0 C--N 1.331 -0.355 0 CA-C-O 122.085 0.785 . . . . 175.62 111.683 178.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 452' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.55 -65.11 0.73 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 114.796 -1.093 . . . . 186.43 112.021 -175.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 453' ' ' GLY . . . . . . . . . . . . . . . -78.3 -158.72 11.88 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-O 122.028 0.793 . . . . 164.42 112.779 -175.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 454' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -71.91 139.54 48.8 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.059 -0.57 . . . . 164.12 110.431 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 455' ' ' TRP . . . . . . . . . . . . . 66.7 t90 -122.01 131.56 54.06 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 108.408 -0.96 . . . . 143.54 108.408 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 456' ' ' LEU . . . . . . . . . . . . . 3.0 mp -114.75 135.66 53.93 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.269 -0.641 . . . . 135.3 109.269 178.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 457' ' ' CYS . . . . . 0.547 ' HB2' ' CE1' ' B' ' 438' ' ' TYR . 12.2 p -69.47 158.81 85.9 Favored Pre-proline 0 N--CA 1.45 -0.471 0 CA-C-N 115.86 -0.609 . . . . 121.35 111.046 -170.449 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 458' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -51.69 -29.46 33.37 Favored 'Trans proline' 0 C--O 1.237 0.464 0 N-CA-C 114.312 0.851 . . . . 130.57 114.312 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 459' ' ' ARG . . . . . . . . . . . . . 68.0 mtp85 -64.76 -38.38 90.81 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 118.645 0.657 . . . . 116.53 111.232 173.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 460' ' ' CYS . . . . . . . . . . . . . 83.5 m -77.82 -31.62 51.78 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 112.106 0.41 . . . . 102.76 112.106 176.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 461' ' ' THR . . . . . 0.466 HG23 ' O ' ' B' ' 457' ' ' CYS . 5.0 p -74.2 -28.86 61.47 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.341 -0.544 . . . . 130.79 111.696 177.142 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 462' ' ' CYS . . . . . . . . . . . . . 47.6 t -52.47 119.24 14.71 Favored Pre-proline 0 C--O 1.241 0.626 0 C-N-CA 123.268 0.627 . . . . 129.95 110.653 -172.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 463' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -68.46 154.21 72.27 Favored 'Trans proline' 0 C--O 1.245 0.826 0 N-CA-C 110.624 -0.568 . . . . 118.1 110.624 -177.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 464' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.19 163.95 36.66 Favored 'Trans proline' 0 C--N 1.33 -0.397 0 CA-C-O 122.023 0.76 . . . . 114.67 111.287 176.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 465' ' ' LEU . . . . . . . . . . . . . 19.2 mt -87.36 145.8 26.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.945 -1.025 . . . . 106.17 110.251 177.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 466' ' ' LYS . . . . . . . . . . . . . 13.7 pttp -67.23 -27.15 66.99 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.608 -0.723 . . . . 143.48 111.854 -178.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 467' ' ' GLY . . . . . . . . . . . . . . . -145.57 -168.38 13.06 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 117.882 0.31 . . . . 107.93 113.681 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 468' ' ' LYS . . . . . . . . . . . . . 4.3 mtpp -100.9 122.87 44.21 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 108.542 -0.911 . . . . 133.99 108.542 176.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 469' ' ' VAL . . . . . 0.431 HG12 ' CE1' ' B' ' 535' ' ' HIS . 2.2 p -78.96 132.52 32.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 109.211 -0.663 . . . . 98.84 109.211 178.496 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 470' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -92.04 -33.27 14.87 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 112.494 0.553 . . . . 119.91 112.494 178.944 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 471' ' ' ARG . . . . . 0.507 ' NH1' ' OH ' ' B' ' 520' ' ' TYR . 4.4 ttp-105 -153.7 141.42 20.0 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 109.742 -0.466 . . . . 105.14 109.742 -176.787 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 472' ' ' ILE . . . . . 0.488 ' HB ' ' CD2' ' B' ' 542' ' ' TYR . 2.5 mt -91.26 127.74 43.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 108.51 -0.922 . . . . 108.64 108.51 171.321 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 473' ' ' LEU . . . . . . . . . . . . . 10.3 mp -100.5 -42.29 6.64 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.084 0.772 . . . . 98.25 113.084 -173.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 474' ' ' HIS . . . . . . . . . . . . . 29.8 t-80 -164.1 163.24 23.18 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.274 -1.01 . . . . 