data_6qpi_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 6qpi _Structure_validation_residue.Date_analyzed 2019-03-06 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 ' 295' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.457 0 N-CA-C 110.636 -0.135 . . . . 48.94 110.636 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 296' ' ' ILE . . . . . . . . . . . . . . . -77.84 -34.18 19.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-O 121.038 0.447 . . . . 45.57 110.978 -178.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 297' ' ' GLY . . . . . . . . . . . . . . . -79.57 -45.47 8.59 Favored Glycine 0 C--N 1.334 0.434 0 C-N-CA 120.336 -0.935 . . . . 47.04 114.146 -172.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 298' ' ' ILE . . . . . . . . . . . . . . . -67.3 -31.68 54.06 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.427 0 O-C-N 122.095 -0.65 . . . . 45.88 110.057 176.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . . . -66.75 -33.79 76.4 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 119.949 -0.701 . . . . 43.67 111.089 169.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 300' ' ' PHE . . . . . . . . . . . . . . . -68.15 -45.35 73.8 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 120.338 -0.545 . . . . 42.57 111.187 178.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' ALA . . . . . . . . . . . . . . . -72.86 -21.18 60.97 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 121.614 -0.679 . . . . 43.76 111.324 175.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' TRP . . . . . . . . . . . . . . . -72.33 -37.05 68.98 Favored 'General case' 0 CA--C 1.514 -0.436 0 O-C-N 121.63 -0.669 . . . . 41.67 110.619 173.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' LEU . . . . . . . . . . . . . . . -63.61 -34.77 78.56 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 119.99 -0.684 . . . . 39.97 109.891 167.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' GLY . . . . . . . . . . . . . . . -65.9 -41.6 95.36 Favored Glycine 0 C--O 1.224 -0.474 0 C-N-CA 120.713 -0.756 . . . . 38.46 113.949 175.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' TYR . . . . . . . . . . . . . . . -73.74 -39.47 64.23 Favored 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 121.797 -0.825 . . . . 36.8 110.8 -177.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' TYR . . . . . . . . . . . . . . . -65.75 -33.45 75.9 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 119.423 -0.911 . . . . 37.18 110.552 172.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' THR . . . . . . . . . . . . . . . -69.76 -37.04 76.26 Favored 'General case' 0 C--O 1.233 0.19 0 O-C-N 121.972 -0.455 . . . . 36.45 111.646 176.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' GLN . . . . . . . . . . . . . . . -71.51 -47.82 52.93 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 121.679 -0.638 . . . . 35.98 111.953 177.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' MET . . . . . . . . . . . . . . . -65.67 -34.44 78.21 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.206 -0.597 . . . . 34.62 111.19 177.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' LEU . . . . . . . . . . . . . . . -68.14 -31.35 70.87 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.383 -0.527 . . . . 34.35 110.737 174.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . . . -71.96 -39.64 69.23 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.806 -0.559 . . . . 35.18 112.423 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' LEU . . . . . . . . . . . . . . . -72.1 -44.31 63.43 Favored 'General case' 0 C--O 1.242 0.694 0 O-C-N 120.971 -1.081 . . . . 34.35 111.008 -179.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -64.67 -23.48 67.27 Favored 'General case' 0 CA--C 1.518 -0.278 0 O-C-N 122.23 -0.294 . . . . 32.32 110.992 171.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' ALA . . . . . . . . . . . . . . . -72.92 -31.59 64.74 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 112.218 0.451 . . . . 32.05 112.218 173.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' VAL . . . . . . . . . . . . . . . -69.01 -42.97 82.29 Favored 'Isoleucine or valine' 0 C--O 1.241 0.654 0 C-N-CA 120.188 -0.605 . . . . 34.13 110.217 174.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' VAL . . . . . . . . . . . . . . . -62.49 -40.74 89.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 CA-C-O 120.988 0.423 . . . . 31.46 110.613 174.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' GLY . . . . . . . . . . . . . . . -68.56 -34.86 79.81 Favored Glycine 0 C--O 1.225 -0.452 0 C-N-CA 120.831 -0.7 . . . . 30.52 113.51 177.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' VAL . . . . . . . . . . . . . . . -67.96 -36.0 73.99 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-N 117.358 0.579 . . . . 31.17 110.638 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' ALA . . . . . . . . . . . . . . . -63.46 -45.61 90.0 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 120.481 -0.488 . . . . 30.17 111.258 175.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' CYS . . . . . . . . . . . . . . . -70.72 -19.52 62.74 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 119.265 -0.974 . . . . 29.94 111.794 175.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' PHE . . . . . . . . . . . . . . . -76.03 -31.19 58.75 Favored 'General case' 0 C--O 1.237 0.442 0 O-C-N 121.994 -0.441 . . . . 29.65 112.105 176.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' LEU . . . . . . . . . . . . . . . -61.96 -36.76 82.37 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.369 -0.532 . . . . 31.71 110.708 172.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.845 0 CA-C-O 121.011 0.434 . . . . 30.42 109.846 166.632 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.57 0 N-CA-C 109.343 -0.614 . . . . 81.91 109.343 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 378' ' ' GLY . . . . . . . . . . . . . . . -72.13 -34.5 61.4 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.081 -1.057 . . . . 80.64 111.938 173.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 379' ' ' THR . . . . . . . . . . . . . . . -66.37 -40.66 89.87 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 122.283 -0.539 . . . . 78.13 110.967 172.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 380' ' ' LEU . . . . . . . . . . . . . . . -71.55 -30.85 66.35 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 121.011 -0.276 . . . . 79.8 111.41 174.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 381' ' ' ILE . . . . . . . . . . . . . . . -63.81 -41.5 92.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 119.879 -0.729 . . . . 78.57 110.034 171.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . . . -63.13 -34.12 76.94 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 116.698 -0.228 . . . . 78.89 111.177 172.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 383' ' ' ALA . . . . . . . . . . . . . . . -72.89 -49.3 30.64 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 120.94 -0.304 . . . . 78.94 111.272 -175.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . . . -66.1 -33.53 64.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 C-N-CA 120.421 -0.511 . . . . 80.52 110.188 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 385' ' ' PHE . . . . . . . . . . . . . . . -63.85 -35.24 79.97 Favored 'General case' 0 CA--C 1.519 -0.237 0 O-C-N 122.264 -0.273 . . . . 81.26 111.02 171.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 386' ' ' MET . . . . . . . . . . . . . . . -74.94 -29.25 60.88 Favored 'General case' 0 CA--C 1.515 -0.38 0 O-C-N 122.018 -0.426 . . . . 82.7 110.902 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . -65.21 -46.31 88.06 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.118 -1.039 . . . . 84.17 111.288 171.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . . . -63.61 -31.1 51.69 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.074 0 C-N-CA 120.904 -0.318 . . . . 84.86 110.589 172.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 389' ' ' TRP . . . . . . . . . . . . . . . -75.64 -35.49 60.42 Favored 'General case' 0 CA--C 1.514 -0.424 0 O-C-N 121.937 -0.477 . . . . 85.62 111.15 -177.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . . . -65.48 -40.71 89.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.398 -0.593 . . . . 85.39 109.398 174.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 391' ' ' THR . . . . . . . . . . . . . . . -64.47 -47.29 79.56 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-O 120.888 0.375 . . . . 85.95 111.714 176.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 392' ' ' LEU . . . . . . . . . . . . . . . -68.42 -32.07 71.84 Favored 'General case' 0 C--O 1.234 0.289 0 O-C-N 122.261 -0.275 . . . . 90.55 111.507 179.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . . . -66.44 -45.11 80.9 Favored 'General case' 0 CA--C 1.514 -0.418 0 O-C-N 122.276 -0.265 . . . . 92.57 110.785 177.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 394' ' ' LEU . . . . . . . . . . . . . . . -62.31 -38.55 89.85 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 120.851 -0.34 . . . . 91.11 111.426 174.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . . . -66.17 -52.86 44.15 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 112.047 0.388 . . . . 94.29 112.047 179.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 396' ' ' PHE . . . . . . . . . . . . . . . -69.49 -32.5 71.41 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 120.646 -0.422 . . . . 96.1 111.562 -177.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 397' ' ' TRP . . . . . . . . . . . . . . . -66.92 -34.37 77.62 Favored 'General case' 0 CA--C 1.518 -0.284 0 C-N-CA 120.586 -0.446 . . . . 97.13 110.588 174.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . . . -65.12 -38.55 91.04 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.376 -0.53 . . . . 97.95 111.151 172.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 399' ' ' ARG . . . . . . . . . . . . . . . -66.69 -46.12 76.61 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 120.431 -0.507 . . . . 98.66 111.911 -179.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . . . -68.88 -29.98 68.39 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.55 -0.46 . . . . 100.03 110.92 178.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' GLN . . . . . . . . . . . . . . . -62.01 -40.78 96.83 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 120.655 0.264 . . . . 101.91 110.978 172.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' ALA . . . . . . . . . . . . . . . -66.39 -44.03 84.2 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.815 -0.354 . . . . 100.83 111.477 176.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . . . -70.6 -31.31 68.25 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 112.418 0.525 . . . . 101.16 112.418 -175.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . . . -77.26 -44.81 28.5 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.049 0.759 . . . . 102.17 113.049 -163.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 405' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.281 0 O-C-N 121.896 -0.502 . . . . 100.82 112.344 -173.775 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.069 0 CA-C-O 120.937 0.399 . . . . 97.8 110.912 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 456' ' ' CYS . . . . . . . . . . . . . . . -68.36 -25.03 64.88 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.843 -0.617 . . . . 99.87 111.158 168.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 457' ' ' ALA . . . . . . . . . . . . . . . -66.19 -39.38 89.64 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 111.758 0.281 . . . . 101.63 111.758 178.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . . . -66.51 -36.19 82.09 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.431 -0.508 . . . . 98.9 110.994 175.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 459' ' ' ALA . . . . . . . . . . . . . . . -64.02 -34.1 77.24 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 120.897 -0.321 . . . . 97.95 111.109 172.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 460' ' ' VAL . . . . . . . . . . . . . . . -67.6 -43.36 87.01 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 CA-C-O 120.8 0.333 . . . . 97.29 110.526 178.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . . . -67.6 -34.19 76.51 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.345 -0.542 . . . . 97.39 111.415 178.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 462' ' ' PHE . . . . . . . . . . . . . . . -68.79 -39.83 79.95 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.587 -0.445 . . . . 99.0 111.474 175.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 463' ' ' TRP . . . . . . . . . . . . . . . -65.53 -29.15 69.75 Favored 'General case' 0 CA--C 1.517 -0.317 0 O-C-N 122.208 -0.308 . . . . 96.1 111.301 173.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . . . -69.9 -39.22 77.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 CA-C-O 121.497 0.665 . . . . 98.6 110.609 175.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . . . -63.88 -42.7 97.42 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 121.961 -0.462 . . . . 94.35 111.096 174.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . . . -65.76 -29.14 69.6 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 120.854 -0.339 . . . . 94.63 111.221 174.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . . . -65.92 -38.74 82.81 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.389 0 N-CA-C 109.924 -0.399 . . . . 93.13 109.924 174.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . . . -66.05 -35.25 74.59 Favored 'Isoleucine or valine' 0 C--O 1.241 0.641 0 CA-C-O 121.013 0.435 . . . . 92.6 110.382 174.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -68.07 -38.98 83.03 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.478 -0.328 . . . . 91.84 111.532 178.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . . . -69.29 -30.54 68.65 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.458 -0.497 . . . . 89.07 110.593 172.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . . . -68.13 -34.45 66.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 C-N-CA 122.851 0.46 . . . . 86.6 110.986 -178.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . . . -61.66 -29.6 46.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 121.008 0.432 . . . . 89.79 110.897 173.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.774 0 N-CA-C 111.253 -0.739 . . . . 88.47 111.253 169.131 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.405 0 N-CA-C 109.315 -0.624 . . . . 65.87 109.315 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' THR . . . . . . . . . . . . . . . -68.12 -28.7 67.55 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.033 -0.53 . . . . 64.79 110.961 170.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.74 88.46 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 111.738 0.273 . . . . 64.6 111.738 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . . . -67.86 -29.62 68.79 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.125 -0.63 . . . . 63.51 111.153 174.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 515' ' ' ILE . . . . . . . . . . . . . . . -69.55 -42.6 80.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 C-N-CA 120.413 -0.515 . . . . 62.8 110.81 176.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 516' ' ' ILE . . . . . . . . . . . . . . . -67.82 -36.48 75.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 O-C-N 121.885 -0.509 . . . . 63.91 110.692 176.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . . . -67.16 -37.65 84.12 Favored 'General case' 0 CA--C 1.515 -0.395 0 O-C-N 122.075 -0.391 . . . . 62.91 111.231 176.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 518' ' ' PHE . . . . . . . . . . . . . . . -68.41 -33.14 73.69 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 120.514 -0.474 . . . . 65.07 110.908 175.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 519' ' ' ILE . . . . . . . . . . . . . . . -67.18 -51.09 57.19 Favored 'Isoleucine or valine' 0 C--O 1.24 0.603 0 C-N-CA 120.508 -0.477 . . . . 62.61 110.81 178.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 520' ' ' ILE . . . . . . . . . . . . . . . -68.45 -32.02 53.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 C-N-CA 120.647 -0.421 . . . . 65.34 110.834 179.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . . . -70.71 -31.32 45.59 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 O-C-N 121.734 -0.604 . . . . 65.53 109.879 177.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . . . -66.64 -48.75 68.41 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.074 0.464 . . . . 67.39 111.268 174.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . . . -64.08 -43.23 97.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 C-N-CA 120.608 -0.437 . . . . 69.02 110.96 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . . . -67.55 -29.62 69.05 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 121.946 -0.471 . . . . 68.81 111.579 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 525' ' ' ASN . . . . . . . . . . . . . . . -68.39 -40.35 81.38 Favored 'General case' 0 CA--C 1.51 -0.573 0 O-C-N 122.257 -0.277 . . . . 68.62 111.005 175.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 526' ' ' THR . . . . . . . . . . . . . . . -66.62 -42.96 85.99 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.042 -0.663 . . . . 72.59 111.352 176.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . . . -65.03 -38.52 82.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-O 120.787 0.327 . . . . 71.72 111.042 177.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . . . -72.68 -35.5 67.69 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 121.756 -0.59 . . . . 73.47 111.235 -179.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 529' ' ' GLU . . . . . . . . . . . . . . . -67.76 -33.97 75.89 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.837 -0.345 . . . . 74.73 110.958 174.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . . . -69.01 -33.26 73.36 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 119.822 -0.751 . . . . 74.6 110.977 171.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . . . -65.51 -27.91 42.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 120.815 0.34 . . . . 74.84 110.466 179.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 532' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.627 0 CA-C-O 121.777 0.798 . . . . 72.72 110.252 173.099 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 556' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 121.386 0.613 . . . . 28.28 110.21 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . . . -63.76 -30.42 71.52 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 119.792 -0.763 . . . . 30.52 110.281 158.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . . . . -66.97 -42.67 84.76 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 120.716 -0.394 . . . . 30.11 111.546 171.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 559' ' ' GLN . . . . . . . . . . . . . . . -70.52 -41.27 72.8 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.663 -0.415 . . . . 33.41 111.547 -177.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 560' ' ' PHE . . . . . . . . . . . . . . . -62.97 -35.64 80.86 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 120.854 -0.339 . . . . 31.65 111.008 172.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 561' ' ' VAL . . . . . 0.503 ' O ' ' CB ' ' A' ' 565' ' ' SER . . . -62.65 -45.23 99.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 C-N-CA 120.747 -0.381 . . . . 32.8 110.715 175.285 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 562' ' ' ASN . . . . . . . . . . . . . . . -67.7 -41.46 83.56 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 122.094 -0.379 . . . . 33.25 111.613 -177.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . . . -74.22 -55.74 5.7 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 120.399 -0.52 . . . . 33.33 111.701 -178.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 564' ' ' TYR . . . . . . . . . . . . . . . -76.76 -15.51 59.74 Favored 'General case' 0 C--O 1.235 0.294 0 O-C-N 121.868 -0.52 . . . . 31.69 112.193 -172.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 565' ' ' SER . . . . . 0.503 ' CB ' ' O ' ' A' ' 561' ' ' VAL . . . -64.74 -35.87 82.45 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 112.6 0.593 . . . . 34.06 112.6 -174.521 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 566' ' ' SER . . . . . . . . . . . . . . . -67.64 -39.93 84.62 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.274 -0.57 . . . . 34.64 111.378 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . . . -69.96 -47.7 61.26 Favored 'General case' 0 C--O 1.241 0.633 0 O-C-N 122.154 -0.341 . . . . 33.18 111.321 -179.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 568' ' ' PHE . . . . . . . . . . . . . . . -64.96 -28.4 69.49 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 120.632 -0.427 . . . . 32.38 111.123 174.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 569' ' ' TYR . . . . . . . . . . . . . . . -69.07 -35.4 76.49 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 121.95 -0.469 . . . . 36.7 111.323 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . . . -66.21 -48.97 79.5 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 C-N-CA 120.331 -0.547 . . . . 35.81 109.689 174.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -63.8 -25.94 68.4 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.776 -0.647 . . . . 36.65 112.43 -177.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 572' ' ' PHE . . . . . . . . . . . . . . . -86.28 -23.02 26.49 Favored 'General case' 0 C--O 1.233 0.209 0 O-C-N 121.78 -0.575 . . . . 35.87 111.832 167.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 573' ' ' PHE . . . . . . . . . . . . . . . -74.84 -37.21 62.31 Favored 'General case' 0 CA--C 1.509 -0.629 0 O-C-N 122.224 -0.297 . . . . 37.87 111.606 -167.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 574' ' ' LYS . . . . . . . . . . . . . . . -66.29 -29.96 70.29 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 118.173 -1.411 . . . . 37.77 110.838 168.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.447 0 N-CA-C 118.034 1.973 . . . . 37.64 118.034 -178.354 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 604' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' A' ' 608' ' ' GLN . . . . . . . . 0 C--O 1.214 -0.793 0 N-CA-C 109.458 -0.571 . . . . 28.09 109.458 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 605' ' ' LEU . . . . . 0.428 ' O ' ' CB ' ' A' ' 609' ' ' LEU . . . -62.64 -30.92 71.72 Favored 'General case' 0 CA--C 1.513 -0.463 0 O-C-N 124.194 0.934 . . . . 29.46 111.188 -176.666 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 606' ' ' THR . . . . . . . . . . . . . . . -62.86 -52.08 64.51 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 120.076 -0.65 . . . . 29.19 110.695 169.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . . . -72.25 -42.39 65.69 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 120.6 -0.44 . . . . 29.27 111.82 -177.