130.25 108.274 -171.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 33.0 p-90 -146.71 145.52 30.01 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.57 -0.741 . . . . 131.7 109.334 175.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 33.4 ptt180 -140.18 163.71 32.01 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.383 -0.826 . . . . 117.36 109.142 179.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 477' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -82.29 155.54 24.77 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.395 -0.82 . . . . 119.88 110.51 176.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 478' ' ' THR . . . . . . . . . . . . . 3.1 t -137.9 170.94 15.17 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.371 -0.831 . . . . 145.53 109.204 176.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -61.47 150.92 79.21 Favored Pre-proline 0 C--O 1.236 0.345 0 CA-C-N 115.219 -0.9 . . . . 194.5 110.368 -177.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 480' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -71.16 148.09 55.35 Favored 'Trans proline' 0 C--O 1.245 0.828 0 N-CA-C 110.353 -0.672 . . . . 156.1 110.353 170.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 481' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -65.49 159.77 46.18 Favored 'Trans proline' 0 C--N 1.33 -0.401 0 CA-C-O 122.1 0.792 . . . . 156.58 111.729 178.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 482' ' ' ALA . . . . . . . . . . . . . . . -82.83 131.68 53.67 Favored Pre-proline 0 C--O 1.235 0.322 0 CA-C-N 114.908 -1.042 . . . . 189.01 110.336 -175.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 483' ' ' PRO . . . . . 0.427 ' HG3' ' HA ' ' B' ' 504' ' ' GLU . 24.1 Cg_exo . . . . . 0 C--N 1.341 0.172 0 C-N-CA 123.674 2.916 . . . . 174.06 112.427 178.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 503' ' ' LEU . . . . . . . . . . . . . 8.6 tp . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.772 0.32 . . . . 170.96 110.557 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 504' ' ' GLU . . . . . 0.427 ' HA ' ' HG3' ' B' ' 483' ' ' PRO . 16.3 mt-10 -79.52 179.8 7.27 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.907 0.861 . . . . 206.35 110.833 -172.65 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 505' ' ' GLY . . . . . . . . . . . . . . . -124.35 177.04 16.89 Favored Glycine 0 N--CA 1.444 -0.8 0 CA-C-O 122.151 0.862 . . . . 172.1 113.333 -173.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 506' ' ' ILE . . . . . . . . . . . . . 4.1 tp -87.39 144.89 36.45 Favored Pre-proline 0 C--O 1.24 0.595 0 N-CA-C 108.104 -1.072 . . . . 141.48 108.104 -176.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 507' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -66.96 137.77 45.82 Favored 'Trans proline' 0 C--O 1.234 0.291 0 CA-C-N 119.389 0.817 . . . . 134.64 111.831 177.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 508' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -96.38 172.75 7.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.331 -0.849 . . . . 151.22 110.266 176.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 509' ' ' ARG . . . . . . . . . . . . . 6.9 ptp85 -127.9 140.78 51.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.419 -0.81 . . . . 128.16 109.75 -179.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 21.3 pt-20 -118.38 149.22 41.57 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.062 -0.517 . . . . 133.36 109.65 177.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 511' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -111.02 138.26 47.65 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.04 -0.527 . . . . 106.2 110.884 -173.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -84.44 122.98 29.73 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.44 -0.948 . . . . 109.61 108.44 173.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 513' ' ' VAL . . . . . . . . . . . . . 22.0 m -119.4 155.43 21.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 121.5 0.667 . . . . 116.52 109.988 -171.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 514' ' ' LYS . . . . . 0.521 ' HG3' ' CE1' ' B' ' 520' ' ' TYR . 12.4 tmtt? -105.38 119.48 39.19 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 107.762 -1.199 . . . . 114.7 107.762 165.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 515' ' ' TRP . . . . . . . . . . . . . 90.0 m95 -76.14 133.94 40.09 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.221 -0.592 . . . . 103.69 109.8 -178.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 516' ' ' ALA . . . . . . . . . . . . . . . -65.33 142.16 58.34 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.026 -0.67 . . . . 108.32 109.571 174.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 517' ' ' GLY . . . . . . . . . . . . . . . 75.79 -19.71 2.57 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 115.052 0.781 . . . . 91.25 115.052 -178.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 518' ' ' LEU . . . . . . . . . . . . . 21.4 mt -103.75 154.1 19.94 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.277 1.038 . . . . 