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 608' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 604' ' ' GLU . . . -69.12 -40.03 78.56 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 120.387 -0.525 . . . . 30.23 111.259 179.991 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 609' ' ' LEU . . . . . 0.428 ' CB ' ' O ' ' A' ' 605' ' ' LEU . . . -65.69 -40.29 92.17 Favored 'General case' 0 CA--C 1.516 -0.344 0 O-C-N 122.03 -0.419 . . . . 31.47 111.289 175.806 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . . . -68.9 -42.62 76.63 Favored 'General case' 0 CA--C 1.517 -0.322 0 O-C-N 122.311 -0.243 . . . . 32.79 111.378 179.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 611' ' ' ILE . . . . . . . . . . . . . . . -74.51 -33.76 33.68 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.381 0 O-C-N 122.073 -0.392 . . . . 34.45 111.164 -178.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 612' ' ' ILE . . . . . . . . . . . . . . . -69.77 -43.22 80.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 O-C-N 121.394 -0.816 . . . . 36.44 110.347 175.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 613' ' ' MET . . . . . . . . . . . . . . . -66.74 -48.84 67.9 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 121.959 -0.463 . . . . 37.84 111.123 177.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 614' ' ' GLY . . . . . . . . . . . . . . . -66.04 -36.37 91.88 Favored Glycine 0 C--O 1.221 -0.657 0 C-N-CA 121.095 -0.574 . . . . 40.79 113.195 178.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . -72.39 -36.49 59.36 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.078 -1.058 . . . . 42.64 112.416 179.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 616' ' ' LYS . . . . . . . . . . . . . . . -66.26 -32.14 73.37 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 119.312 -0.955 . . . . 43.14 110.382 171.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -67.76 -46.43 72.07 Favored 'General case' 0 C--O 1.231 0.123 0 N-CA-C 112.076 0.399 . . . . 45.8 112.076 175.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . . . -71.2 -36.1 60.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 O-C-N 122.067 -0.395 . . . . 48.24 110.6 -178.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 619' ' ' TRP . . . . . . . . . . . . . . . -69.32 -36.3 76.83 Favored 'General case' 0 CA--C 1.516 -0.343 0 O-C-N 121.583 -0.698 . . . . 50.6 111.038 175.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 620' ' ' ASN . . . . . . . . . . . . . . . -67.3 -32.96 74.3 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.421 -0.512 . . . . 51.24 111.266 173.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 621' ' ' ASN . . . . . . . . . . . . . . . -70.49 -37.49 74.21 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.412 -0.515 . . . . 54.23 111.491 176.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 622' ' ' ILE . . . . . . . . . . . . . . . -65.12 -36.13 77.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 120.88 0.372 . . . . 55.25 110.518 174.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 623' ' ' GLN . . . . . . . . . . . . . . . -68.21 -33.66 74.83 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 121.902 -0.499 . . . . 55.99 111.593 173.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 624' ' ' GLU . . . . . . . . . . . . . . . -68.69 -34.17 75.21 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 122.243 -0.286 . . . . 54.75 111.547 177.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 625' ' ' VAL . . . . . . . . . . . . . . . -73.07 -41.11 59.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.072 -0.651 . . . . 57.69 110.573 174.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . . . -90.06 2.54 55.11 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.872 1.064 . . . . 59.08 113.872 -172.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 627' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 118.682 0.674 . . . . 60.33 111.347 177.444 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 665' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.622 0 N-CA-C 110.178 -0.304 . . . . 44.77 110.178 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 666' ' ' TYR . . . . . . . . . . . . . . . -64.31 -32.46 74.07 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.293 -0.563 . . . . 44.88 110.856 175.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 667' ' ' GLU . . . . . . . . . . . . . . . -67.62 -43.92 79.25 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 116.716 -0.22 . . . . 44.41 111.488 176.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 668' ' ' TYR . . . . . . . . . . . . . . . -69.22 -26.62 64.9 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 120.459 -0.496 . . . . 40.7 110.678 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . . . -64.12 -42.6 96.8 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.444 -0.502 . . . . 40.89 111.098 170.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . . . -66.91 -42.77 84.86 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.19 -0.604 . . . . 40.64 111.372 179.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 671' ' ' MET . . . . . . . . . . . . . . . -70.18 -30.29 67.39 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 119.741 -0.784 . . . . 40.85 111.596 179.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 672' ' ' ILE . . . . . . . . . . . . . . . -72.89 -32.58 40.59 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 C-N-CA 120.151 -0.62 . . . . 41.07 110.04 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . . . -64.32 -35.61 74.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 120.106 -0.638 . . . . 41.18 109.994 170.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 674' ' ' GLN . . . . . . . . . . . . . . . -69.72 -34.62 74.13 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 119.869 -0.732 . . . . 42.25 111.577 175.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 675' ' ' PHE . . . . . . . . . . . . . . . -69.08 -34.53 75.28 Favored 'General case' 0 CA--C 1.509 -0.605 0 O-C-N 121.758 -0.589 . . . . 39.21 110.756 176.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 676' ' ' GLY . . . . . . . . . . . . . . . -64.65 -36.0 92.61 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 119.794 -1.193 . . . . 37.36 111.83 170.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 677' ' ' PHE . . . . . . . . . . . . . . . -63.11 -49.57 73.88 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 120.608 -0.437 . . . . 36.64 111.375 175.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 678' ' ' VAL . . . . . . . . . . . . . . . -70.0 -49.44 56.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.757 0.313 . . . . 37.12 110.362 -176.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 679' ' ' THR . . . . . . . . . . . . . . . -77.2 -44.53 29.75 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.695 0.628 . . . . 36.4 112.695 -173.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 680' ' ' LEU . . . . . . . . . . . . . . . -75.03 -34.92 61.93 Favored 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 121.427 -0.796 . . . . 37.37 111.707 -175.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 681' ' ' PHE . . . . . . . . . . . . . . . -111.57 29.58 7.71 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.664 0.616 . . . . 39.74 112.664 -175.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 682' ' ' VAL . . . . . . . . . . . . . . . -59.24 -28.06 38.23 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 C-N-CA 125.312 1.445 . . . . 39.88 112.484 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 683' ' ' ALA . . . . . . . . . . . . . . . -72.89 -17.37 61.52 Favored 'General case' 0 C--N 1.318 -0.761 0 C-N-CA 118.187 -1.405 . . . . 41.1 112.956 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 684' ' ' SER . . . . . . . . . . . . . . . -74.27 -75.01 0.17 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-N 118.949 0.795 . . . . 35.44 111.579 -175.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . . . -122.23 131.24 24.43 Favored Pre-proline 0 N--CA 1.438 -1.049 0 N-CA-C 103.588 -2.745 . . . . 39.22 103.588 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 686' ' ' PRO . . . . . . . . . . . . . . . -88.66 -17.32 2.22 Favored 'Trans proline' 0 C--O 1.238 0.511 0 N-CA-C 114.165 0.794 . . . . 38.93 114.165 -173.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . . . -80.0 3.64 19.48 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 119.266 0.939 . . . . 37.97 112.75 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -68.54 -20.3 0.52 Allowed Pre-proline 0 C--O 1.264 1.825 0 CA-C-O 117.922 -1.037 . . . . 37.68 112.84 -173.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 689' ' ' PRO . . . . . . . . . . . . . . . -67.63 -46.35 2.73 Favored 'Trans proline' 0 C--O 1.243 0.758 0 CA-C-N 122.169 1.81 . . . . 36.22 113.763 -176.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . . . -59.22 -41.12 87.92 Favored 'General case' 0 C--N 1.349 0.546 0 O-C-N 123.302 0.376 . . . . 36.61 111.659 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . . . -61.23 -20.77 63.19 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.368 0.667 . . . . 40.13 112.074 -177.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 692' ' ' ALA . . . . . . . . . . . . . . . -72.75 -62.83 1.31 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 118.01 -1.476 . . . . 43.27 111.209 171.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . . . -67.74 -35.37 78.62 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 120.638 0.256 . . . . 42.6 111.347 -159.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 694' ' ' VAL . . . . . . . . . . . . . . . -55.54 -49.49 73.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 C-N-CA 123.303 0.641 . . . . 44.28 110.127 176.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 695' ' ' ASN . . . . . . . . . . . . . . . -62.37 -40.19 95.63 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 116.4 -0.364 . . . . 45.04 110.916 176.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 696' ' ' ASN . . . . . . . . . . . . . . . -63.18 -32.21 73.55 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.242 -0.436 . . . . 45.7 111.464 -178.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . . . -68.73 -30.07 45.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 C-N-CA 118.864 -1.134 . . . . 43.83 109.91 -175.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 698' ' ' LEU . . . . . . . . . . . . . . . -67.4 -24.58 65.69 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 120.572 -0.451 . . . . 44.29 111.773 175.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . . . -62.29 -31.83 72.48 Favored 'General case' 0 C--N 1.344 0.333 0 O-C-N 122.422 -0.174 . . . . 44.68 111.366 174.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 700' ' ' ILE . . . . . . . . . . . . . . . -61.86 -35.58 68.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 C-N-CA 120.348 -0.541 . . . . 42.54 109.923 173.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 701' ' ' ARG . . . . . . . . . . . . . . . -60.84 -36.13 78.31 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 116.232 -0.44 . . . . 44.65 111.931 174.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 702' ' ' VAL . . . . . . . . . . . . . . . -66.41 -33.68 65.1 Favored 'Isoleucine or valine' 0 C--N 1.345 0.385 0 C-N-CA 120.398 -0.521 . . . . 42.08 110.336 177.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 703' ' ' ASP . . . . . . . . . . . . . . . -69.14 -29.8 67.92 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 119.456 -0.898 . . . . 43.13 110.387 172.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 704' ' ' ALA . . . . . . . . . . . . . . . -78.34 -23.78 46.83 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 112.445 0.535 . . . . 41.31 112.445 -174.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 705' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.254 0 N-CA-C 113.122 0.786 . . . . 40.67 113.122 -174.781 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 726' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 730' ' ' GLN . . . . . . . . 0 C--O 1.219 -0.509 0 N-CA-C 110.369 -0.234 . . . . 34.41 110.369 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 727' ' ' PRO . . . . . . . . . . . . . . . -68.38 -42.68 5.13 Favored 'Trans proline' 0 C--O 1.237 0.425 0 O-C-N 123.247 1.13 . . . . 33.34 113.835 -176.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 728' ' ' ILE . . . . . . . . . . . . . . . -66.84 -33.39 63.12 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 C-N-CA 120.012 -0.675 . . . . 33.44 110.113 171.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 729' ' ' MET . . . . . . . . . . . . . . . -71.7 -43.67 65.53 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 120.138 -0.625 . . . . 33.64 111.87 179.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 730' ' ' GLN . . . . . 0.41 ' N ' ' O ' ' A' ' 726' ' ' GLN . . . -68.41 -29.81 68.57 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 120.043 -0.663 . . . . 32.01 110.912 176.845 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 731' ' ' GLY . . . . . . . . . . . . . . . -65.51 -41.64 96.13 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 119.849 -1.167 . . . . 33.8 112.299 170.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 732' ' ' ILE . . . . . . . . . . . . . . . -65.93 -25.8 36.99 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 O-C-N 122.664 -0.315 . . . . 33.82 110.262 174.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 733' ' ' ALA . . . . . . . . . . . . . . . -77.96 -41.29 36.62 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.776 -0.577 . . . . 33.5 112.159 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 734' ' ' ILE . . . . . . . . . . . . . . . -68.74 -39.64 80.46 Favored 'Isoleucine or valine' 0 C--O 1.241 0.63 0 C-N-CA 119.784 -0.767 . . . . 32.45 110.153 175.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . . . -65.45 -27.02 68.21 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 116.411 -0.358 . . . . 34.19 111.101 171.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 736' ' ' ALA . . . . . . . . . . . . . . . -75.7 -32.57 60.14 Favored 'General case' 0 CA--C 1.512 -0.508 0 O-C-N 122.09 -0.381 . . . . 33.76 111.686 176.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 737' ' ' VAL . . . . . . . . . . . . . . . -63.63 -49.69 81.25 Favored 'Isoleucine or valine' 0 C--O 1.242 0.692 0 C-N-CA 119.769 -0.772 . . . . 33.63 109.515 172.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 738' ' ' VAL . . . . . . . . . . . . . . . -63.64 -35.7 73.76 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.096 0 O-C-N 121.989 -0.444 . . . . 32.58 111.058 174.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 739' ' ' THR . . . . . . . . . . . . . . . -78.75 -37.69 40.57 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 121.756 -0.59 . . . . 31.63 111.374 -173.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 740' ' ' ASN . . . . . . . . . . . . . . . -73.53 -32.77 64.39 Favored 'General case' 0 CA--C 1.512 -0.491 0 O-C-N 121.824 -0.547 . . . . 30.32 110.385 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -65.85 -39.49 90.8 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 120.277 -0.569 . . . . 30.34 110.998 170.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . . . -74.82 -24.38 58.62 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.104 -0.638 . . . . 31.04 111.358 174.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 743' ' ' ILE . . . . . . . . . . . . . . . -73.52 -42.14 56.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 O-C-N 121.769 -0.582 . . . . 30.99 109.837 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . . . -67.06 -44.45 88.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 120.234 -0.586 . . . . 30.09 110.761 171.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 745' ' ' ALA . . . . . . . . . . . . . . . -76.41 -52.76 9.23 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 121.449 -0.782 . . . . 29.07 112.906 -172.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . . . -85.22 -52.15 6.12 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 121.177 -0.952 . . . . 31.01 110.692 -179.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 747' ' ' THR . . . . . . . . . . . . . . . -74.17 -41.12 61.98 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 118.061 -1.456 . . . . 32.2 112.644 -173.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 748' ' ' SER . . . . . . . . . . . . . . . -78.83 -36.24 42.84 Favored 'General case' 0 C--N 1.345 0.374 0 C-N-CA 118.155 -1.418 . . . . 31.53 114.016 -154.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 749' ' ' ASP . . . . . . . . . . . . . . . 52.08 52.45 14.36 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.903 0.881 . . . . 34.38 110.614 -159.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 750' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.742 0 C-N-CA 125.096 1.358 . . . . 36.8 111.641 176.638 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 829' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.532 0 CA-C-O 121.718 0.771 . . . . 15.59 110.352 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 830' ' ' HIS . . . . . . . . . . . . . . . -77.49 -29.61 52.66 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 114.482 -1.235 . . . . 15.68 113.093 -160.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . . . -71.53 -35.27 55.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 C-N-CA 119.998 -0.681 . . . . 17.61 111.435 -156.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 832' ' ' ILE . . . . . . . . . . . . . . . -64.15 -37.99 81.3 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 CA-C-O 121.369 0.604 . . . . 17.85 109.751 174.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 833' ' ' ALA . . . . . . . . . . . . . . . -69.96 -37.77 75.9 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 115.932 -0.576 . . . . 18.0 111.77 179.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 834' ' ' ALA . . . . . . . . . . . . . . . -76.18 -30.63 58.12 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.048 -0.661 . . . . 17.47 111.413 179.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 835' ' ' LYS . . . . . . . . . . . . . . . -64.51 -42.3 95.89 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 120.09 -0.644 . . . . 17.91 110.189 172.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 836' ' ' LEU . . . . . . . . . . . . . . . -66.75 -34.88 78.8 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.752 0.311 . . . . 19.33 111.012 175.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -73.14 -35.15 66.43 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 122.156 -0.34 . . . . 19.43 111.788 179.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 838' ' ' PHE . . . . . . . . . . . . . . . -70.11 -36.57 74.93 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 117.88 0.309 . . . . 19.9 110.551 175.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 839' ' ' ILE . . . . . . . . . . . . . . . -61.73 -39.7 84.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 C-N-CA 120.379 -0.528 . . . . 21.1 109.846 172.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 840' ' ' ILE . . . . . . . . . . . . . . . -70.09 -46.12 73.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.811 0.338 . . . . 22.07 111.031 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 841' ' ' VAL . . . . . . . . . . . . . . . -75.03 -39.87 44.49 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 O-C-N 121.882 -0.511 . . . . 23.45 110.963 -174.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 842' ' ' MET . . . . . . . . . . . . . . . -70.72 -37.48 73.52 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 121.756 -0.59 . . . . 23.51 110.999 177.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . . . -65.53 -36.35 83.56 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 120.257 -0.577 . . . . 24.55 111.093 172.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 844' ' ' HIS . . . . . . . . . . . . . . . -74.32 -41.21 61.5 Favored 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 112.065 0.395 . . . . 26.79 112.065 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 845' ' ' ILE . . . . . . . . . . . . . . . -73.93 -39.69 51.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 O-C-N 121.598 -0.689 . . . . 26.3 110.658 178.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 846' ' ' ILE . . . . . . . . . . . . . . . -75.2 -18.99 16.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.259 0 O-C-N 121.702 -0.624 . . . . 26.93 110.468 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 847' ' ' TYR . . . . . . . . . . . . . . . -84.48 -23.1 30.02 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.868 -0.52 . . . . 29.6 111.032 167.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 848' ' ' SER . . . . . . . . . . . . . . . -70.31 -43.64 69.92 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.159 -0.616 . . . . 29.96 110.691 174.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 849' ' ' VAL . . . . . . . . . . . . . . . -63.93 -34.13 66.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.84 0.352 . . . . 30.54 110.42 175.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 850' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.619 0 O-C-N 121.785 -0.572 . . . . 29.74 111.922 175.831 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 295' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.476 0 N-CA-C 110.628 -0.138 . . . . 47.56 110.628 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 296' ' ' ILE . . . . . . . . . . . . . . . -77.84 -34.21 19.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 120.95 0.405 . . . . 42.44 110.915 -178.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 297' ' ' GLY . . . . . . . . . . . . . . . -79.57 -45.38 8.66 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.349 -0.929 . . . . 42.09 114.113 -172.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . . . -67.45 -31.48 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.39 0 C-N-CA 120.103 -0.639 . . . . 40.76 110.077 176.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 299' ' ' TYR . . . . . . . . . . . . . . . -66.88 -33.74 76.27 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 119.915 -0.714 . . . . 39.98 111.05 169.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 300' ' ' PHE . . . . . . . . . . . . . . . -68.15 -45.35 73.79 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.337 -0.545 . . . . 39.02 111.22 178.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' ALA . . . . . . . . . . . . . . . -72.92 -21.13 60.94 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 121.61 -0.681 . . . . 38.44 111.331 175.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' TRP . . . . . . . . . . . . . . . -72.27 -37.1 69.12 Favored 'General case' 0 CA--C 1.512 -0.483 0 O-C-N 121.622 -0.674 . . . . 38.05 110.695 173.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' LEU . . . . . . . . . . . . . . . -63.54 -34.84 78.68 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 120.06 -0.656 . . . . 35.72 109.838 167.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 304' ' ' GLY . . . . . . . . . . . . . . . -65.96 -41.58 95.25 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.625 -0.798 . . . . 