99.34 109.648 173.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 519' ' ' SER . . . . . . . . . . . . . 13.2 p -73.36 -173.98 1.51 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.891 0.853 . . . . 102.72 110.361 -177.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 520' ' ' TYR . . . . . 0.521 ' CE1' ' HG3' ' B' ' 514' ' ' LYS . 41.7 m-85 -78.65 -9.33 59.35 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.812 0.671 . . . . 102.13 112.812 176.0 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 521' ' ' TRP . . . . . . . . . . . . . 90.0 m95 -68.89 -29.59 67.9 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 119.327 -0.949 . . . . 102.81 111.178 174.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 522' ' ' HIS . . . . . 0.531 ' NE2' ' OE1' ' B' ' 625' ' ' GLU . 90.6 m-70 -88.86 0.92 56.13 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.038 0.755 . . . . 110.23 113.038 -178.178 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 523' ' ' CYS . . . . . . . . . . . . . 71.7 m -50.34 122.62 7.21 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 118.451 0.568 . . . . 88.82 110.886 172.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 524' ' ' SER . . . . . . . . . . . . . 20.2 p -134.01 -178.74 5.16 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.36 -0.837 . . . . 89.89 108.919 -175.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 525' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -102.47 145.87 28.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.728 -0.669 . . . . 113.65 110.387 179.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 526' ' ' VAL . . . . . . . . . . . . . 33.5 m -137.63 153.82 28.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 121.641 0.734 . . . . 90.37 109.216 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 527' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -73.06 144.65 47.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.119 -0.946 . . . . 125.94 110.619 -179.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 528' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -58.87 -43.77 90.96 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 115.624 -0.716 . . . . 125.74 111.185 -177.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 529' ' ' LEU . . . . . . . . . . . . . 34.2 tp -57.41 -37.36 72.63 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.709 -0.397 . . . . 103.82 111.203 178.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -58.65 -41.32 85.8 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.473 -0.491 . . . . 120.46 111.128 175.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 531' ' ' LEU . . . . . . . . . . . . . 11.9 mt -65.79 -45.0 84.05 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.682 -0.407 . . . . 98.31 111.183 179.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -64.55 -35.61 81.53 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 120.387 -0.525 . . . . 138.43 111.587 -176.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 533' ' ' LEU . . . . . . . . . . . . . 22.9 mt -76.77 -48.09 19.71 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 119.94 -0.704 . . . . 108.05 111.752 -176.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 534' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -103.07 -9.8 19.43 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 114.053 1.131 . . . . 119.56 114.053 -170.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 535' ' ' HIS . . . . . 0.431 ' CE1' HG12 ' B' ' 469' ' ' VAL . 70.9 m80 -142.9 57.26 1.41 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 122.08 0.943 . . . . 100.82 109.262 178.054 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 536' ' ' THR . . . . . . . . . . . . . 3.1 m -59.77 -49.77 76.42 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.003 -0.544 . . . . 115.98 111.592 -173.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 537' ' ' VAL . . . . . . . . . . . . . 8.1 p -64.42 -40.87 90.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 C-N-CA 119.891 -0.724 . . . . 141.47 110.656 -172.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 538' ' ' MET . . . . . . . . . . . . . 24.4 ttm -67.31 -34.38 77.26 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.044 -0.663 . . . . 126.28 111.168 175.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 539' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -68.28 -51.33 46.18 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 120.643 0.258 . . . . 139.9 111.2 179.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 540' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -62.57 -38.22 89.24 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.593 -0.443 . . . . 151.4 111.402 -179.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 541' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -57.66 -50.59 72.66 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.584 -0.447 . . . . 117.69 110.992 175.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 542' ' ' TYR . . . . . 0.488 ' CD2' ' HB ' ' B' ' 472' ' ' ILE . 