34.7 113.934 175.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 305' ' ' TYR . . . . . . . . . . . . . . . -73.74 -39.42 64.26 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 121.831 -0.805 . . . . 33.83 110.745 -177.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 306' ' ' TYR . . . . . . . . . . . . . . . -65.81 -33.38 75.71 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 119.404 -0.918 . . . . 33.55 110.566 172.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 307' ' ' THR . . . . . . . . . . . . . . . -69.71 -37.16 76.46 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.902 0.382 . . . . 33.86 111.631 176.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 308' ' ' GLN . . . . . . . . . . . . . . . -71.43 -47.84 53.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 121.677 -0.639 . . . . 32.63 111.954 178.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 309' ' ' MET . . . . . . . . . . . . . . . -65.65 -34.52 78.4 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.192 -0.603 . . . . 31.92 111.131 177.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 310' ' ' LEU . . . . . . . . . . . . . . . -68.1 -31.32 70.84 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 120.406 -0.518 . . . . 30.65 110.763 174.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 311' ' ' LEU . . . . . . . . . . . . . . . -71.9 -39.69 69.37 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.82 -0.55 . . . . 32.63 112.432 174.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 312' ' ' LEU . . . . . . . . . . . . . . . -72.17 -44.16 63.46 Favored 'General case' 0 C--O 1.243 0.733 0 C-N-CA 119.135 -1.026 . . . . 32.25 111.067 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 313' ' ' ALA . . . . . . . . . . . . . . . -64.76 -23.35 67.22 Favored 'General case' 0 CA--C 1.518 -0.262 0 O-C-N 122.21 -0.306 . . . . 28.73 111.048 170.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 314' ' ' ALA . . . . . . . . . . . . . . . -72.92 -31.65 64.78 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 112.205 0.446 . . . . 28.7 112.205 173.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 315' ' ' VAL . . . . . . . . . . . . . . . -69.13 -42.86 81.93 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 C-N-CA 120.16 -0.616 . . . . 30.64 110.206 174.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 316' ' ' VAL . . . . . . . . . . . . . . . -62.53 -40.66 89.07 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 CA-C-O 121.081 0.467 . . . . 28.47 110.679 174.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 317' ' ' GLY . . . . . . . . . . . . . . . -68.57 -34.93 79.96 Favored Glycine 0 C--O 1.225 -0.438 0 C-N-CA 120.785 -0.722 . . . . 27.96 113.558 177.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 318' ' ' VAL . . . . . . . . . . . . . . . -67.9 -35.92 73.87 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-N 117.348 0.574 . . . . 27.7 110.681 176.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 319' ' ' ALA . . . . . . . . . . . . . . . -63.57 -45.62 89.61 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.533 -0.467 . . . . 28.15 111.156 175.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 320' ' ' CYS . . . . . . . . . . . . . . . -70.71 -19.49 62.75 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 119.206 -0.998 . . . . 28.1 111.804 175.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 321' ' ' PHE . . . . . . . . . . . . . . . -76.11 -31.15 58.53 Favored 'General case' 0 C--O 1.237 0.425 0 O-C-N 121.877 -0.514 . . . . 28.71 112.079 176.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 322' ' ' LEU . . . . . . . . . . . . . . . -61.93 -36.86 82.62 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.365 -0.534 . . . . 29.75 110.708 172.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 323' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.801 0 CA-C-O 121.0 0.429 . . . . 27.92 109.881 166.601 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 377' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.596 0 N-CA-C 109.257 -0.646 . . . . 84.63 109.257 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 378' ' ' GLY . . . . . . . . . . . . . . . -72.11 -34.5 61.48 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.171 -1.014 . . . . 82.1 111.932 173.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 379' ' ' THR . . . . . . . . . . . . . . . -66.49 -40.51 89.31 Favored 'General case' 0 C--O 1.232 0.183 0 O-C-N 122.368 -0.489 . . . . 79.62 110.965 172.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . . . -71.55 -30.92 66.43 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 122.21 -0.306 . . . . 81.59 111.399 174.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 381' ' ' ILE . . . . . . . . . . . . . . . -63.7 -41.55 92.98 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 C-N-CA 119.855 -0.738 . . . . 82.18 110.074 171.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 382' ' ' PHE . . . . . . . . . . . . . . . -63.17 -34.04 76.77 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 116.696 -0.229 . . . . 81.67 111.156 172.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . -72.91 -49.25 30.77 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.87 -0.332 . . . . 81.98 111.331 -175.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 384' ' ' VAL . . . . . . . . . . . . . . . -66.13 -33.54 64.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 C-N-CA 120.373 -0.531 . . . . 82.03 110.214 175.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 385' ' ' PHE . . . . . . . . . . . . . . . -63.83 -35.19 79.81 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 121.122 -0.231 . . . . 84.84 111.071 171.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 386' ' ' MET . . . . . . . . . . . . . . . -74.9 -29.27 60.93 Favored 'General case' 0 CA--C 1.514 -0.411 0 O-C-N 122.028 -0.42 . . . . 84.32 110.967 179.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 387' ' ' GLY . . . . . . . . . . . . . . . -65.31 -46.31 87.26 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.044 -1.074 . . . . 87.38 111.224 171.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . . . -63.48 -31.12 51.69 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.092 0 C-N-CA 120.881 -0.327 . . . . 88.47 110.649 172.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 389' ' ' TRP . . . . . . . . . . . . . . . -75.49 -35.63 60.76 Favored 'General case' 0 CA--C 1.515 -0.375 0 O-C-N 121.957 -0.464 . . . . 88.6 111.185 -177.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 390' ' ' VAL . . . . . . . . . . . . . . . -65.47 -40.75 89.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 109.355 -0.609 . . . . 89.96 109.355 174.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 391' ' ' THR . . . . . . . . . . . . . . . -64.43 -47.34 79.47 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 120.899 0.38 . . . . 90.9 111.763 176.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 392' ' ' LEU . . . . . . . . . . . . . . . -68.3 -32.07 71.95 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 122.345 -0.222 . . . . 94.38 111.554 178.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 393' ' ' PHE . . . . . . . . . . . . . . . -66.58 -44.88 81.01 Favored 'General case' 0 CA--C 1.514 -0.438 0 O-C-N 122.279 -0.263 . . . . 94.87 110.808 177.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 394' ' ' LEU . . . . . . . . . . . . . . . -62.45 -38.49 89.97 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 120.823 -0.351 . . . . 95.99 111.434 174.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 395' ' ' GLU . . . . . . . . . . . . . . . -66.14 -52.81 44.91 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.706 -0.398 . . . . 100.06 112.06 179.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 396' ' ' PHE . . . . . . . . . . . . . . . -69.63 -32.39 71.04 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.69 -0.404 . . . . 103.19 111.562 -177.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 397' ' ' TRP . . . . . . . . . . . . . . . -66.99 -34.44 77.76 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.556 -0.458 . . . . 104.61 110.545 174.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 398' ' ' LYS . . . . . . . . . . . . . . . -65.02 -38.6 91.42 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.38 -0.528 . . . . 106.14 111.169 172.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 399' ' ' ARG . . . . . . . . . . . . . . . -66.7 -46.08 76.7 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 120.49 -0.484 . . . . 106.66 111.883 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 400' ' ' ARG . . . . . . . . . . . . . . . -68.92 -30.07 68.47 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.592 -0.443 . . . . 108.13 110.815 178.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 401' ' ' GLN . . . . . . . . . . . . . . . -61.95 -40.7 96.45 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 120.694 0.283 . . . . 109.03 111.041 173.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 402' ' ' ALA . . . . . . . . . . . . . . . -66.44 -44.01 84.06 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 120.797 -0.361 . . . . 109.96 111.419 176.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 403' ' ' GLU . . . . . . . . . . . . . . . -70.66 -31.37 68.26 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.392 0.516 . . . . 108.42 112.392 -175.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 404' ' ' LEU . . . . . . . . . . . . . . . -77.2 -44.86 28.56 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 113.034 0.753 . . . . 109.66 113.034 -163.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 405' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.31 0 O-C-N 121.902 -0.499 . . . . 111.75 112.34 -173.769 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 455' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.071 0 CA-C-O 121.042 0.449 . . . . 97.4 110.958 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 456' ' ' CYS . . . . . . . . . . . . . . . -68.4 -25.0 64.83 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.827 -0.624 . . . . 95.61 111.167 168.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 457' ' ' ALA . . . . . . . . . . . . . . . -66.2 -39.33 89.57 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 111.79 0.292 . . . . 97.17 111.79 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 458' ' ' SER . . . . . . . . . . . . . . . -66.54 -36.12 81.91 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 120.459 -0.496 . . . . 95.73 110.989 175.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 459' ' ' ALA . . . . . . . . . . . . . . . -64.12 -34.04 77.14 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 120.858 -0.337 . . . . 94.83 111.078 172.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 460' ' ' VAL . . . . . . . . . . . . . . . -67.63 -43.31 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.293 0 CA-C-O 120.798 0.332 . . . . 93.99 110.586 178.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 461' ' ' PHE . . . . . . . . . . . . . . . -67.6 -34.22 76.56 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.348 -0.541 . . . . 92.49 111.48 178.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 462' ' ' PHE . . . . . . . . . . . . . . . -68.81 -39.82 79.85 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.571 -0.452 . . . . 92.04 111.44 175.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 463' ' ' TRP . . . . . . . . . . . . . . . -65.49 -29.14 69.76 Favored 'General case' 0 CA--C 1.517 -0.319 0 O-C-N 122.205 -0.309 . . . . 90.44 111.253 173.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 464' ' ' ILE . . . . . . . . . . . . . . . -69.9 -39.26 77.42 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 CA-C-O 121.516 0.674 . . . . 94.42 110.608 175.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 465' ' ' LEU . . . . . . . . . . . . . . . -63.87 -42.69 97.47 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 121.966 -0.459 . . . . 90.87 111.066 174.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . . . -65.85 -29.16 69.57 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 120.914 -0.314 . . . . 92.04 111.233 174.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 467' ' ' ILE . . . . . . . . . . . . . . . -65.81 -38.84 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 109.992 -0.373 . . . . 91.3 109.992 174.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 468' ' ' ILE . . . . . . . . . . . . . . . -65.93 -35.15 74.41 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-O 121.04 0.448 . . . . 90.83 110.547 174.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 469' ' ' ALA . . . . . . . . . . . . . . . -68.18 -38.92 82.55 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.398 -0.365 . . . . 89.88 111.514 178.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 470' ' ' SER . . . . . . . . . . . . . . . -69.39 -30.46 68.45 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.343 -0.543 . . . . 87.89 110.596 172.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 471' ' ' VAL . . . . . . . . . . . . . . . -68.15 -34.41 66.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 C-N-CA 122.78 0.432 . . . . 84.98 110.992 -178.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 472' ' ' ILE . . . . . . . . . . . . . . . -61.67 -29.62 46.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-O 121.047 0.451 . . . . 85.66 110.95 173.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 473' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.821 0 N-CA-C 111.287 -0.725 . . . . 86.08 111.287 169.078 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 511' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.404 0 N-CA-C 109.404 -0.591 . . . . 64.64 109.404 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 512' ' ' THR . . . . . . . . . . . . . . . -68.17 -28.73 67.54 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.013 -0.54 . . . . 63.34 110.989 170.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.53 -37.81 88.73 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.57 -0.286 . . . . 62.52 111.758 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 514' ' ' SER . . . . . . . . . . . . . . . -67.74 -29.7 69.0 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.088 -0.645 . . . . 60.99 111.247 174.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 515' ' ' ILE . . . . . . . . . . . . . . . -69.54 -42.58 80.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 120.292 -0.563 . . . . 60.78 110.804 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 516' ' ' ILE . . . . . . . . . . . . . . . -67.82 -36.54 76.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 O-C-N 121.918 -0.489 . . . . 61.61 110.629 176.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 517' ' ' SER . . . . . . . . . . . . . . . -67.03 -37.72 84.63 Favored 'General case' 0 CA--C 1.515 -0.393 0 O-C-N 122.038 -0.414 . . . . 61.7 111.234 176.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 518' ' ' PHE . . . . . . . . . . . . . . . -68.34 -33.21 73.88 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.531 -0.468 . . . . 61.43 110.933 175.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 519' ' ' ILE . . . . . . . . . . . . . . . -67.2 -51.12 56.7 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 120.434 -0.506 . . . . 60.6 110.73 178.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 520' ' ' ILE . . . . . . . . . . . . . . . -68.39 -32.1 54.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.632 -0.427 . . . . 61.19 110.809 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 521' ' ' ILE . . . . . . . . . . . . . . . -70.69 -31.23 45.33 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 O-C-N 121.778 -0.576 . . . . 63.35 109.996 177.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 522' ' ' MET . . . . . . . . . . . . . . . -66.65 -48.68 68.62 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.12 0.486 . . . . 62.9 111.297 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 523' ' ' ILE . . . . . . . . . . . . . . . -64.19 -43.19 97.29 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 C-N-CA 120.619 -0.432 . . . . 61.45 110.89 178.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . . . -67.56 -29.72 69.16 Favored 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 122.033 -0.417 . . . . 61.05 111.474 178.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . . . -68.38 -40.35 81.41 Favored 'General case' 0 CA--C 1.509 -0.612 0 C-N-CA 120.98 -0.288 . . . . 60.56 110.992 175.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 526' ' ' THR . . . . . . . . . . . . . . . -66.62 -42.93 86.04 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.026 -0.67 . . . . 63.5 111.383 176.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 527' ' ' ILE . . . . . . . . . . . . . . . -65.01 -38.53 83.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 120.816 0.341 . . . . 61.44 111.047 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 528' ' ' TYR . . . . . . . . . . . . . . . -72.62 -35.5 67.84 Favored 'General case' 0 CA--C 1.518 -0.276 0 O-C-N 121.649 -0.657 . . . . 63.58 111.308 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . . . -67.77 -33.96 75.85 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.836 -0.346 . . . . 65.06 110.989 174.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 530' ' ' LYS . . . . . . . . . . . . . . . -68.93 -33.35 73.58 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.859 -0.736 . . . . 64.66 110.986 171.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 531' ' ' VAL . . . . . . . . . . . . . . . -65.46 -27.93 43.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-O 120.918 0.39 . . . . 63.74 110.516 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 532' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.629 0 CA-C-O 121.885 0.85 . . . . 63.1 110.328 173.126 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 556' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.509 0 CA-C-O 121.388 0.614 . . . . 40.8 110.154 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 557' ' ' LEU . . . . . . . . . . . . . . . -63.71 -30.43 71.54 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 119.849 -0.74 . . . . 40.21 110.254 158.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 558' ' ' PHE . . . . . . . . . . . . . . . -67.04 -42.66 84.45 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 120.788 -0.365 . . . . 41.22 111.474 171.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 559' ' ' GLN . . . . . . . . . . . . . . . -70.61 -41.26 72.52 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 120.69 -0.404 . . . . 43.24 111.521 -177.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 560' ' ' PHE . . . . . . . . . . . . . . . -62.91 -35.67 80.83 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 120.872 -0.331 . . . . 41.97 110.993 171.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 561' ' ' VAL . . . . . 0.512 ' O ' ' CB ' ' B' ' 565' ' ' SER . . . -62.7 -45.26 99.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 C-N-CA 120.788 -0.365 . . . . 42.26 110.687 175.362 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 562' ' ' ASN . . . . . . . . . . . . . . . -67.73 -41.29 83.69 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 122.082 -0.386 . . . . 43.43 111.672 -177.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 563' ' ' TYR . . . . . . . . . . . . . . . -74.22 -55.77 5.67 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 120.452 -0.499 . . . . 44.56 111.688 -178.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 564' ' ' TYR . . . . . . . . . . . . . . . -76.81 -15.5 59.71 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 121.944 -0.472 . . . . 43.94 112.207 -172.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 565' ' ' SER . . . . . 0.512 ' CB ' ' O ' ' B' ' 561' ' ' VAL . . . -64.68 -35.89 82.49 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 112.631 0.604 . . . . 46.77 112.631 -174.541 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 566' ' ' SER . . . . . . . . . . . . . . . -67.63 -39.91 84.63 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.253 -0.579 . . . . 49.43 111.39 178.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 567' ' ' CYS . . . . . . . . . . . . . . . -70.01 -47.74 60.91 Favored 'General case' 0 C--O 1.241 0.627 0 O-C-N 122.127 -0.358 . . . . 48.82 111.307 -179.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . . . -64.9 -28.46 69.55 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 120.599 -0.441 . . . . 47.41 111.119 173.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 569' ' ' TYR . . . . . . . . . . . . . . . -69.06 -35.47 76.58 Favored 'General case' 0 CA--C 1.515 -0.38 0 O-C-N 121.975 -0.453 . . . . 52.46 111.268 175.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 570' ' ' ILE . . . . . . . . . . . . . . . -66.07 -49.01 79.62 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 CA-C-O 121.247 0.546 . . . . 54.03 109.754 174.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 571' ' ' ALA . . . . . . . . . . . . . . . -63.77 -25.89 68.39 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.749 -0.66 . . . . 55.67 112.48 -177.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . . . -86.36 -22.99 26.36 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 121.821 -0.55 . . . . 55.05 111.814 167.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 573' ' ' PHE . . . . . . . . . . . . . . . -74.87 -37.16 62.25 Favored 'General case' 0 CA--C 1.508 -0.637 0 O-C-N 122.23 -0.294 . . . . 55.54 111.649 -167.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 574' ' ' LYS . . . . . . . . . . . . . . . -66.39 -29.81 70.05 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 118.117 -1.433 . . . . 55.36 110.879 168.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 575' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.461 0 N-CA-C 118.016 1.966 . . . . 56.18 118.016 -178.411 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 604' ' ' GLU . . . . . 0.504 ' O ' ' N ' ' B' ' 608' ' ' GLN . . . . . . . . 0 C--O 1.213 -0.829 0 N-CA-C 109.461 -0.57 . . . . 23.64 109.461 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 605' ' ' LEU . . . . . 0.427 ' O ' ' CB ' ' B' ' 609' ' ' LEU . . . -62.68 -30.87 71.72 Favored 'General case' 0 CA--C 1.513 -0.462 0 O-C-N 124.216 0.948 . . . . 26.07 111.199 -176.647 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 606' ' ' THR . . . . . . . . . . . . . . . -62.9 -52.09 64.41 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 120.112 -0.635 . . . . 26.55 110.653 169.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 607' ' ' THR . . . . . . . . . . . . . . . -72.15 -42.48 65.89 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 120.653 -0.419 . . . . 26.95 111.82 -177.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 608' ' ' GLN . . . . . 0.504 ' N ' ' O ' ' B' ' 604' ' ' GLU . . . -69.1 -40.01 78.64 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 120.369 -0.532 . . . . 28.93 111.23 -179.938 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 609' ' ' LEU . . . . . 