1.9 t80 -57.28 -53.41 58.39 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.115 0.484 . . . . 114.37 110.879 176.612 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 543' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -48.31 -41.64 28.78 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 112.469 0.544 . . . . 141.57 112.469 -177.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 544' ' ' ARG . . . . . . . . . . . . . 2.7 ttp-105 -74.73 -30.71 61.6 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.53 -0.468 . . . . 176.6 110.376 -177.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 545' ' ' LYS . . . . . . . . . . . . . 15.8 mttt -70.8 -31.19 67.86 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.591 -0.844 . . . . 149.44 112.117 -172.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 546' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -147.25 155.91 42.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 118.649 0.659 . . . . 137.95 110.135 178.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 547' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -75.08 153.58 38.28 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.632 -0.713 . . . . 183.33 111.074 -173.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 548' ' ' MET . . . . . . . . . . . . . 64.6 mmm -115.14 20.61 14.85 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.38 -0.827 . . . . 128.92 112.951 -169.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 549' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -88.69 -48.79 7.27 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 117.834 0.288 . . . . 164.75 111.139 170.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 550' ' ' GLU . . . . . . . . . . . . . 52.1 tt0 -107.76 127.2 28.17 Favored Pre-proline 0 N--CA 1.45 -0.469 0 C-N-CA 125.524 1.53 . . . . 174.16 109.261 -178.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 551' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -61.24 152.91 68.84 Favored 'Trans proline' 0 C--O 1.248 0.987 0 CA-C-N 119.009 0.682 . . . . 137.87 110.769 178.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -69.53 153.88 69.38 Favored 'Trans proline' 0 C--O 1.244 0.784 0 N-CA-C 110.686 -0.544 . . . . 129.49 110.686 -178.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 553' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -68.23 160.1 50.34 Favored 'Trans proline' 0 C--N 1.33 -0.406 0 CA-C-O 122.165 0.819 . . . . 133.58 111.281 -179.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -75.68 139.71 42.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.802 -1.09 . . . . 168.14 109.63 179.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 555' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -87.07 70.16 10.22 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 122.586 1.184 . . . . 164.63 109.286 176.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 556' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 114.596 -1.184 . . . . 184.97 109.99 173.603 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 571' ' ' LYS . . . . . 0.424 ' HB2' ' HE2' ' B' ' 571' ' ' LYS . 1.6 mppt? . . . . . 0 C--O 1.232 0.17 0 CA-C-O 121.005 0.431 . . . . 193.83 110.808 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 572' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -79.36 170.99 13.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.711 -0.677 . . . . 185.15 109.49 176.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 573' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -60.76 -38.46 70.71 Favored 'Trans proline' 0 C--O 1.236 0.379 0 N-CA-C 113.798 0.653 . . . . 167.87 113.798 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 574' ' ' LEU . . . . . 0.409 ' HA ' ' NZ ' ' B' ' 577' ' ' LYS . 37.5 tp -60.18 -41.52 93.09 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.016 -0.673 . . . . 156.71 111.229 179.971 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 575' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -69.12 -33.07 72.88 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.308 -0.557 . . . . 126.55 111.541 173.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -63.05 -51.42 66.81 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.67 -0.412 . . . . 118.57 111.275 -175.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 577' ' ' LYS . . . . . 0.409 ' NZ ' ' HA ' ' B' ' 574' ' ' LEU . 3.6 pttp -70.57 -31.43 68.46 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 119.179 -1.008 . . . . 156.2 111.329 177.951 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 578' ' ' MET . . . . . . . . . . . . . 10.0 tpp -63.55 -42.28 98.38 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.232 -0.587 . . . . 133.74 110.986 173.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 579' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -61.4 -44.66 96.76 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.641 -0.824 . . . . 141.91 110.565 172.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 580' ' ' GLU . . . . . 0.654 ' HA ' ' HD3' ' B' ' 584' ' ' ARG . 10.9 tt0 -64.17 -36.04 82.74 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.618 -0.433 . . . . 