0.427 ' CB ' ' O ' ' B' ' 605' ' ' LEU . . . -65.7 -40.37 92.22 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 120.658 -0.417 . . . . 29.28 111.265 175.836 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 610' ' ' THR . . . . . . . . . . . . . . . -68.77 -42.66 77.15 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 121.115 -0.234 . . . . 30.32 111.434 179.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 611' ' ' ILE . . . . . . . . . . . . . . . -74.51 -33.74 33.58 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.349 0 O-C-N 122.065 -0.397 . . . . 32.18 111.087 -178.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 612' ' ' ILE . . . . . . . . . . . . . . . -69.83 -43.16 79.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 O-C-N 121.497 -0.752 . . . . 34.94 110.385 175.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 613' ' ' MET . . . . . . . . . . . . . . . -66.72 -48.85 67.93 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.909 -0.495 . . . . 36.37 111.144 177.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 614' ' ' GLY . . . . . . . . . . . . . . . -65.98 -36.38 91.96 Favored Glycine 0 C--O 1.221 -0.685 0 C-N-CA 121.16 -0.543 . . . . 39.2 113.197 178.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 615' ' ' GLY . . . . . . . . . . . . . . . -72.47 -36.39 59.11 Favored Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 120.035 -1.079 . . . . 39.49 112.435 179.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 616' ' ' LYS . . . . . . . . . . . . . . . -66.27 -32.17 73.43 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.418 -0.913 . . . . 42.05 110.357 171.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 617' ' ' ALA . . . . . . . . . . . . . . . -67.78 -46.35 72.23 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 112.118 0.414 . . . . 43.8 112.118 175.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 618' ' ' ILE . . . . . . . . . . . . . . . -71.26 -36.04 60.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 O-C-N 121.968 -0.457 . . . . 46.65 110.596 -178.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 619' ' ' TRP . . . . . . . . . . . . . . . -69.49 -36.18 76.27 Favored 'General case' 0 CA--C 1.517 -0.309 0 O-C-N 121.566 -0.709 . . . . 48.25 111.02 176.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 620' ' ' ASN . . . . . . . . . . . . . . . -67.19 -33.03 74.51 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.398 -0.521 . . . . 49.61 111.382 173.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 621' ' ' ASN . . . . . . . . . . . . . . . -70.4 -37.54 74.49 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.396 -0.522 . . . . 51.06 111.498 176.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 622' ' ' ILE . . . . . . . . . . . . . . . -65.17 -36.06 76.86 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 120.902 0.382 . . . . 52.18 110.508 174.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 623' ' ' GLN . . . . . . . . . . . . . . . -68.23 -33.7 74.89 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 121.891 -0.506 . . . . 55.34 111.581 173.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 624' ' ' GLU . . . . . . . . . . . . . . . -68.61 -34.26 75.46 Favored 'General case' 0 C--O 1.234 0.249 0 O-C-N 122.141 -0.349 . . . . 54.33 111.597 177.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 625' ' ' VAL . . . . . . . . . . . . . . . -72.99 -41.12 59.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 C-N-CA 120.087 -0.645 . . . . 55.71 110.641 174.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 626' ' ' LEU . . . . . . . . . . . . . . . -90.02 2.58 55.02 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 113.969 1.1 . . . . 56.3 113.969 -172.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 627' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 118.723 0.692 . . . . 57.26 111.372 177.391 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 665' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.603 0 N-CA-C 110.186 -0.302 . . . . 45.13 110.186 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 666' ' ' TYR . . . . . . . . . . . . . . . -64.39 -32.46 74.08 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 120.176 -0.61 . . . . 42.77 110.782 175.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . . . -67.48 -43.97 79.7 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 111.557 0.206 . . . . 43.93 111.557 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 668' ' ' TYR . . . . . . . . . . . . . . . -69.29 -26.55 64.79 Favored 'General case' 0 CA--C 1.512 -0.519 0 C-N-CA 120.399 -0.52 . . . . 39.92 110.698 176.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . . . -64.08 -42.59 96.91 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.421 -0.511 . . . . 39.07 111.194 170.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 670' ' ' GLU . . . . . . . . . . . . . . . -66.91 -42.77 84.9 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.262 -0.575 . . . . 37.34 111.42 179.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 671' ' ' MET . . . . . . . . . . . . . . . -70.22 -30.26 67.3 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 119.776 -0.769 . . . . 38.02 111.542 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 672' ' ' ILE . . . . . . . . . . . . . . . -72.87 -32.62 40.82 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.436 0 C-N-CA 120.129 -0.629 . . . . 36.7 110.073 177.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 673' ' ' ILE . . . . . . . . . . . . . . . -64.26 -35.61 74.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.109 -0.636 . . . . 36.15 109.992 170.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 674' ' ' GLN . . . . . . . . . . . . . . . -69.75 -34.68 74.15 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 119.895 -0.722 . . . . 36.49 111.49 175.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 675' ' ' PHE . . . . . . . . . . . . . . . -69.12 -34.44 75.06 Favored 'General case' 0 CA--C 1.51 -0.593 0 O-C-N 121.855 -0.528 . . . . 33.16 110.795 176.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 676' ' ' GLY . . . . . . . . . . . . . . . -64.58 -36.07 92.7 Favored Glycine 0 N--CA 1.443 -0.859 0 C-N-CA 119.839 -1.172 . . . . 32.99 111.823 170.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 677' ' ' PHE . . . . . . . . . . . . . . . -63.18 -49.53 73.92 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 120.612 -0.435 . . . . 32.17 111.342 175.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 678' ' ' VAL . . . . . . . . . . . . . . . -69.99 -49.44 56.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.738 0.304 . . . . 31.39 110.371 -176.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 679' ' ' THR . . . . . . . . . . . . . . . -77.26 -44.45 29.8 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.764 0.653 . . . . 30.34 112.764 -173.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 680' ' ' LEU . . . . . . . . . . . . . . . -75.07 -34.84 61.84 Favored 'General case' 0 CA--C 1.513 -0.476 0 O-C-N 121.466 -0.771 . . . . 31.76 111.684 -175.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 681' ' ' PHE . . . . . . . . . . . . . . . -111.69 29.6 7.71 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.665 0.617 . . . . 33.91 112.665 -175.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 682' ' ' VAL . . . . . . . . . . . . . . . -59.19 -28.07 38.11 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.554 0 C-N-CA 125.339 1.456 . . . . 34.38 112.484 -176.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 683' ' ' ALA . . . . . . . . . . . . . . . -72.89 -17.38 61.52 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 118.136 -1.426 . . . . 35.77 112.959 -179.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 684' ' ' SER . . . . . . . . . . . . . . . -74.24 -74.88 0.17 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-N 118.918 0.781 . . . . 31.35 111.675 -175.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . . . -122.38 131.29 24.41 Favored Pre-proline 0 N--CA 1.438 -1.051 0 N-CA-C 103.505 -2.776 . . . . 34.68 103.505 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 686' ' ' PRO . . . . . . . . . . . . . . . -88.6 -17.39 2.24 Favored 'Trans proline' 0 C--O 1.239 0.55 0 N-CA-C 114.124 0.778 . . . . 36.6 114.124 -173.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 687' ' ' LEU . . . . . . . . . . . . . . . -79.97 3.61 19.5 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 119.365 0.984 . . . . 35.59 112.778 178.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 688' ' ' ALA . . . . . . . . . . . . . . . -68.37 -20.51 0.54 Allowed Pre-proline 0 C--O 1.262 1.73 0 CA-C-O 117.91 -1.043 . . . . 34.98 112.822 -173.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 689' ' ' PRO . . . . . . . . . . . . . . . -67.59 -46.28 2.81 Favored 'Trans proline' 0 C--O 1.244 0.778 0 CA-C-N 122.143 1.801 . . . . 34.04 113.759 -176.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 690' ' ' LEU . . . . . . . . . . . . . . . -59.27 -41.24 88.42 Favored 'General case' 0 C--O 1.239 0.507 0 O-C-N 123.334 0.396 . . . . 34.42 111.606 -179.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . . . -61.1 -20.75 63.0 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.388 0.675 . . . . 38.79 112.091 -177.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 692' ' ' ALA . . . . . . . . . . . . . . . -72.83 -62.71 1.36 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 117.981 -1.488 . . . . 42.54 111.221 171.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 693' ' ' LEU . . . . . . . . . . . . . . . -67.8 -35.46 78.69 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 120.638 0.256 . . . . 43.27 111.243 -159.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 694' ' ' VAL . . . . . . . . . . . . . . . -55.54 -49.46 73.41 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 C-N-CA 123.353 0.661 . . . . 46.42 110.069 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 695' ' ' ASN . . . . . . . . . . . . . . . -62.39 -40.15 95.53 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 116.426 -0.352 . . . . 47.9 110.945 176.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 696' ' ' ASN . . . . . . . . . . . . . . . -63.33 -31.96 73.26 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.262 -0.426 . . . . 50.68 111.485 -178.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . . . -68.83 -30.12 45.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 118.817 -1.153 . . . . 49.28 109.892 -175.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 698' ' ' LEU . . . . . . . . . . . . . . . -67.35 -24.55 65.72 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 120.585 -0.446 . . . . 53.23 111.812 175.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 699' ' ' GLU . . . . . . . . . . . . . . . -62.33 -31.73 72.4 Favored 'General case' 0 C--N 1.342 0.282 0 N-CA-C 111.408 0.151 . . . . 54.67 111.408 174.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 700' ' ' ILE . . . . . . . . . . . . . . . -62.01 -35.5 68.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 C-N-CA 120.34 -0.544 . . . . 54.64 109.89 173.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 701' ' ' ARG . . . . . . . . . . . . . . . -60.85 -36.11 78.3 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 116.301 -0.408 . . . . 56.44 111.884 174.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 702' ' ' VAL . . . . . . . . . . . . . . . -66.45 -33.65 64.9 Favored 'Isoleucine or valine' 0 C--N 1.346 0.433 0 C-N-CA 120.374 -0.53 . . . . 55.24 110.314 178.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 703' ' ' ASP . . . . . . . . . . . . . . . -69.05 -29.85 68.08 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 119.488 -0.885 . . . . 57.16 110.383 172.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 704' ' ' ALA . . . . . . . . . . . . . . . -78.35 -23.78 46.78 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 112.411 0.523 . . . . 55.88 112.411 -174.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 705' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.213 0 N-CA-C 113.112 0.782 . . . . 58.13 113.112 -174.769 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 726' ' ' GLN . . . . . 0.404 ' O ' ' N ' ' B' ' 730' ' ' GLN . . . . . . . . 0 CA--C 1.512 -0.504 0 N-CA-C 110.348 -0.242 . . . . 33.2 110.348 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 727' ' ' PRO . . . . . . . . . . . . . . . -68.28 -42.74 5.22 Favored 'Trans proline' 0 C--O 1.237 0.466 0 O-C-N 123.219 1.115 . . . . 33.67 113.849 -176.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 728' ' ' ILE . . . . . . . . . . . . . . . -66.76 -33.48 63.71 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.327 0 C-N-CA 120.07 -0.652 . . . . 34.03 110.114 171.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 729' ' ' MET . . . . . . . . . . . . . . . -71.69 -43.63 65.64 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 120.094 -0.642 . . . . 33.37 111.869 179.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 730' ' ' GLN . . . . . 0.404 ' N ' ' O ' ' B' ' 726' ' ' GLN . . . -68.4 -29.85 68.63 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 119.988 -0.685 . . . . 32.68 110.946 176.855 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 731' ' ' GLY . . . . . . . . . . . . . . . -65.45 -41.74 96.21 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 119.853 -1.165 . . . . 35.79 112.282 170.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 732' ' ' ILE . . . . . . . . . . . . . . . -65.78 -25.96 37.61 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.154 0 O-C-N 122.651 -0.323 . . . . 36.13 110.233 174.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 733' ' ' ALA . . . . . . . . . . . . . . . -77.85 -41.32 37.31 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 121.903 -0.498 . . . . 36.03 112.194 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 734' ' ' ILE . . . . . . . . . . . . . . . -68.74 -39.65 80.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.599 0 C-N-CA 119.786 -0.766 . . . . 34.71 110.13 175.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 735' ' ' LEU . . . . . . . . . . . . . . . -65.39 -27.07 68.29 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.443 -0.344 . . . . 35.58 111.104 171.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 736' ' ' ALA . . . . . . . . . . . . . . . -75.73 -32.53 60.06 Favored 'General case' 0 CA--C 1.512 -0.507 0 O-C-N 122.077 -0.389 . . . . 34.5 111.672 176.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 737' ' ' VAL . . . . . . . . . . . . . . . -63.7 -49.66 81.26 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 C-N-CA 119.766 -0.774 . . . . 34.01 109.473 172.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 738' ' ' VAL . . . . . . . . . . . . . . . -63.66 -35.63 73.53 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 O-C-N 122.089 -0.382 . . . . 32.25 111.078 174.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 739' ' ' THR . . . . . . . . . . . . . . . -78.74 -37.82 40.35 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.74 -0.6 . . . . 31.26 111.33 -173.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 740' ' ' ASN . . . . . . . . . . . . . . . -73.42 -32.82 64.62 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 121.824 -0.547 . . . . 29.22 110.404 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 741' ' ' ALA . . . . . . . . . . . . . . . -65.79 -39.47 90.97 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.337 -0.545 . . . . 29.39 111.091 170.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 742' ' ' MET . . . . . . . . . . . . . . . -74.76 -24.54 58.7 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.102 -0.639 . . . . 29.92 111.346 174.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 743' ' ' ILE . . . . . . . . . . . . . . . -73.51 -42.1 56.12 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 O-C-N 121.81 -0.556 . . . . 29.61 109.848 178.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 744' ' ' ILE . . . . . . . . . . . . . . . -66.96 -44.53 88.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 O-C-N 121.799 -0.563 . . . . 28.98 110.846 171.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 745' ' ' ALA . . . . . . . . . . . . . . . -76.41 -52.7 9.36 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.437 -0.789 . . . . 27.93 112.971 -172.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 746' ' ' PHE . . . . . . . . . . . . . . . -85.22 -52.23 6.06 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 121.033 -1.042 . . . . 30.42 110.62 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 747' ' ' THR . . . . . . . . . . . . . . . -74.11 -41.22 61.97 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 118.112 -1.435 . . . . 30.74 112.627 -173.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 748' ' ' SER . . . . . . . . . . . . . . . -78.71 -36.27 43.67 Favored 'General case' 0 C--N 1.346 0.438 0 C-N-CA 118.103 -1.439 . . . . 30.54 114.044 -154.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 749' ' ' ASP . . . . . . . . . . . . . . . 52.06 52.5 14.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.873 0.869 . . . . 32.62 110.68 -159.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 750' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.717 0 C-N-CA 125.034 1.334 . . . . 34.47 111.651 176.664 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 829' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.434 0 CA-C-O 121.678 0.751 . . . . 16.69 110.352 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 830' ' ' HIS . . . . . . . . . . . . . . . -77.41 -29.69 53.14 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 114.495 -1.23 . . . . 16.88 113.078 -160.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 831' ' ' VAL . . . . . . . . . . . . . . . -71.48 -35.31 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 C-N-CA 120.028 -0.669 . . . . 21.06 111.382 -156.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 832' ' ' ILE . . . . . . . . . . . . . . . -64.13 -37.96 81.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 CA-C-O 121.495 0.664 . . . . 20.33 109.824 174.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 833' ' ' ALA . . . . . . . . . . . . . . . -69.94 -37.84 75.99 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 115.856 -0.611 . . . . 19.87 111.746 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 834' ' ' ALA . . . . . . . . . . . . . . . -76.16 -30.55 58.15 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 120.005 -0.678 . . . . 20.66 111.443 179.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 835' ' ' LYS . . . . . . . . . . . . . . . -64.48 -42.28 95.98 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 120.058 -0.657 . . . . 20.99 110.265 172.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 836' ' ' LEU . . . . . . . . . . . . . . . -66.75 -34.83 78.69 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.909 0.385 . . . . 21.92 111.055 175.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 837' ' ' ALA . . . . . . . . . . . . . . . -73.2 -35.11 66.29 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 122.044 -0.41 . . . . 22.85 111.816 179.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 838' ' ' PHE . . . . . . . . . . . . . . . -70.12 -36.6 74.94 Favored 'General case' 0 CA--C 1.508 -0.672 0 C-N-CA 120.939 -0.305 . . . . 22.91 110.58 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 839' ' ' ILE . . . . . . . . . . . . . . . -61.63 -39.86 84.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 C-N-CA 120.371 -0.532 . . . . 24.26 109.841 172.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 840' ' ' ILE . . . . . . . . . . . . . . . -69.95 -46.14 74.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-O 120.755 0.312 . . . . 25.58 111.034 179.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 841' ' ' VAL . . . . . . . . . . . . . . . -75.0 -39.98 44.85 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 O-C-N 121.875 -0.515 . . . . 27.12 110.957 -174.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 842' ' ' MET . . . . . . . . . . . . . . . -70.61 -37.5 73.86 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 121.757 -0.59 . . . . 27.49 111.055 177.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 843' ' ' GLU . . . . . . . . . . . . . . . -65.43 -36.41 83.84 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 120.275 -0.57 . . . . 27.68 111.078 172.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 844' ' ' HIS . . . . . . . . . . . . . . . -74.33 -41.26 61.39 Favored 'General case' 0 N--CA 1.457 -0.116 0 N-CA-C 112.058 0.392 . . . . 29.37 112.058 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 845' ' ' ILE . . . . . . . . . . . . . . . -73.88 -39.76 52.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 O-C-N 121.61 -0.681 . . . . 28.57 110.585 178.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 846' ' ' ILE . . . . . . . . . . . . . . . -75.22 -18.93 16.09 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 O-C-N 121.646 -0.659 . . . . 28.55 110.5 179.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 847' ' ' TYR . . . . . . . . . . . . . . . -84.52 -23.04 29.96 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.404 -0.518 . . . . 31.46 111.062 167.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 848' ' ' SER . . . . . . . . . . . . . . . -70.39 -43.48 69.96 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.131 -0.628 . . . . 31.85 110.7 174.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 849' ' ' VAL . . . . . . . . . . . . . . . -64.07 -34.04 66.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-O 120.774 0.321 . . . . 34.14 110.357 175.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 850' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.599 0 O-C-N 121.778 -0.576 . . . . 34.76 111.896 175.769 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 295' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.457 0 N-CA-C 110.636 -0.135 . . . . 48.939999999999998 110.636 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 296' ' ' ILE . . . . . . . . . . . . . . . -77.84 -34.18 19.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-O 121.038 0.447 . . . . 45.57 110.978 -178.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 297' ' ' GLY . . . . . . . . . . . . . . . -79.57 -45.47 8.59 Favored Glycine 0 C--N 1.334 0.434 0 C-N-CA 120.336 -0.935 . . . . 47.039999999999999 114.146 -172.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 298' ' ' ILE . . . . . . . . . . . . . . . -67.3 -31.68 54.06 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.427 0 O-C-N 122.095 -0.65 . . . . 45.880000000000003 110.057 176.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . . . -66.75 -33.79 76.4 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 119.949 -0.701 . . . . 43.670000000000002 111.089 169.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 300' ' ' PHE . . . . . . . . . . . . . . . -68.15 -45.35 73.8 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 120.338 -0.545 . . . . 42.57 111.187 178.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 301' ' ' ALA . . . . . . . . . . . . . . . -72.86 -21.18 60.97 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 121.614 -0.679 . . . . 43.759999999999998 111.324 175.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' TRP . . . . . . . . . . . . . . . -72.33 -37.05 68.98 Favored 'General case' 0 CA--C 1.514 -0.436 0 O-C-N 121.63 -0.669 . . . . 41.670000000000002 110.619 173.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 303' ' ' LEU . . . . . . . . . . . . . . . -63.61 -34.77 78.56 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 119.99 -0.684 . . . . 39.969999999999999 109.891 167.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 304' ' ' GLY . . . . . . . . . . . . . . . -65.9 -41.6 95.36 Favored Glycine 0 C--O 1.224 -0.474 0 C-N-CA 120.713 -0.756 . . . . 38.460000000000001 113.949 175.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 305' ' ' TYR . . . . . . . . . . . . . . . -73.74 -39.47 64.23 Favored 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 121.797 -0.825 . . . . 36.799999999999997 110.8 -177.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 306' ' ' TYR . . . . . . . . . . . . . . . -65.75 -33.45 75.9 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 119.423 -0.911 . . . . 37.18 110.552 172.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 307' ' ' THR . . . . . . . . . . . . . . . -69.76 -37.04 76.26 Favored 'General case' 0 C--O 1.233 0.19 0 O-C-N 121.972 -0.455 . . . . 36.450000000000003 111.646 176.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 308' ' ' GLN . . . . . . . . . . . . . . . -71.51 -47.82 52.93 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 121.679 -0.638 . . . . 35.979999999999997 111.953 177.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 309' ' ' MET . . . . . . . . . . . . . . . -65.67 -34.44 78.21 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.206 -0.597 . . . . 34.619999999999997 111.19 177.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 310' ' ' LEU . . . . . 0.506 ' O ' ' HB2' ' A' ' 314' ' ' ALA . . . -68.14 -31.35 70.87 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.383 -0.527 . . . . 34.350000000000001 110.737 174.06 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . . . -71.96 -39.64 69.23 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.806 -0.559 . . . . 35.18 112.423 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 312' ' ' LEU . . . . . . . . . . . . . . . -72.1 -44.31 63.43 Favored 'General case' 0 C--O 1.242 0.694 0 O-C-N 120.971 -1.081 . . . . 34.350000000000001 111.008 -179.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -64.67 -23.48 67.27 Favored 'General case' 0 CA--C 1.518 -0.278 0 O-C-N 122.23 -0.294 . . . . 32.32 110.992 171.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 314' ' ' ALA . . . . . 0.506 ' HB2' ' O ' ' A' ' 310' ' ' LEU . . . -72.92 -31.59 64.74 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 112.218 0.451 . . . . 32.049999999999997 112.218 173.111 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 315' ' ' VAL . . . . . . . . . . . . . . . -69.01 -42.97 82.29 Favored 'Isoleucine or valine' 0 C--O 1.241 0.654 0 C-N-CA 120.188 -0.605 . . . . 34.130000000000003 110.217 174.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 316' ' ' VAL . . . . . . . . . . . . . . . -62.49 -40.74 89.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 CA-C-O 120.988 0.423 . . . . 31.460000000000001 110.613 174.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 317' ' ' GLY . . . . . . . . . . . . . . . -68.56 -34.86 79.81 Favored Glycine 0 C--O 1.225 -0.452 0 C-N-CA 120.831 -0.7 . . . . 30.52 113.51 177.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 318' ' ' VAL . . . . . . . . . . . . . . . -67.96 -36.0 73.99 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-N 117.358 0.579 . . . . 31.170000000000002 110.638 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 319' ' ' ALA . . . . . . . . . . . . . . . -63.46 -45.61 90.0 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 120.481 -0.488 . . . . 30.170000000000002 111.258 175.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 320' ' ' CYS . . . . . . . . . . . . . . . -70.72 -19.52 62.74 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 119.265 -0.974 . . . . 29.940000000000001 111.794 175.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 321' ' ' PHE . . . . . . . . . . . . . . . -76.03 -31.19 58.75 Favored 'General case' 0 C--O 1.237 0.442 0 O-C-N 121.994 -0.441 . . . . 29.649999999999999 112.105 176.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 322' ' ' LEU . . . . . . . . . . . . . . . -61.96 -36.76 82.37 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.369 -0.532 . . . . 31.710000000000001 110.708 172.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.845 0 CA-C-O 121.011 0.434 . . . . 30.420000000000002 109.846 166.632 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.57 0 N-CA-C 109.343 -0.614 . . . . 81.909999999999997 109.343 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 378' ' ' GLY . . . . . . . . . . . . . . . -72.13 -34.5 61.4 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.081 -1.057 . . . . 80.640000000000001 111.938 173.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 379' ' ' THR . . . . . . . . . . . . . . . -66.37 -40.66 89.87 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 122.283 -0.539 . . . . 78.129999999999995 110.967 172.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 380' ' ' LEU . . . . . . . . . . . . . . . -71.55 -30.85 66.35 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 121.011 -0.276 . . . . 79.799999999999997 111.41 174.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 381' ' ' ILE . . . . . . . . . . . . . . . -63.81 -41.5 92.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 119.879 -0.729 . . . . 78.569999999999993 110.034 171.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . . . -63.13 -34.12 76.94 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 116.698 -0.228 . . . . 78.890000000000001 111.177 172.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 383' ' ' ALA . . . . . . . . . . . . . . . -72.89 -49.3 30.64 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 120.94 -0.304 . . . . 78.939999999999998 111.272 -175.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . . . -66.1 -33.53 64.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 C-N-CA 120.421 -0.511 . . . . 80.519999999999996 110.188 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 385' ' ' PHE . . . . . . . . . . . . . . . -63.85 -35.24 79.97 Favored 'General case' 0 CA--C 1.519 -0.237 0 O-C-N 122.264 -0.273 . . . . 81.260000000000005 111.02 171.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 386' ' ' MET . . . . . . . . . . . . . . . -74.94 -29.25 60.88 Favored 'General case' 0 CA--C 1.515 -0.38 0 O-C-N 122.018 -0.426 . . . . 82.700000000000003 110.902 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . -65.21 -46.31 88.06 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.118 -1.039 . . . . 84.170000000000002 111.288 171.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . . . -63.61 -31.1 51.69 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.074 0 C-N-CA 120.904 -0.318 . . . . 84.859999999999999 110.589 172.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 389' ' ' TRP . . . . . . . . . . . . . . . -75.64 -35.49 60.42 Favored 'General case' 0 CA--C 1.514 -0.424 0 O-C-N 121.937 -0.477 . . . . 85.620000000000005 111.15 -177.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . . . -65.48 -40.71 89.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.398 -0.593 . . . . 85.390000000000001 109.398 174.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 391' ' ' THR . . . . . . . . . . . . . . . -64.47 -47.29 79.56 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-O 120.888 0.375 . . . . 85.950000000000003 111.714 176.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 392' ' ' LEU . . . . . . . . . . . . . . . -68.42 -32.07 71.84 Favored 'General case' 0 C--O 1.234 0.289 0 O-C-N 122.261 -0.275 . . . . 90.549999999999997 111.507 179.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . . . -66.44 -45.11 80.9 Favored 'General case' 0 CA--C 1.514 -0.418 0 O-C-N 122.276 -0.265 . . . . 92.569999999999993 110.785 177.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 394' ' ' LEU . . . . . . . . . . . . . . . -62.31 -38.55 89.85 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 120.851 -0.34 . . . . 91.109999999999999 111.426 174.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . . . -66.17 -52.86 44.15 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 112.047 0.388 . . . . 94.290000000000006 112.047 179.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 396' ' ' PHE . . . . . . . . . . . . . . . -69.49 -32.5 71.41 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 120.646 -0.422 . . . . 96.099999999999994 111.562 -177.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 397' ' ' TRP . . . . . . . . . . . . . . . -66.92 -34.37 77.62 Favored 'General case' 0 CA--C 1.518 -0.284 0 C-N-CA 120.586 -0.446 . . . . 97.129999999999995 110.588 174.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . . . -65.12 -38.55 91.04 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.376 -0.53 . . . . 97.950000000000003 111.151 172.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 399' ' ' ARG . . . . . . . . . . . . . . . -66.69 -46.12 76.61 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 120.431 -0.507 . . . . 98.659999999999997 111.911 -179.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . . . -68.88 -29.98 68.39 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.55 -0.46 . . . . 100.03 110.92 178.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 401' ' ' GLN . . . . . . . . . . . . . . . -62.01 -40.78 96.83 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 120.655 0.264 . . . . 101.91 110.978 172.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 402' ' ' ALA . . . . . . . . . . . . . . . -66.39 -44.03 84.2 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.815 -0.354 . . . . 100.83 111.477 176.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . . . -70.6 -31.31 68.25 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 112.418 0.525 . . . . 101.16 112.418 -175.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . . . -77.26 -44.81 28.5 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.049 0.759 . . . . 102.17 113.049 -163.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 405' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.281 0 O-C-N 121.896 -0.502 . . . . 100.81999999999999 112.344 -173.775 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.069 0 CA-C-O 120.937 0.399 . . . . 97.799999999999997 110.912 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 456' ' ' CYS . . . . . . . . . . . . . . . -68.36 -25.03 64.88 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.843 -0.617 . . . . 99.870000000000005 111.158 168.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 457' ' ' ALA . . . . . . . . . . . . . . . -66.19 -39.38 89.64 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 111.758 0.281 . . . . 101.63 111.758 178.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . . . -66.51 -36.19 82.09 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.431 -0.508 . . . . 98.900000000000006 110.994 175.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 459' ' ' ALA . . . . . . . . . . . . . . . -64.02 -34.1 77.24 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 120.897 -0.321 . . . . 97.950000000000003 111.109 172.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 460' ' ' VAL . . . . . . . . . . . . . . . -67.6 -43.36 87.01 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 CA-C-O 120.8 0.333 . . . . 97.290000000000006 110.526 178.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . . . -67.6 -34.19 76.51 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.345 -0.542 . . . . 97.390000000000001 111.415 178.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 462' ' ' PHE . . . . . . . . . . . . . . . -68.79 -39.83 79.95 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.587 -0.445 . . . . 99.0 111.474 175.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 463' ' ' TRP . . . . . . . . . . . . . . . -65.53 -29.15 69.75 Favored 'General case' 0 CA--C 1.517 -0.317 0 O-C-N 122.208 -0.308 . . . . 96.099999999999994 111.301 173.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . . . -69.9 -39.22 77.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 CA-C-O 121.497 0.665 . . . . 98.599999999999994 110.609 175.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . . . -63.88 -42.7 97.42 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 121.961 -0.462 . . . . 94.349999999999994 111.096 174.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . . . -65.76 -29.14 69.6 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 120.854 -0.339 . . . . 94.629999999999995 111.221 174.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . . . -65.92 -38.74 82.81 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.389 0 N-CA-C 109.924 -0.399 . . . . 93.129999999999995 109.924 174.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . . . -66.05 -35.25 74.59 Favored 'Isoleucine or valine' 0 C--O 1.241 0.641 0 CA-C-O 121.013 0.435 . . . . 92.599999999999994 110.382 174.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -68.07 -38.98 83.03 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.478 -0.328 . . . . 91.840000000000003 111.532 178.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . . . -69.29 -30.54 68.65 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.458 -0.497 . . . . 89.069999999999993 110.593 172.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . . . -68.13 -34.45 66.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 C-N-CA 122.851 0.46 . . . . 86.599999999999994 110.986 -178.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . . . -61.66 -29.6 46.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 121.008 0.432 . . . . 89.790000000000006 110.897 173.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.774 0 N-CA-C 111.253 -0.739 . . . . 88.469999999999999 111.253 169.131 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 511' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.405 0 N-CA-C 109.315 -0.624 . . . . 65.870000000000005 109.315 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 512' ' ' THR . . . . . . . . . . . . . . . -68.12 -28.7 67.55 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.033 -0.53 . . . . 64.790000000000006 110.961 170.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.74 88.46 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 111.738 0.273 . . . . 64.599999999999994 111.738 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . . . -67.86 -29.62 68.79 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.125 -0.63 . . . . 63.509999999999998 111.153 174.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 515' ' ' ILE . . . . . . . . . . . . . . . -69.55 -42.6 80.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 C-N-CA 120.413 -0.515 . . . . 62.799999999999997 110.81 176.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 516' ' ' ILE . . . . . . . . . . . . . . . -67.82 -36.48 75.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 O-C-N 121.885 -0.509 . . . . 63.909999999999997 110.692 176.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . . . -67.16 -37.65 84.12 Favored 'General case' 0 CA--C 1.515 -0.395 0 O-C-N 122.075 -0.391 . . . . 62.909999999999997 111.231 176.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 518' ' ' PHE . . . . . . . . . . . . . . . -68.41 -33.14 73.69 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 120.514 -0.474 . . . . 65.069999999999993 110.908 175.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 519' ' ' ILE . . . . . . . . . . . . . . . -67.18 -51.09 57.19 Favored 'Isoleucine or valine' 0 C--O 1.24 0.603 0 C-N-CA 120.508 -0.477 . . . . 62.609999999999999 110.81 178.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 520' ' ' ILE . . . . . . . . . . . . . . . -68.45 -32.02 53.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 C-N-CA 120.647 -0.421 . . . . 65.340000000000003 110.834 179.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . . . -70.71 -31.32 45.59 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 O-C-N 121.734 -0.604 . . . . 65.530000000000001 109.879 177.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . . . -66.64 -48.75 68.41 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.074 0.464 . . . . 67.390000000000001 111.268 174.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . . . -64.08 -43.23 97.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 C-N-CA 120.608 -0.437 . . . . 69.019999999999996 110.96 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . . . -67.55 -29.62 69.05 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 121.946 -0.471 . . . . 68.810000000000002 111.579 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 525' ' ' ASN . . . . . . . . . . . . . . . -68.39 -40.35 81.38 Favored 'General case' 0 CA--C 1.51 -0.573 0 O-C-N 122.257 -0.277 . . . . 68.620000000000005 111.005 175.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 526' ' ' THR . . . . . . . . . . . . . . . -66.62 -42.96 85.99 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.042 -0.663 . . . . 72.590000000000003 111.352 176.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . . . -65.03 -38.52 82.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-O 120.787 0.327 . . . . 71.719999999999999 111.042 177.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . . . -72.68 -35.5 67.69 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 121.756 -0.59 . . . . 73.469999999999999 111.235 -179.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 529' ' ' GLU . . . . . . . . . . . . . . . -67.76 -33.97 75.89 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.837 -0.345 . . . . 74.730000000000004 110.958 174.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . . . -69.01 -33.26 73.36 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 119.822 -0.751 . . . . 74.599999999999994 110.977 171.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . . . -65.51 -27.91 42.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 120.815 0.34 . . . . 74.840000000000003 110.466 179.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 532' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.627 0 CA-C-O 121.777 0.798 . . . . 72.719999999999999 110.252 173.099 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 556' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 121.386 0.613 . . . . 28.280000000000001 110.21 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . . . -63.76 -30.42 71.52 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 119.792 -0.763 . . . . 30.52 110.281 158.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . . . . -66.97 -42.67 84.76 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 120.716 -0.394 . . . . 30.109999999999999 111.546 171.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 559' ' ' GLN . . . . . . . . . . . . . . . -70.52 -41.27 72.8 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.663 -0.415 . . . . 33.409999999999997 111.547 -177.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 560' ' ' PHE . . . . . . . . . . . . . . . -62.97 -35.64 80.86 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 120.854 -0.339 . . . . 31.649999999999999 111.008 172.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 561' ' ' VAL . . . . . 0.503 ' O ' ' CB ' ' A' ' 565' ' ' SER . . . -62.65 -45.23 99.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 C-N-CA 120.747 -0.381 . . . . 32.799999999999997 110.715 175.285 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 562' ' ' ASN . . . . . . . . . . . . . . . -67.7 -41.46 83.56 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 122.094 -0.379 . . . . 33.25 111.613 -177.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . . . -74.22 -55.74 5.7 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 120.399 -0.52 . . . . 33.329999999999998 111.701 -178.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 564' ' ' TYR . . . . . . . . . . . . . . . -76.76 -15.51 59.74 Favored 'General case' 0 C--O 1.235 0.294 0 O-C-N 121.868 -0.52 . . . . 31.690000000000001 112.193 -172.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 565' ' ' SER . . . . . 0.503 ' CB ' ' O ' ' A' ' 561' ' ' VAL . . . -64.74 -35.87 82.45 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 112.6 0.593 . . . . 34.060000000000002 112.6 -174.521 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 566' ' ' SER . . . . . . . . . . . . . . . -67.64 -39.93 84.62 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.274 -0.57 . . . . 34.640000000000001 111.378 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . . . -69.96 -47.7 61.26 Favored 'General case' 0 C--O 1.241 0.633 0 O-C-N 122.154 -0.341 . . . . 33.18 111.321 -179.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 568' ' ' PHE . . . . . . . . . . . . . . . -64.96 -28.4 69.49 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 120.632 -0.427 . . . . 32.380000000000003 111.123 174.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 569' ' ' TYR . . . . . . . . . . . . . . . -69.07 -35.4 76.49 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 121.95 -0.469 . . . . 36.700000000000003 111.323 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . . . -66.21 -48.97 79.5 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 C-N-CA 120.331 -0.547 . . . . 35.810000000000002 109.689 174.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -63.8 -25.94 68.4 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.776 -0.647 . . . . 36.649999999999999 112.43 -177.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 572' ' ' PHE . . . . . . . . . . . . . . . -86.28 -23.02 26.49 Favored 'General case' 0 C--O 1.233 0.209 0 O-C-N 121.78 -0.575 . . . . 35.869999999999997 111.832 167.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 573' ' ' PHE . . . . . . . . . . . . . . . -74.84 -37.21 62.31 Favored 'General case' 0 CA--C 1.509 -0.629 0 O-C-N 122.224 -0.297 . . . . 37.869999999999997 111.606 -167.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 574' ' ' LYS . . . . . . . . . . . . . . . -66.29 -29.96 70.29 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 118.173 -1.411 . . . . 37.770000000000003 110.838 168.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.447 0 N-CA-C 118.034 1.973 . . . . 37.640000000000001 118.034 -178.354 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 604' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.214 -0.793 0 N-CA-C 109.458 -0.571 . . . . 28.09 109.458 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 605' ' ' LEU . . . . . 0.428 ' O ' ' CB ' ' A' ' 609' ' ' LEU . . . -62.64 -30.92 71.72 Favored 'General case' 0 CA--C 1.513 -0.463 0 O-C-N 124.194 0.934 . . . . 29.460000000000001 111.188 -176.666 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 606' ' ' THR . . . . . . . . . . . . . . . -62.86 -52.08 64.51 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 120.076 -0.65 . . . . 29.190000000000001 110.695 169.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . . . -72.25 -42.39 65.69 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 120.6 -0.44 . . . . 