148.58 111.458 -179.164 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 581' ' ' ARG . . . . . . . . . . . . . 6.9 mtp180 -79.88 -35.45 38.07 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.049 -0.66 . . . . 143.38 112.198 -174.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 582' ' ' PHE . . . . . 0.422 ' HB3' HD12 ' B' ' 587' ' ' ILE . 73.2 m-85 -132.77 -62.74 0.8 Allowed 'General case' 0 C--O 1.237 0.438 0 N-CA-C 113.704 1.001 . . . . 116.16 113.704 -169.26 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 583' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -52.47 -37.36 56.92 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.438 0.533 . . . . 112.89 112.438 -163.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 584' ' ' ARG . . . . . 0.654 ' HD3' ' HA ' ' B' ' 580' ' ' GLU . 1.7 ptm180 -62.59 -31.04 71.79 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 119.936 -0.706 . . . . 149.46 111.979 -173.423 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 585' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -82.67 2.98 30.86 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.85 0.685 . . . . 118.86 112.85 -178.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 586' ' ' GLY . . . . . . . . . . . . . . . 110.29 29.28 3.76 Favored Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 114.508 0.563 . . . . 109.07 114.508 172.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 587' ' ' ILE . . . . . 0.422 HD12 ' HB3' ' B' ' 582' ' ' PHE . 58.8 mt -102.79 110.86 30.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 107.913 -1.143 . . . . 102.04 107.913 176.633 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 588' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -58.08 124.7 71.42 Favored Pre-proline 0 C--O 1.241 0.65 0 N-CA-C 108.827 -0.805 . . . . 113.09 108.827 173.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 589' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -56.1 -27.75 66.56 Favored 'Trans proline' 0 C--O 1.238 0.497 0 N-CA-C 114.119 0.776 . . . . 108.56 114.119 -173.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 590' ' ' GLU . . . . . 0.51 ' HA ' ' HG3' ' B' ' 593' ' ' MET . 45.0 mp0 -62.76 -29.0 70.37 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 118.164 0.438 . . . . 99.88 111.763 178.539 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 591' ' ' TRP . . . . . . . . . . . . . 52.0 m0 -66.71 -18.66 65.49 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.545 0.572 . . . . 89.5 112.545 -176.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 592' ' ' MET . . . . . . . . . . . . . 6.3 mtp -101.03 0.68 38.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.151 0.432 . . . . 94.89 112.134 175.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 593' ' ' MET . . . . . 0.51 ' HG3' ' HA ' ' B' ' 590' ' ' GLU . 5.8 mtt -85.72 129.09 34.92 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 109.276 -0.638 . . . . 102.14 109.276 174.286 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 594' ' ' ILE . . . . . . . . . . . . . 14.7 mt -69.19 126.84 30.05 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 109.442 -0.577 . . . . 108.86 109.442 175.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 595' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -94.66 -50.54 5.13 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 116.342 -0.39 . . . . 96.27 111.155 172.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 69.3 mtp180 -145.5 147.4 32.11 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.666 -0.864 . . . . 146.82 108.666 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 597' ' ' ILE . . . . . . . . . . . . . 14.3 mt -100.48 117.66 46.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 106.595 -1.631 . . . . 99.61 106.595 164.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 598' ' ' LEU . . . . . . . . . . . . . 16.4 mt -92.26 -47.06 7.4 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.131 0.419 . . . . 93.45 112.131 -171.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 599' ' ' ASN . . . . . 0.548 ' ND2' ' O ' ' B' ' 600' ' ' HIS . 3.9 t30 -158.97 159.24 34.63 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.531 0.681 . . . . 155.07 109.477 176.239 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 600' ' ' HIS . . . . . 0.548 ' O ' ' ND2' ' B' ' 599' ' ' ASN . 42.2 p-80 -102.4 167.11 10.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.87 -1.059 . . . . 107.11 110.052 175.239 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 601' ' ' SER . . . . . . . . . . . . . 33.5 t -147.3 123.28 10.71 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.043 -1.095 . . . . 103.32 108.043 173.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 602' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -89.4 99.79 12.71 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 107.862 -1.162 . . . . 121.45 107.862 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 603' ' ' ASP . . . . . 0.461 ' OD2' ' N ' ' B' ' 604' ' ' LYS . 46.5 t0 -52.51 146.14 10.39 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.477 0.656 . . . . 