29.27 111.82 -177.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 608' ' ' GLN . . . . . . . . . . . . . . . -69.12 -40.03 78.56 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 120.387 -0.525 . . . . 30.23 111.259 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 609' ' ' LEU . . . . . 0.428 ' CB ' ' O ' ' A' ' 605' ' ' LEU . . . -65.69 -40.29 92.17 Favored 'General case' 0 CA--C 1.516 -0.344 0 O-C-N 122.03 -0.419 . . . . 31.469999999999999 111.289 175.806 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . . . -68.9 -42.62 76.63 Favored 'General case' 0 CA--C 1.517 -0.322 0 O-C-N 122.311 -0.243 . . . . 32.789999999999999 111.378 179.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 611' ' ' ILE . . . . . . . . . . . . . . . -74.51 -33.76 33.68 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.381 0 O-C-N 122.073 -0.392 . . . . 34.450000000000003 111.164 -178.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 612' ' ' ILE . . . . . . . . . . . . . . . -69.77 -43.22 80.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 O-C-N 121.394 -0.816 . . . . 36.439999999999998 110.347 175.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 613' ' ' MET . . . . . . . . . . . . . . . -66.74 -48.84 67.9 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 121.959 -0.463 . . . . 37.840000000000003 111.123 177.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 614' ' ' GLY . . . . . . . . . . . . . . . -66.04 -36.37 91.88 Favored Glycine 0 C--O 1.221 -0.657 0 C-N-CA 121.095 -0.574 . . . . 40.789999999999999 113.195 178.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . -72.39 -36.49 59.36 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.078 -1.058 . . . . 42.640000000000001 112.416 179.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 616' ' ' LYS . . . . . . . . . . . . . . . -66.26 -32.14 73.37 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 119.312 -0.955 . . . . 43.140000000000001 110.382 171.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -67.76 -46.43 72.07 Favored 'General case' 0 C--O 1.231 0.123 0 N-CA-C 112.076 0.399 . . . . 45.799999999999997 112.076 175.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . . . -71.2 -36.1 60.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 O-C-N 122.067 -0.395 . . . . 48.240000000000002 110.6 -178.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 619' ' ' TRP . . . . . . . . . . . . . . . -69.32 -36.3 76.83 Favored 'General case' 0 CA--C 1.516 -0.343 0 O-C-N 121.583 -0.698 . . . . 50.600000000000001 111.038 175.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 620' ' ' ASN . . . . . . . . . . . . . . . -67.3 -32.96 74.3 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.421 -0.512 . . . . 51.240000000000002 111.266 173.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 621' ' ' ASN . . . . . . . . . . . . . . . -70.49 -37.49 74.21 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.412 -0.515 . . . . 54.229999999999997 111.491 176.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 622' ' ' ILE . . . . . . . . . . . . . . . -65.12 -36.13 77.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 120.88 0.372 . . . . 55.25 110.518 174.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 623' ' ' GLN . . . . . . . . . . . . . . . -68.21 -33.66 74.83 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 121.902 -0.499 . . . . 55.990000000000002 111.593 173.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 624' ' ' GLU . . . . . . . . . . . . . . . -68.69 -34.17 75.21 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 122.243 -0.286 . . . . 54.75 111.547 177.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 625' ' ' VAL . . . . . . . . . . . . . . . -73.07 -41.11 59.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.072 -0.651 . . . . 57.689999999999998 110.573 174.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . . . -90.06 2.54 55.11 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.872 1.064 . . . . 59.079999999999998 113.872 -172.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 627' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 118.682 0.674 . . . . 60.329999999999998 111.347 177.444 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 665' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.622 0 N-CA-C 110.178 -0.304 . . . . 44.770000000000003 110.178 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 666' ' ' TYR . . . . . . . . . . . . . . . -64.31 -32.46 74.07 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.293 -0.563 . . . . 44.880000000000003 110.856 175.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 667' ' ' GLU . . . . . . . . . . . . . . . -67.62 -43.92 79.25 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 116.716 -0.22 . . . . 44.409999999999997 111.488 176.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 668' ' ' TYR . . . . . . . . . . . . . . . -69.22 -26.62 64.9 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 120.459 -0.496 . . . . 40.700000000000003 110.678 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . . . -64.12 -42.6 96.8 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.444 -0.502 . . . . 40.890000000000001 111.098 170.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . . . -66.91 -42.77 84.86 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.19 -0.604 . . . . 40.640000000000001 111.372 179.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 671' ' ' MET . . . . . . . . . . . . . . . -70.18 -30.29 67.39 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 119.741 -0.784 . . . . 40.850000000000001 111.596 179.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 672' ' ' ILE . . . . . . . . . . . . . . . -72.89 -32.58 40.59 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 C-N-CA 120.151 -0.62 . . . . 41.07 110.04 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . . . -64.32 -35.61 74.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 120.106 -0.638 . . . . 41.18 109.994 170.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 674' ' ' GLN . . . . . . . . . . . . . . . -69.72 -34.62 74.13 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 119.869 -0.732 . . . . 42.25 111.577 175.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 675' ' ' PHE . . . . . . . . . . . . . . . -69.08 -34.53 75.28 Favored 'General case' 0 CA--C 1.509 -0.605 0 O-C-N 121.758 -0.589 . . . . 39.210000000000001 110.756 176.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 676' ' ' GLY . . . . . . . . . . . . . . . -64.65 -36.0 92.61 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 119.794 -1.193 . . . . 37.359999999999999 111.83 170.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 677' ' ' PHE . . . . . . . . . . . . . . . -63.11 -49.57 73.88 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 120.608 -0.437 . . . . 36.640000000000001 111.375 175.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 678' ' ' VAL . . . . . . . . . . . . . . . -70.0 -49.44 56.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.757 0.313 . . . . 37.119999999999997 110.362 -176.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 679' ' ' THR . . . . . . . . . . . . . . . -77.2 -44.53 29.75 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.695 0.628 . . . . 36.399999999999999 112.695 -173.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 680' ' ' LEU . . . . . . . . . . . . . . . -75.03 -34.92 61.93 Favored 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 121.427 -0.796 . . . . 37.369999999999997 111.707 -175.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 681' ' ' PHE . . . . . . . . . . . . . . . -111.57 29.58 7.71 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.664 0.616 . . . . 39.740000000000002 112.664 -175.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 682' ' ' VAL . . . . . . . . . . . . . . . -59.24 -28.06 38.23 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 C-N-CA 125.312 1.445 . . . . 39.880000000000003 112.484 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 683' ' ' ALA . . . . . . . . . . . . . . . -72.89 -17.37 61.52 Favored 'General case' 0 C--N 1.318 -0.761 0 C-N-CA 118.187 -1.405 . . . . 41.100000000000001 112.956 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 684' ' ' SER . . . . . . . . . . . . . . . -74.27 -75.01 0.17 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-N 118.949 0.795 . . . . 35.439999999999998 111.579 -175.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . . . -122.23 131.24 24.43 Favored Pre-proline 0 N--CA 1.438 -1.049 0 N-CA-C 103.588 -2.745 . . . . 39.219999999999999 103.588 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 686' ' ' PRO . . . . . . . . . . . . . . . -88.66 -17.32 2.22 Favored 'Trans proline' 0 C--O 1.238 0.511 0 N-CA-C 114.165 0.794 . . . . 38.93 114.165 -173.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . . . -80.0 3.64 19.48 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 119.266 0.939 . . . . 37.969999999999999 112.75 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -68.54 -20.3 0.52 Allowed Pre-proline 0 C--O 1.264 1.825 0 CA-C-O 117.922 -1.037 . . . . 37.68 112.84 -173.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 689' ' ' PRO . . . . . . . . . . . . . . . -67.63 -46.35 2.73 Favored 'Trans proline' 0 C--O 1.243 0.758 0 CA-C-N 122.169 1.81 . . . . 36.219999999999999 113.763 -176.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . . . -59.22 -41.12 87.92 Favored 'General case' 0 C--N 1.349 0.546 0 O-C-N 123.302 0.376 . . . . 36.609999999999999 111.659 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . . . -61.23 -20.77 63.19 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.368 0.667 . . . . 40.130000000000003 112.074 -177.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 692' ' ' ALA . . . . . . . . . . . . . . . -72.75 -62.83 1.31 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 118.01 -1.476 . . . . 43.270000000000003 111.209 171.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . . . -67.74 -35.37 78.62 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 120.638 0.256 . . . . 42.600000000000001 111.347 -159.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 694' ' ' VAL . . . . . . . . . . . . . . . -55.54 -49.49 73.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 C-N-CA 123.303 0.641 . . . . 44.280000000000001 110.127 176.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 695' ' ' ASN . . . . . . . . . . . . . . . -62.37 -40.19 95.63 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 116.4 -0.364 . . . . 45.039999999999999 110.916 176.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 696' ' ' ASN . . . . . . . . . . . . . . . -63.18 -32.21 73.55 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.242 -0.436 . . . . 45.700000000000003 111.464 -178.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . . . -68.73 -30.07 45.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 C-N-CA 118.864 -1.134 . . . . 43.829999999999998 109.91 -175.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 698' ' ' LEU . . . . . . . . . . . . . . . -67.4 -24.58 65.69 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 120.572 -0.451 . . . . 44.289999999999999 111.773 175.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . . . -62.29 -31.83 72.48 Favored 'General case' 0 C--N 1.344 0.333 0 O-C-N 122.422 -0.174 . . . . 44.68 111.366 174.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 700' ' ' ILE . . . . . . . . . . . . . . . -61.86 -35.58 68.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 C-N-CA 120.348 -0.541 . . . . 42.539999999999999 109.923 173.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 701' ' ' ARG . . . . . . . . . . . . . . . -60.84 -36.13 78.31 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 116.232 -0.44 . . . . 44.649999999999999 111.931 174.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 702' ' ' VAL . . . . . . . . . . . . . . . -66.41 -33.68 65.1 Favored 'Isoleucine or valine' 0 C--N 1.345 0.385 0 C-N-CA 120.398 -0.521 . . . . 42.079999999999998 110.336 177.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 703' ' ' ASP . . . . . . . . . . . . . . . -69.14 -29.8 67.92 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 119.456 -0.898 . . . . 43.130000000000003 110.387 172.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 704' ' ' ALA . . . . . . . . . . . . . . . -78.34 -23.78 46.83 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 112.445 0.535 . . . . 41.310000000000002 112.445 -174.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 705' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.254 0 N-CA-C 113.122 0.786 . . . . 40.670000000000002 113.122 -174.781 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 726' ' ' GLN . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.509 0 N-CA-C 110.369 -0.234 . . . . 34.409999999999997 110.369 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 727' ' ' PRO . . . . . . . . . . . . . . . -68.38 -42.68 5.13 Favored 'Trans proline' 0 C--O 1.237 0.425 0 O-C-N 123.247 1.13 . . . . 33.340000000000003 113.835 -176.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 728' ' ' ILE . . . . . . . . . . . . . . . -66.84 -33.39 63.12 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 C-N-CA 120.012 -0.675 . . . . 33.439999999999998 110.113 171.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 729' ' ' MET . . . . . . . . . . . . . . . -71.7 -43.67 65.53 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 120.138 -0.625 . . . . 33.640000000000001 111.87 179.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 730' ' ' GLN . . . . . . . . . . . . . . . -68.41 -29.81 68.57 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 120.043 -0.663 . . . . 32.009999999999998 110.912 176.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 731' ' ' GLY . . . . . . . . . . . . . . . -65.51 -41.64 96.13 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 119.849 -1.167 . . . . 33.799999999999997 112.299 170.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 732' ' ' ILE . . . . . . . . . . . . . . . -65.93 -25.8 36.99 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 O-C-N 122.664 -0.315 . . . . 33.82 110.262 174.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 733' ' ' ALA . . . . . . . . . . . . . . . -77.96 -41.29 36.62 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.776 -0.577 . . . . 33.5 112.159 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 734' ' ' ILE . . . . . . . . . . . . . . . -68.74 -39.64 80.46 Favored 'Isoleucine or valine' 0 C--O 1.241 0.63 0 C-N-CA 119.784 -0.767 . . . . 32.450000000000003 110.153 175.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . . . -65.45 -27.02 68.21 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 116.411 -0.358 . . . . 34.189999999999998 111.101 171.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 736' ' ' ALA . . . . . . . . . . . . . . . -75.7 -32.57 60.14 Favored 'General case' 0 CA--C 1.512 -0.508 0 O-C-N 122.09 -0.381 . . . . 33.759999999999998 111.686 176.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 737' ' ' VAL . . . . . . . . . . . . . . . -63.63 -49.69 81.25 Favored 'Isoleucine or valine' 0 C--O 1.242 0.692 0 C-N-CA 119.769 -0.772 . . . . 33.630000000000003 109.515 172.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 738' ' ' VAL . . . . . . . . . . . . . . . -63.64 -35.7 73.76 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.096 0 O-C-N 121.989 -0.444 . . . . 32.579999999999998 111.058 174.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 739' ' ' THR . . . . . . . . . . . . . . . -78.75 -37.69 40.57 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 121.756 -0.59 . . . . 31.629999999999999 111.374 -173.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 740' ' ' ASN . . . . . . . . . . . . . . . -73.53 -32.77 64.39 Favored 'General case' 0 CA--C 1.512 -0.491 0 O-C-N 121.824 -0.547 . . . . 30.32 110.385 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -65.85 -39.49 90.8 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 120.277 -0.569 . . . . 30.34 110.998 170.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . . . -74.82 -24.38 58.62 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.104 -0.638 . . . . 31.039999999999999 111.358 174.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 743' ' ' ILE . . . . . . . . . . . . . . . -73.52 -42.14 56.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 O-C-N 121.769 -0.582 . . . . 30.989999999999998 109.837 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . . . -67.06 -44.45 88.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 120.234 -0.586 . . . . 30.09 110.761 171.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 745' ' ' ALA . . . . . . . . . . . . . . . -76.41 -52.76 9.23 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 121.449 -0.782 . . . . 29.07 112.906 -172.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . . . -85.22 -52.15 6.12 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 121.177 -0.952 . . . . 31.010000000000002 110.692 -179.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 747' ' ' THR . . . . . . . . . . . . . . . -74.17 -41.12 61.98 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 118.061 -1.456 . . . . 32.200000000000003 112.644 -173.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 748' ' ' SER . . . . . . . . . . . . . . . -78.83 -36.24 42.84 Favored 'General case' 0 C--N 1.345 0.374 0 C-N-CA 118.155 -1.418 . . . . 31.530000000000001 114.016 -154.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 749' ' ' ASP . . . . . . . . . . . . . . . 52.08 52.45 14.36 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.903 0.881 . . . . 34.380000000000003 110.614 -159.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 750' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.742 0 C-N-CA 125.096 1.358 . . . . 36.799999999999997 111.641 176.638 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 829' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.532 0 CA-C-O 121.718 0.771 . . . . 15.59 110.352 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 830' ' ' HIS . . . . . . . . . . . . . . . -77.49 -29.61 52.66 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 114.482 -1.235 . . . . 15.68 113.093 -160.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . . . -71.53 -35.27 55.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 C-N-CA 119.998 -0.681 . . . . 17.609999999999999 111.435 -156.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 832' ' ' ILE . . . . . . . . . . . . . . . -64.15 -37.99 81.3 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 CA-C-O 121.369 0.604 . . . . 17.850000000000001 109.751 174.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 833' ' ' ALA . . . . . 0.461 ' HB2' ' HB2' ' B' ' 833' ' ' ALA . . . -69.96 -37.77 75.9 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 115.932 -0.576 . . . . 18.0 111.77 179.365 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 834' ' ' ALA . . . . . . . . . . . . . . . -76.18 -30.63 58.12 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.048 -0.661 . . . . 17.469999999999999 111.413 179.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 835' ' ' LYS . . . . . . . . . . . . . . . -64.51 -42.3 95.89 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 120.09 -0.644 . . . . 17.91 110.189 172.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 836' ' ' LEU . . . . . . . . . . . . . . . -66.75 -34.88 78.8 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.752 0.311 . . . . 19.329999999999998 111.012 175.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -73.14 -35.15 66.43 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 122.156 -0.34 . . . . 19.43 111.788 179.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 838' ' ' PHE . . . . . . . . . . . . . . . -70.11 -36.57 74.93 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 117.88 0.309 . . . . 19.899999999999999 110.551 175.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 839' ' ' ILE . . . . . . . . . . . . . . . -61.73 -39.7 84.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 C-N-CA 120.379 -0.528 . . . . 21.100000000000001 109.846 172.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 840' ' ' ILE . . . . . . . . . . . . . . . -70.09 -46.12 73.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.811 0.338 . . . . 22.07 111.031 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 841' ' ' VAL . . . . . . . . . . . . . . . -75.03 -39.87 44.49 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 O-C-N 121.882 -0.511 . . . . 23.449999999999999 110.963 -174.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 842' ' ' MET . . . . . . . . . . . . . . . -70.72 -37.48 73.52 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 121.756 -0.59 . . . . 23.510000000000002 110.999 177.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . . . -65.53 -36.35 83.56 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 120.257 -0.577 . . . . 24.550000000000001 111.093 172.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 844' ' ' HIS . . . . . . . . . . . . . . . -74.32 -41.21 61.5 Favored 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 112.065 0.395 . . . . 26.789999999999999 112.065 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 845' ' ' ILE . . . . . . . . . . . . . . . -73.93 -39.69 51.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 O-C-N 121.598 -0.689 . . . . 26.300000000000001 110.658 178.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 846' ' ' ILE . . . . . . . . . . . . . . . -75.2 -18.99 16.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.259 0 O-C-N 121.702 -0.624 . . . . 26.93 110.468 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 847' ' ' TYR . . . . . . . . . . . . . . . -84.48 -23.1 30.02 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.868 -0.52 . . . . 29.600000000000001 111.032 167.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 848' ' ' SER . . . . . . . . . . . . . . . -70.31 -43.64 69.92 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.159 -0.616 . . . . 29.960000000000001 110.691 174.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 849' ' ' VAL . . . . . . . . . . . . . . . -63.93 -34.13 66.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.84 0.352 . . . . 30.539999999999999 110.42 175.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 850' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.619 0 O-C-N 121.785 -0.572 . . . . 29.739999999999998 111.922 175.831 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 295' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.476 0 N-CA-C 110.628 -0.138 . . . . 47.560000000000002 110.628 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 296' ' ' ILE . . . . . . . . . . . . . . . -77.84 -34.21 19.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 120.95 0.405 . . . . 42.439999999999998 110.915 -178.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 297' ' ' GLY . . . . . . . . . . . . . . . -79.57 -45.38 8.66 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.349 -0.929 . . . . 42.090000000000003 114.113 -172.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . . . -67.45 -31.48 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.39 0 C-N-CA 120.103 -0.639 . . . . 40.759999999999998 110.077 176.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 299' ' ' TYR . . . . . . . . . . . . . . . -66.88 -33.74 76.27 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 119.915 -0.714 . . . . 39.979999999999997 111.05 169.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 300' ' ' PHE . . . . . . . . . . . . . . . -68.15 -45.35 73.79 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.337 -0.545 . . . . 39.020000000000003 111.22 178.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 301' ' ' ALA . . . . . . . . . . . . . . . -72.92 -21.13 60.94 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 121.61 -0.681 . . . . 38.439999999999998 111.331 175.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 302' ' ' TRP . . . . . . . . . . . . . . . -72.27 -37.1 69.12 Favored 'General case' 0 CA--C 1.512 -0.483 0 O-C-N 121.622 -0.674 . . . . 38.049999999999997 110.695 173.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 303' ' ' LEU . . . . . . . . . . . . . . . -63.54 -34.84 78.68 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 120.06 -0.656 . . . . 35.719999999999999 109.838 167.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 304' ' ' GLY . . . . . . . . . . . . . . . -65.96 -41.58 95.25 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.625 -0.798 . . . . 34.700000000000003 113.934 175.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 305' ' ' TYR . . . . . . . . . . . . . . . -73.74 -39.42 64.26 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 121.831 -0.805 . . . . 33.829999999999998 110.745 -177.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 306' ' ' TYR . . . . . . . . . . . . . . . -65.81 -33.38 75.71 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 119.404 -0.918 . . . . 33.549999999999997 110.566 172.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 307' ' ' THR . . . . . . . . . . . . . . . -69.71 -37.16 76.46 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.902 0.382 . . . . 33.859999999999999 111.631 176.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 308' ' ' GLN . . . . . . . . . . . . . . . -71.43 -47.84 53.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 121.677 -0.639 . . . . 32.630000000000003 111.954 178.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 309' ' ' MET . . . . . . . . . . . . . . . -65.65 -34.52 78.4 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.192 -0.603 . . . . 31.920000000000002 111.131 177.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 310' ' ' LEU . . . . . 0.507 ' O ' ' HB2' ' B' ' 314' ' ' ALA . . . -68.1 -31.32 70.84 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 120.406 -0.518 . . . . 30.649999999999999 110.763 174.115 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 311' ' ' LEU . . . . . . . . . . . . . . . -71.9 -39.69 69.37 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.82 -0.55 . . . . 32.630000000000003 112.432 174.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 312' ' ' LEU . . . . . . . . . . . . . . . -72.17 -44.16 63.46 Favored 'General case' 0 C--O 1.243 0.733 0 C-N-CA 119.135 -1.026 . . . . 32.25 111.067 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 313' ' ' ALA . . . . . . . . . . . . . . . -64.76 -23.35 67.22 Favored 'General case' 0 CA--C 1.518 -0.262 0 O-C-N 122.21 -0.306 . . . . 28.73 111.048 170.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 314' ' ' ALA . . . . . 0.507 ' HB2' ' O ' ' B' ' 310' ' ' LEU . . . -72.92 -31.65 64.78 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 112.205 0.446 . . . . 28.699999999999999 112.205 173.037 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 315' ' ' VAL . . . . . . . . . . . . . . . -69.13 -42.86 81.93 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 C-N-CA 120.16 -0.616 . . . . 30.640000000000001 110.206 174.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 316' ' ' VAL . . . . . . . . . . . . . . . -62.53 -40.66 89.07 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 CA-C-O 121.081 0.467 . . . . 28.469999999999999 110.679 174.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 317' ' ' GLY . . . . . . . . . . . . . . . -68.57 -34.93 79.96 Favored Glycine 0 C--O 1.225 -0.438 0 C-N-CA 120.785 -0.722 . . . . 27.960000000000001 113.558 177.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 318' ' ' VAL . . . . . . . . . . . . . . . -67.9 -35.92 73.87 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-N 117.348 0.574 . . . . 27.699999999999999 110.681 176.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 319' ' ' ALA . . . . . . . . . . . . . . . -63.57 -45.62 89.61 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.533 -0.467 . . . . 28.149999999999999 111.156 175.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 320' ' ' CYS . . . . . . . . . . . . . . . -70.71 -19.49 62.75 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 119.206 -0.998 . . . . 28.100000000000001 111.804 175.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 321' ' ' PHE . . . . . . . . . . . . . . . -76.11 -31.15 58.53 Favored 'General case' 0 C--O 1.237 0.425 0 O-C-N 121.877 -0.514 . . . . 28.710000000000001 112.079 176.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 322' ' ' LEU . . . . . . . . . . . . . . . -61.93 -36.86 82.62 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.365 -0.534 . . . . 29.75 110.708 172.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 323' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.801 0 CA-C-O 121.0 0.429 . . . . 27.920000000000002 109.881 166.601 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 377' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.596 0 N-CA-C 109.257 -0.646 . . . . 84.629999999999995 109.257 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 378' ' ' GLY . . . . . . . . . . . . . . . -72.11 -34.5 61.48 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.171 -1.014 . . . . 82.099999999999994 111.932 173.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 379' ' ' THR . . . . . . . . . . . . . . . -66.49 -40.51 89.31 Favored 'General case' 0 C--O 1.232 0.183 0 O-C-N 122.368 -0.489 . . . . 79.620000000000005 110.965 172.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . . . -71.55 -30.92 66.43 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 122.21 -0.306 . . . . 81.590000000000003 111.399 174.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 381' ' ' ILE . . . . . . . . . . . . . . . -63.7 -41.55 92.98 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 C-N-CA 119.855 -0.738 . . . . 82.180000000000007 110.074 171.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 382' ' ' PHE . . . . . . . . . . . . . . . -63.17 -34.04 76.77 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 116.696 -0.229 . . . . 81.670000000000002 111.156 172.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . -72.91 -49.25 30.77 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.87 -0.332 . . . . 81.980000000000004 111.331 -175.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 384' ' ' VAL . . . . . . . . . . . . . . . -66.13 -33.54 64.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 C-N-CA 120.373 -0.531 . . . . 82.030000000000001 110.214 175.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 385' ' ' PHE . . . . . . . . . . . . . . . -63.83 -35.19 79.81 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 121.122 -0.231 . . . . 84.840000000000003 111.071 171.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 386' ' ' MET . . . . . . . . . . . . . . . -74.9 -29.27 60.93 Favored 'General case' 0 CA--C 1.514 -0.411 0 O-C-N 122.028 -0.42 . . . . 84.319999999999993 110.967 179.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 387' ' ' GLY . . . . . . . . . . . . . . . -65.31 -46.31 87.26 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.044 -1.074 . . . . 87.379999999999995 111.224 171.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . . . -63.48 -31.12 51.69 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.092 0 C-N-CA 120.881 -0.327 . . . . 88.469999999999999 110.649 172.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 389' ' ' TRP . . . . . . . . . . . . . . . -75.49 -35.63 60.76 Favored 'General case' 0 CA--C 1.515 -0.375 0 O-C-N 121.957 -0.464 . . . . 88.599999999999994 111.185 -177.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 390' ' ' VAL . . . . . . . . . . . . . . . -65.47 -40.75 89.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 109.355 -0.609 . . . . 89.959999999999994 109.355 174.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 391' ' ' THR . . . . . . . . . . . . . . . -64.43 -47.34 79.47 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 120.899 0.38 . . . . 90.900000000000006 111.763 176.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 392' ' ' LEU . . . . . . . . . . . . . . . -68.3 -32.07 71.95 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 122.345 -0.222 . . . . 94.379999999999995 111.554 178.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 393' ' ' PHE . . . . . . . . . . . . . . . -66.58 -44.88 81.01 Favored 'General case' 0 CA--C 1.514 -0.438 0 O-C-N 122.279 -0.263 . . . . 94.870000000000005 110.808 177.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 394' ' ' LEU . . . . . . . . . . . . . . . -62.45 -38.49 89.97 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 120.823 -0.351 . . . . 95.989999999999995 111.434 174.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 395' ' ' GLU . . . . . . . . . . . . . . . -66.14 -52.81 44.91 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.706 -0.398 . . . . 100.06 112.06 179.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 396' ' ' PHE . . . . . . . . . . . . . . . -69.63 -32.39 71.04 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.69 -0.404 . . . . 103.19 111.562 -177.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 397' ' ' TRP . . . . . . . . . . . . . . . -66.99 -34.44 77.76 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.556 -0.458 . . . . 104.61 110.545 174.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 398' ' ' LYS . . . . . . . . . . . . . . . -65.02 -38.6 91.42 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.38 -0.528 . . . . 106.14 111.169 172.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 399' ' ' ARG . . . . . . . . . . . . . . . -66.7 -46.08 76.7 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 120.49 -0.484 . . . . 106.66 111.883 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 400' ' ' ARG . . . . . . . . . . . . . . . -68.92 -30.07 68.47 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.592 -0.443 . . . . 108.13 110.815 178.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 401' ' ' GLN . . . . . . . . . . . . . . . -61.95 -40.7 96.45 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 120.694 0.283 . . . . 109.03 111.041 173.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 402' ' ' ALA . . . . . . . . . . . . . . . -66.44 -44.01 84.06 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 120.797 -0.361 . . . . 109.95999999999999 111.419 176.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 403' ' ' GLU . . . . . . . . . . . . . . . -70.66 -31.37 68.26 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.392 0.516 . . . . 108.42 112.392 -175.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 404' ' ' LEU . . . . . . . . . . . . . . . -77.2 -44.86 28.56 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 113.034 0.753 . . . . 109.66 113.034 -163.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 405' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.31 0 O-C-N 121.902 -0.499 . . . . 111.75 112.34 -173.769 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 455' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.071 0 CA-C-O 121.042 0.449 . . . . 97.400000000000006 110.958 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 456' ' ' CYS . . . . . . . . . . . . . . . -68.4 -25.0 64.83 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.827 -0.624 . . . . 95.609999999999999 111.167 168.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 457' ' ' ALA . . . . . . . . . . . . . . . -66.2 -39.33 89.57 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 111.79 0.292 . . . . 97.170000000000002 111.79 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 458' ' ' SER . . . . . . . . . . . . . . . -66.54 -36.12 81.91 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 120.459 -0.496 . . . . 95.730000000000004 110.989 175.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 459' ' ' ALA . . . . . . . . . . . . . . . -64.12 -34.04 77.14 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 120.858 -0.337 . . . . 94.829999999999998 111.078 172.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 460' ' ' VAL . . . . . . . . . . . . . . . -67.63 -43.31 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.293 0 CA-C-O 120.798 0.332 . . . . 93.989999999999995 110.586 178.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 461' ' ' PHE . . . . . . . . . . . . . . . -67.6 -34.22 76.56 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.348 -0.541 . . . . 92.489999999999995 111.48 178.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 462' ' ' PHE . . . . . . . . . . . . . . . -68.81 -39.82 79.85 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.571 -0.452 . . . . 92.040000000000006 111.44 175.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 463' ' ' TRP . . . . . . . . . . . . . . . -65.49 -29.14 69.76 Favored 'General case' 0 CA--C 1.517 -0.319 0 O-C-N 122.205 -0.309 . . . . 90.439999999999998 111.253 173.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 464' ' ' ILE . . . . . . . . . . . . . . . -69.9 -39.26 77.42 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 CA-C-O 121.516 0.674 . . . . 94.420000000000002 110.608 175.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 465' ' ' LEU . . . . . . . . . . . . . . . -63.87 -42.69 97.47 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 121.966 -0.459 . . . . 90.870000000000005 111.066 174.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . . . -65.85 -29.16 69.57 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 120.914 -0.314 . . . . 92.040000000000006 111.233 174.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 467' ' ' ILE . . . . . . . . . . . . . . . -65.81 -38.84 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 109.992 -0.373 . . . . 91.299999999999997 109.992 174.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 468' ' ' ILE . . . . . . . . . . . . . . . -65.93 -35.15 74.41 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-O 121.04 0.448 . . . . 90.829999999999998 110.547 174.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 469' ' ' ALA . . . . . . . . . . . . . . . -68.18 -38.92 82.55 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.398 -0.365 . . . . 89.879999999999995 111.514 178.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 470' ' ' SER . . . . . . . . . . . . . . . -69.39 -30.46 68.45 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.343 -0.543 . . . . 87.890000000000001 110.596 172.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 471' ' ' VAL . . . . . . . . . . . . . . . -68.15 -34.41 66.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 C-N-CA 122.78 0.432 . . . . 84.980000000000004 110.992 -178.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 472' ' ' ILE . . . . . . . . . . . . . . . -61.67 -29.62 46.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-O 121.047 0.451 . . . . 85.659999999999997 110.95 173.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 473' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.821 0 N-CA-C 111.287 -0.725 . . . . 86.079999999999998 111.287 169.078 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 511' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.404 0 N-CA-C 109.404 -0.591 . . . . 64.640000000000001 109.404 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 512' ' ' THR . . . . . . . . . . . . . . . -68.17 -28.73 67.54 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.013 -0.54 . . . . 63.340000000000003 110.989 170.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.53 -37.81 88.73 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.57 -0.286 . . . . 62.520000000000003 111.758 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 514' ' ' SER . . . . . . . . . . . . . . . -67.74 -29.7 69.0 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.088 -0.645 . . . . 60.990000000000002 111.247 174.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 515' ' ' ILE . . . . . . . . . . . . . . . -69.54 -42.58 80.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 120.292 -0.563 . . . . 60.780000000000001 110.804 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 516' ' ' ILE . . . . . . . . . . . . . . . -67.82 -36.54 76.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 O-C-N 121.918 -0.489 . . . . 61.609999999999999 110.629 176.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 517' ' ' SER . . . . . . . . . . . . . . . -67.03 -37.72 84.63 Favored 'General case' 0 CA--C 1.515 -0.393 0 O-C-N 122.038 -0.414 . . . . 61.700000000000003 111.234 176.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 518' ' ' PHE . . . . . . . . . . . . . . . -68.34 -33.21 73.88 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.531 -0.468 . . . . 61.43 110.933 175.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 519' ' ' ILE . . . . . . . . . . . . . . . -67.2 -51.12 56.7 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 120.434 -0.506 . . . . 60.600000000000001 110.73 178.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 520' ' ' ILE . . . . . . . . . . . . . . . -68.39 -32.1 54.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.632 -0.427 . . . . 61.189999999999998 110.809 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 521' ' ' ILE . . . . . . . . . . . . . . . -70.69 -31.23 45.33 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 O-C-N 121.778 -0.576 . . . . 63.350000000000001 109.996 177.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 522' ' ' MET . . . . . . . . . . . . . . . -66.65 -48.68 68.62 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.12 0.486 . . . . 62.899999999999999 111.297 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 523' ' ' ILE . . . . . . . . . . . . . . . -64.19 -43.19 97.29 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 C-N-CA 120.619 -0.432 . . . . 61.450000000000003 110.89 178.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . . . -67.56 -29.72 69.16 Favored 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 122.033 -0.417 . . . . 61.049999999999997 111.474 178.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . . . -68.38 -40.35 81.41 Favored 'General case' 0 CA--C 1.509 -0.612 0 C-N-CA 120.98 -0.288 . . . . 60.560000000000002 110.992 175.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 526' ' ' THR . . . . . . . . . . . . . . . -66.62 -42.93 86.04 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.026 -0.67 . . . . 63.5 111.383 176.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 527' ' ' ILE . . . . . . . . . . . . . . . -65.01 -38.53 83.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 120.816 0.341 . . . . 61.439999999999998 111.047 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 528' ' ' TYR . . . . . . . . . . . . . . . -72.62 -35.5 67.84 Favored 'General case' 0 CA--C 1.518 -0.276 0 O-C-N 121.649 -0.657 . . . . 63.579999999999998 111.308 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . . . -67.77 -33.96 75.85 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.836 -0.346 . . . . 65.060000000000002 110.989 174.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 530' ' ' LYS . . . . . . . . . . . . . . . -68.93 -33.35 73.58 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.859 -0.736 . . . . 64.659999999999997 110.986 171.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 531' ' ' VAL . . . . . . . . . . . . . . . -65.46 -27.93 43.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-O 120.918 0.39 . . . . 63.740000000000002 110.516 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 532' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.629 0 CA-C-O 121.885 0.85 . . . . 63.100000000000001 110.328 173.126 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 556' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.509 0 CA-C-O 121.388 0.614 . . . . 40.799999999999997 110.154 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 557' ' ' LEU . . . . . . . . . . . . . . . -63.71 -30.43 71.54 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 119.849 -0.74 . . . . 40.210000000000001 110.254 158.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 558' ' ' PHE . . . . . . . . . . . . . . . -67.04 -42.66 84.45 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 120.788 -0.365 . . . . 41.219999999999999 111.474 171.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 559' ' ' GLN . . . . . . . . . . . . . . . -70.61 -41.26 72.52 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 120.69 -0.404 . . . . 43.240000000000002 111.521 -177.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 560' ' ' PHE . . . . . . . . . . . . . . . -62.91 -35.67 80.83 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 120.872 -0.331 . . . . 41.969999999999999 110.993 171.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 561' ' ' VAL . . . . . 0.512 ' O ' ' CB ' ' B' ' 565' ' ' SER . . . -62.7 -45.26 99.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 C-N-CA 120.788 -0.365 . . . . 42.259999999999998 110.687 175.362 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 562' ' ' ASN . . . . . . . . . . . . . . . -67.73 -41.29 83.69 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 122.082 -0.386 . . . . 43.43 111.672 -177.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 563' ' ' TYR . . . . . . . . . . . . . . . -74.22 -55.77 5.67 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 120.452 -0.499 . . . . 44.560000000000002 111.688 -178.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 564' ' ' TYR . . . . . . . . . . . . . . . -76.81 -15.5 59.71 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 121.944 -0.472 . . . . 43.939999999999998 112.207 -172.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 565' ' ' SER . . . . . 0.512 ' CB ' ' O ' ' B' ' 561' ' ' VAL . . . -64.68 -35.89 82.49 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 112.631 0.604 . . . . 46.770000000000003 112.631 -174.541 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 566' ' ' SER . . . . . . . . . . . . . . . -67.63 -39.91 84.63 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.253 -0.579 . . . . 49.43 111.39 178.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 567' ' ' CYS . . . . . . . . . . . . . . . -70.01 -47.74 60.91 Favored 'General case' 0 C--O 1.241 0.627 0 O-C-N 122.127 -0.358 . . . . 48.82 111.307 -179.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . . . -64.9 -28.46 69.55 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 120.599 -0.441 . . . . 47.409999999999997 111.119 173.