175.88 110.483 178.026 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 604' ' ' LYS . . . . . 0.461 ' N ' ' OD2' ' B' ' 603' ' ' ASP . 20.8 mmtt -64.87 -25.88 68.09 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.625 -0.716 . . . . 159.6 111.411 178.221 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 605' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -66.94 -27.25 67.32 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.51 -0.476 . . . . 154.82 111.619 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 606' ' ' GLY . . . . . . . . . . . . . . . 122.64 -0.32 10.16 Favored Glycine 0 C--O 1.238 0.391 0 CA-C-O 119.031 -0.872 . . . . 135.29 114.597 -177.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 607' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -91.81 157.49 16.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 119.32 1.56 . . . . 139.42 110.062 177.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 608' ' ' VAL . . . . . 0.431 HG13 ' HB2' ' B' ' 627' ' ' ASP . 5.4 p -113.88 133.27 60.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 N-CA-C 108.357 -0.979 . . . . 110.92 108.357 175.473 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 609' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -116.0 152.2 33.99 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.573 -0.899 . . . . 109.26 108.573 173.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 610' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -120.94 122.74 40.83 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.454 -0.943 . . . . 93.98 108.454 178.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 611' ' ' LEU . . . . . . . . . . . . . 9.9 tp -78.1 111.61 14.19 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.392 -1.336 . . . . 98.85 107.392 172.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 612' ' ' ILE . . . . . 0.882 HD11 ' CE2' ' B' ' 614' ' ' TRP . 2.2 pp -107.06 165.8 4.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 109.04 -0.726 . . . . 120.38 109.04 -175.252 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 613' ' ' LYS . . . . . . . . . . . . . 9.2 tptp -115.5 128.54 56.07 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 107.847 -1.168 . . . . 101.1 107.847 169.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 614' ' ' TRP . . . . . 0.882 ' CE2' HD11 ' B' ' 612' ' ' ILE . 86.3 m95 -89.16 150.21 22.8 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.383 0.611 . . . . 112.34 110.557 -177.321 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 615' ' ' LYS . . . . . . . . . . . . . 18.3 mttt -68.98 137.99 54.17 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.535 -0.757 . . . . 113.93 110.344 177.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 616' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 59.35 28.23 17.52 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.553 0.741 . . . . 137.07 111.993 178.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 617' ' ' LEU . . . . . . . . . . . . . 19.7 mt -134.09 130.94 20.57 Favored Pre-proline 0 C--O 1.243 0.739 0 N-CA-C 105.869 -1.901 . . . . 99.15 105.869 175.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 618' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -67.61 172.16 10.86 Favored 'Trans proline' 0 C--N 1.328 -0.525 0 CA-C-O 122.254 0.856 . . . . 79.75 111.592 -174.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 619' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -68.31 -36.84 79.91 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 114.815 -1.084 . . . . 124.02 111.712 -173.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 620' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' B' ' 620' ' ' ASP . 9.6 p-10 -59.3 -16.56 22.68 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 119.912 -0.715 . . . . 133.5 111.944 176.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 621' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -97.13 13.66 28.47 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 123.45 0.7 . . . . 156.38 112.595 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 622' ' ' CYS . . . . . . . . . . . . . 84.3 m -65.31 145.13 56.6 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.266 0.555 . . . . 88.59 110.154 172.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 623' ' ' THR . . . . . . . . . . . . . 2.0 p -132.14 156.15 46.89 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.574 0.702 . . . . 83.15 109.945 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 624' ' ' TRP . . . . . . . . . . . . . 86.6 m95 -82.18 129.35 34.81 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.121 -0.945 . . . . 93.44 109.207 170.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 625' ' ' GLU . . . . . 0.531 ' OE1' ' NE2' ' B' ' 522' ' ' HIS . 3.2 tp10 -117.18 146.19 43.38 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.315 0.578 . . . . 130.13 110.338 -178.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 626' ' ' ILE . . . . . . . . . . . . . 36.9 pt -71.55 161.19 4.87 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 CA-C-O 122.26 1.028 . . . . 97.88 110.226 -177.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 627' ' ' ASP . . . . . 0.431 ' HB2' HG13 ' B' ' 608' ' ' VAL . 39.0 t70 -70.35 -46.01 65.0 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.204 -0.907 . . . . 120.18 111.174 -179.405 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 628' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -99.33 78.87 2.25 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 122.135 0.969 . . . . 126.0 110.019 -168.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 629' ' ' ILE . . . . . . . . . . . . . 5.8 tp -149.81 133.06 7.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 107.889 -1.152 . . . . 136.91 107.889 168.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 630' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -82.94 85.07 7.21 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.87 0.843 . . . . 151.92 109.468 -170.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 631' ' ' ILE . . . . . . . . . . . . . 51.4 mt -99.48 139.21 20.73 Favored Pre-proline 0 C--O 1.241 0.64 0 N-CA-C 107.661 -1.237 . . . . 104.16 107.661 172.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 632' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.81 137.67 79.29 Favored 'Trans proline' 0 C--O 1.234 0.303 0 CA-C-N 119.205 0.752 . . . . 103.55 111.263 177.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 633' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 63.15 11.89 5.63 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 125.301 1.44 . . . . 107.07 113.403 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 634' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -65.01 -45.55 85.1 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.652 -0.819 . . . . 109.81 111.223 -176.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 635' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -76.5 -28.71 56.52 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.759 -0.777 . . . . 163.12 111.791 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 636' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -58.22 -56.24 24.66 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.27 -0.572 . . . . 114.87 110.23 171.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 637' ' ' LEU . . . . . . . . . . . . . 59.8 mt -67.86 -30.2 69.52 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.635 -0.426 . . . . 97.94 111.735 -179.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 638' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -58.51 -50.76 72.59 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 119.983 -0.687 . . . . 94.9 110.631 171.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 639' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -65.07 -33.63 76.49 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.186 -0.605 . . . . 117.05 111.797 -179.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 640' ' ' ALA . . . . . . . . . . . . . . . -69.02 -42.01 76.95 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.557 -0.457 . . . . 90.78 111.138 177.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 641' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -61.46 -48.71 79.89 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.879 0.371 . . . . 121.19 110.746 178.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 642' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -65.78 -34.07 77.31 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.479 -0.488 . . . . 110.48 111.652 176.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 643' ' ' GLY . . . . . . . . . . . . . . . -57.74 -57.21 21.01 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 121.098 -0.572 . . . . 97.33 112.263 176.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 644' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -59.65 -35.48 74.49 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.553 -0.459 . . . . 157.43 110.93 177.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 645' ' ' ARG . . . . . . . . . . . . . 36.1 ttt-85 -61.78 -30.7 70.97 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.237 -0.585 . . . . 124.95 111.664 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 646' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -70.86 -35.14 72.26 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.023 -0.671 . . . . 120.25 111.001 171.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 647' ' ' LEU . . . . . . . . . . . . . 7.5 mt -60.95 -27.09 67.99 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 111.932 0.345 . . . . 130.07 111.932 -175.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 648' ' ' MET . . . . . . . . . . . . . 2.3 mtm -87.81 25.28 1.55 Allowed 'General case' 0 C--O 1.239 0.512 0 N-CA-C 112.485 0.55 . . . . 186.51 112.485 171.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 649' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 C--N 1.331 -0.208 0 C-N-CA 123.121 0.568 . . . . 163.3 111.948 176.346 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . 0.902 'ZN ' ' HG ' ' B' ' 434' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_