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 569' ' ' TYR . . . . . . . . . . . . . . . -69.06 -35.47 76.58 Favored 'General case' 0 CA--C 1.515 -0.38 0 O-C-N 121.975 -0.453 . . . . 52.460000000000001 111.268 175.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 570' ' ' ILE . . . . . . . . . . . . . . . -66.07 -49.01 79.62 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 CA-C-O 121.247 0.546 . . . . 54.030000000000001 109.754 174.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 571' ' ' ALA . . . . . . . . . . . . . . . -63.77 -25.89 68.39 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.749 -0.66 . . . . 55.670000000000002 112.48 -177.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . . . -86.36 -22.99 26.36 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 121.821 -0.55 . . . . 55.049999999999997 111.814 167.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 573' ' ' PHE . . . . . . . . . . . . . . . -74.87 -37.16 62.25 Favored 'General case' 0 CA--C 1.508 -0.637 0 O-C-N 122.23 -0.294 . . . . 55.539999999999999 111.649 -167.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 574' ' ' LYS . . . . . . . . . . . . . . . -66.39 -29.81 70.05 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 118.117 -1.433 . . . . 55.359999999999999 110.879 168.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 575' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.461 0 N-CA-C 118.016 1.966 . . . . 56.18 118.016 -178.411 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 604' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.213 -0.829 0 N-CA-C 109.461 -0.57 . . . . 23.640000000000001 109.461 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 605' ' ' LEU . . . . . 0.427 ' O ' ' CB ' ' B' ' 609' ' ' LEU . . . -62.68 -30.87 71.72 Favored 'General case' 0 CA--C 1.513 -0.462 0 O-C-N 124.216 0.948 . . . . 26.07 111.199 -176.647 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 606' ' ' THR . . . . . . . . . . . . . . . -62.9 -52.09 64.41 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 120.112 -0.635 . . . . 26.550000000000001 110.653 169.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 607' ' ' THR . . . . . . . . . . . . . . . -72.15 -42.48 65.89 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 120.653 -0.419 . . . . 26.949999999999999 111.82 -177.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 608' ' ' GLN . . . . . . . . . . . . . . . -69.1 -40.01 78.64 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 120.369 -0.532 . . . . 28.93 111.23 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 609' ' ' LEU . . . . . 0.427 ' CB ' ' O ' ' B' ' 605' ' ' LEU . . . -65.7 -40.37 92.22 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 120.658 -0.417 . . . . 29.280000000000001 111.265 175.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 610' ' ' THR . . . . . . . . . . . . . . . -68.77 -42.66 77.15 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 121.115 -0.234 . . . . 30.32 111.434 179.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 611' ' ' ILE . . . . . . . . . . . . . . . -74.51 -33.74 33.58 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.349 0 O-C-N 122.065 -0.397 . . . . 32.18 111.087 -178.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 612' ' ' ILE . . . . . . . . . . . . . . . -69.83 -43.16 79.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 O-C-N 121.497 -0.752 . . . . 34.939999999999998 110.385 175.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 613' ' ' MET . . . . . . . . . . . . . . . -66.72 -48.85 67.93 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.909 -0.495 . . . . 36.369999999999997 111.144 177.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 614' ' ' GLY . . . . . . . . . . . . . . . -65.98 -36.38 91.96 Favored Glycine 0 C--O 1.221 -0.685 0 C-N-CA 121.16 -0.543 . . . . 39.200000000000003 113.197 178.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 615' ' ' GLY . . . . . . . . . . . . . . . -72.47 -36.39 59.11 Favored Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 120.035 -1.079 . . . . 39.490000000000002 112.435 179.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 616' ' ' LYS . . . . . . . . . . . . . . . -66.27 -32.17 73.43 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.418 -0.913 . . . . 42.049999999999997 110.357 171.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 617' ' ' ALA . . . . . . . . . . . . . . . -67.78 -46.35 72.23 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 112.118 0.414 . . . . 43.799999999999997 112.118 175.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 618' ' ' ILE . . . . . . . . . . . . . . . -71.26 -36.04 60.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 O-C-N 121.968 -0.457 . . . . 46.649999999999999 110.596 -178.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 619' ' ' TRP . . . . . . . . . . . . . . . -69.49 -36.18 76.27 Favored 'General case' 0 CA--C 1.517 -0.309 0 O-C-N 121.566 -0.709 . . . . 48.25 111.02 176.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 620' ' ' ASN . . . . . . . . . . . . . . . -67.19 -33.03 74.51 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.398 -0.521 . . . . 49.609999999999999 111.382 173.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 621' ' ' ASN . . . . . . . . . . . . . . . -70.4 -37.54 74.49 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.396 -0.522 . . . . 51.060000000000002 111.498 176.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 622' ' ' ILE . . . . . . . . . . . . . . . -65.17 -36.06 76.86 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 120.902 0.382 . . . . 52.18 110.508 174.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 623' ' ' GLN . . . . . . . . . . . . . . . -68.23 -33.7 74.89 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 121.891 -0.506 . . . . 55.340000000000003 111.581 173.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 624' ' ' GLU . . . . . . . . . . . . . . . -68.61 -34.26 75.46 Favored 'General case' 0 C--O 1.234 0.249 0 O-C-N 122.141 -0.349 . . . . 54.329999999999998 111.597 177.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 625' ' ' VAL . . . . . . . . . . . . . . . -72.99 -41.12 59.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 C-N-CA 120.087 -0.645 . . . . 55.710000000000001 110.641 174.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 626' ' ' LEU . . . . . . . . . . . . . . . -90.02 2.58 55.02 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 113.969 1.1 . . . . 56.299999999999997 113.969 -172.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 627' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 118.723 0.692 . . . . 57.259999999999998 111.372 177.391 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 665' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.603 0 N-CA-C 110.186 -0.302 . . . . 45.130000000000003 110.186 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 666' ' ' TYR . . . . . . . . . . . . . . . -64.39 -32.46 74.08 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 120.176 -0.61 . . . . 42.770000000000003 110.782 175.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . . . -67.48 -43.97 79.7 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 111.557 0.206 . . . . 43.93 111.557 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 668' ' ' TYR . . . . . . . . . . . . . . . -69.29 -26.55 64.79 Favored 'General case' 0 CA--C 1.512 -0.519 0 C-N-CA 120.399 -0.52 . . . . 39.920000000000002 110.698 176.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . . . -64.08 -42.59 96.91 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.421 -0.511 . . . . 39.07 111.194 170.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 670' ' ' GLU . . . . . . . . . . . . . . . -66.91 -42.77 84.9 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.262 -0.575 . . . . 37.340000000000003 111.42 179.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 671' ' ' MET . . . . . . . . . . . . . . . -70.22 -30.26 67.3 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 119.776 -0.769 . . . . 38.020000000000003 111.542 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 672' ' ' ILE . . . . . . . . . . . . . . . -72.87 -32.62 40.82 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.436 0 C-N-CA 120.129 -0.629 . . . . 36.700000000000003 110.073 177.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 673' ' ' ILE . . . . . . . . . . . . . . . -64.26 -35.61 74.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.109 -0.636 . . . . 36.149999999999999 109.992 170.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 674' ' ' GLN . . . . . . . . . . . . . . . -69.75 -34.68 74.15 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 119.895 -0.722 . . . . 36.490000000000002 111.49 175.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 675' ' ' PHE . . . . . . . . . . . . . . . -69.12 -34.44 75.06 Favored 'General case' 0 CA--C 1.51 -0.593 0 O-C-N 121.855 -0.528 . . . . 33.159999999999997 110.795 176.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 676' ' ' GLY . . . . . . . . . . . . . . . -64.58 -36.07 92.7 Favored Glycine 0 N--CA 1.443 -0.859 0 C-N-CA 119.839 -1.172 . . . . 32.990000000000002 111.823 170.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 677' ' ' PHE . . . . . . . . . . . . . . . -63.18 -49.53 73.92 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 120.612 -0.435 . . . . 32.170000000000002 111.342 175.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 678' ' ' VAL . . . . . . . . . . . . . . . -69.99 -49.44 56.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.738 0.304 . . . . 31.390000000000001 110.371 -176.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 679' ' ' THR . . . . . . . . . . . . . . . -77.26 -44.45 29.8 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.764 0.653 . . . . 30.34 112.764 -173.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 680' ' ' LEU . . . . . . . . . . . . . . . -75.07 -34.84 61.84 Favored 'General case' 0 CA--C 1.513 -0.476 0 O-C-N 121.466 -0.771 . . . . 31.760000000000002 111.684 -175.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 681' ' ' PHE . . . . . . . . . . . . . . . -111.69 29.6 7.71 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.665 0.617 . . . . 33.909999999999997 112.665 -175.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 682' ' ' VAL . . . . . . . . . . . . . . . -59.19 -28.07 38.11 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.554 0 C-N-CA 125.339 1.456 . . . . 34.380000000000003 112.484 -176.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 683' ' ' ALA . . . . . . . . . . . . . . . -72.89 -17.38 61.52 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 118.136 -1.426 . . . . 35.770000000000003 112.959 -179.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 684' ' ' SER . . . . . . . . . . . . . . . -74.24 -74.88 0.17 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-N 118.918 0.781 . . . . 31.350000000000001 111.675 -175.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . . . -122.38 131.29 24.41 Favored Pre-proline 0 N--CA 1.438 -1.051 0 N-CA-C 103.505 -2.776 . . . . 34.68 103.505 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 686' ' ' PRO . . . . . . . . . . . . . . . -88.6 -17.39 2.24 Favored 'Trans proline' 0 C--O 1.239 0.55 0 N-CA-C 114.124 0.778 . . . . 36.600000000000001 114.124 -173.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 687' ' ' LEU . . . . . . . . . . . . . . . -79.97 3.61 19.5 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 119.365 0.984 . . . . 35.590000000000003 112.778 178.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 688' ' ' ALA . . . . . . . . . . . . . . . -68.37 -20.51 0.54 Allowed Pre-proline 0 C--O 1.262 1.73 0 CA-C-O 117.91 -1.043 . . . . 34.979999999999997 112.822 -173.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 689' ' ' PRO . . . . . . . . . . . . . . . -67.59 -46.28 2.81 Favored 'Trans proline' 0 C--O 1.244 0.778 0 CA-C-N 122.143 1.801 . . . . 34.039999999999999 113.759 -176.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 690' ' ' LEU . . . . . . . . . . . . . . . -59.27 -41.24 88.42 Favored 'General case' 0 C--O 1.239 0.507 0 O-C-N 123.334 0.396 . . . . 34.420000000000002 111.606 -179.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . . . -61.1 -20.75 63.0 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.388 0.675 . . . . 38.789999999999999 112.091 -177.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 692' ' ' ALA . . . . . . . . . . . . . . . -72.83 -62.71 1.36 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 117.981 -1.488 . . . . 42.539999999999999 111.221 171.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 693' ' ' LEU . . . . . . . . . . . . . . . -67.8 -35.46 78.69 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 120.638 0.256 . . . . 43.270000000000003 111.243 -159.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 694' ' ' VAL . . . . . . . . . . . . . . . -55.54 -49.46 73.41 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 C-N-CA 123.353 0.661 . . . . 46.420000000000002 110.069 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 695' ' ' ASN . . . . . . . . . . . . . . . -62.39 -40.15 95.53 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 116.426 -0.352 . . . . 47.899999999999999 110.945 176.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 696' ' ' ASN . . . . . . . . . . . . . . . -63.33 -31.96 73.26 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.262 -0.426 . . . . 50.68 111.485 -178.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . . . -68.83 -30.12 45.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 118.817 -1.153 . . . . 49.280000000000001 109.892 -175.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 698' ' ' LEU . . . . . . . . . . . . . . . -67.35 -24.55 65.72 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 120.585 -0.446 . . . . 53.229999999999997 111.812 175.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 699' ' ' GLU . . . . . . . . . . . . . . . -62.33 -31.73 72.4 Favored 'General case' 0 C--N 1.342 0.282 0 N-CA-C 111.408 0.151 . . . . 54.670000000000002 111.408 174.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 700' ' ' ILE . . . . . . . . . . . . . . . -62.01 -35.5 68.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 C-N-CA 120.34 -0.544 . . . . 54.640000000000001 109.89 173.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 701' ' ' ARG . . . . . . . . . . . . . . . -60.85 -36.11 78.3 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 116.301 -0.408 . . . . 56.439999999999998 111.884 174.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 702' ' ' VAL . . . . . . . . . . . . . . . -66.45 -33.65 64.9 Favored 'Isoleucine or valine' 0 C--N 1.346 0.433 0 C-N-CA 120.374 -0.53 . . . . 55.240000000000002 110.314 178.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 703' ' ' ASP . . . . . . . . . . . . . . . -69.05 -29.85 68.08 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 119.488 -0.885 . . . . 57.159999999999997 110.383 172.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 704' ' ' ALA . . . . . . . . . . . . . . . -78.35 -23.78 46.78 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 112.411 0.523 . . . . 55.880000000000003 112.411 -174.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 705' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.213 0 N-CA-C 113.112 0.782 . . . . 58.130000000000003 113.112 -174.769 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 726' ' ' GLN . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.504 0 N-CA-C 110.348 -0.242 . . . . 33.200000000000003 110.348 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 727' ' ' PRO . . . . . . . . . . . . . . . -68.28 -42.74 5.22 Favored 'Trans proline' 0 C--O 1.237 0.466 0 O-C-N 123.219 1.115 . . . . 33.670000000000002 113.849 -176.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 728' ' ' ILE . . . . . . . . . . . . . . . -66.76 -33.48 63.71 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.327 0 C-N-CA 120.07 -0.652 . . . . 34.030000000000001 110.114 171.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 729' ' ' MET . . . . . . . . . . . . . . . -71.69 -43.63 65.64 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 120.094 -0.642 . . . . 33.369999999999997 111.869 179.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 730' ' ' GLN . . . . . . . . . . . . . . . -68.4 -29.85 68.63 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 119.988 -0.685 . . . . 32.68 110.946 176.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 731' ' ' GLY . . . . . . . . . . . . . . . -65.45 -41.74 96.21 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 119.853 -1.165 . . . . 35.789999999999999 112.282 170.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 732' ' ' ILE . . . . . . . . . . . . . . . -65.78 -25.96 37.61 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.154 0 O-C-N 122.651 -0.323 . . . . 36.130000000000003 110.233 174.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 733' ' ' ALA . . . . . . . . . . . . . . . -77.85 -41.32 37.31 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 121.903 -0.498 . . . . 36.030000000000001 112.194 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 734' ' ' ILE . . . . . . . . . . . . . . . -68.74 -39.65 80.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.599 0 C-N-CA 119.786 -0.766 . . . . 34.710000000000001 110.13 175.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 735' ' ' LEU . . . . . . . . . . . . . . . -65.39 -27.07 68.29 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.443 -0.344 . . . . 35.579999999999998 111.104 171.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 736' ' ' ALA . . . . . . . . . . . . . . . -75.73 -32.53 60.06 Favored 'General case' 0 CA--C 1.512 -0.507 0 O-C-N 122.077 -0.389 . . . . 34.5 111.672 176.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 737' ' ' VAL . . . . . . . . . . . . . . . -63.7 -49.66 81.26 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 C-N-CA 119.766 -0.774 . . . . 34.009999999999998 109.473 172.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 738' ' ' VAL . . . . . . . . . . . . . . . -63.66 -35.63 73.53 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 O-C-N 122.089 -0.382 . . . . 32.25 111.078 174.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 739' ' ' THR . . . . . . . . . . . . . . . -78.74 -37.82 40.35 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.74 -0.6 . . . . 31.260000000000002 111.33 -173.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 740' ' ' ASN . . . . . . . . . . . . . . . -73.42 -32.82 64.62 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 121.824 -0.547 . . . . 29.219999999999999 110.404 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 741' ' ' ALA . . . . . . . . . . . . . . . -65.79 -39.47 90.97 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.337 -0.545 . . . . 29.390000000000001 111.091 170.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 742' ' ' MET . . . . . . . . . . . . . . . -74.76 -24.54 58.7 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.102 -0.639 . . . . 29.920000000000002 111.346 174.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 743' ' ' ILE . . . . . . . . . . . . . . . -73.51 -42.1 56.12 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 O-C-N 121.81 -0.556 . . . . 29.609999999999999 109.848 178.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 744' ' ' ILE . . . . . . . . . . . . . . . -66.96 -44.53 88.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 O-C-N 121.799 -0.563 . . . . 28.98 110.846 171.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 745' ' ' ALA . . . . . . . . . . . . . . . -76.41 -52.7 9.36 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.437 -0.789 . . . . 27.93 112.971 -172.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 746' ' ' PHE . . . . . . . . . . . . . . . -85.22 -52.23 6.06 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 121.033 -1.042 . . . . 30.420000000000002 110.62 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 747' ' ' THR . . . . . . . . . . . . . . . -74.11 -41.22 61.97 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 118.112 -1.435 . . . . 30.739999999999998 112.627 -173.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 748' ' ' SER . . . . . . . . . . . . . . . -78.71 -36.27 43.67 Favored 'General case' 0 C--N 1.346 0.438 0 C-N-CA 118.103 -1.439 . . . . 30.539999999999999 114.044 -154.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 749' ' ' ASP . . . . . . . . . . . . . . . 52.06 52.5 14.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.873 0.869 . . . . 32.619999999999997 110.68 -159.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 750' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.717 0 C-N-CA 125.034 1.334 . . . . 34.469999999999999 111.651 176.664 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 829' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.434 0 CA-C-O 121.678 0.751 . . . . 16.690000000000001 110.352 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 830' ' ' HIS . . . . . . . . . . . . . . . -77.41 -29.69 53.14 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 114.495 -1.23 . . . . 16.879999999999999 113.078 -160.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 831' ' ' VAL . . . . . . . . . . . . . . . -71.48 -35.31 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 C-N-CA 120.028 -0.669 . . . . 21.059999999999999 111.382 -156.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 832' ' ' ILE . . . . . . . . . . . . . . . -64.13 -37.96 81.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 CA-C-O 121.495 0.664 . . . . 20.329999999999998 109.824 174.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 833' ' ' ALA . . . . . 0.461 ' HB2' ' HB2' ' A' ' 833' ' ' ALA . . . -69.94 -37.84 75.99 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 115.856 -0.611 . . . . 19.870000000000001 111.746 179.339 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 834' ' ' ALA . . . . . . . . . . . . . . . -76.16 -30.55 58.15 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 120.005 -0.678 . . . . 20.66 111.443 179.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 835' ' ' LYS . . . . . . . . . . . . . . . -64.48 -42.28 95.98 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 120.058 -0.657 . . . . 20.989999999999998 110.265 172.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 836' ' ' LEU . . . . . . . . . . . . . . . -66.75 -34.83 78.69 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.909 0.385 . . . . 21.920000000000002 111.055 175.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 837' ' ' ALA . . . . . . . . . . . . . . . -73.2 -35.11 66.29 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 122.044 -0.41 . . . . 22.850000000000001 111.816 179.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 838' ' ' PHE . . . . . . . . . . . . . . . -70.12 -36.6 74.94 Favored 'General case' 0 CA--C 1.508 -0.672 0 C-N-CA 120.939 -0.305 . . . . 22.91 110.58 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 839' ' ' ILE . . . . . . . . . . . . . . . -61.63 -39.86 84.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 C-N-CA 120.371 -0.532 . . . . 24.260000000000002 109.841 172.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 840' ' ' ILE . . . . . . . . . . . . . . . -69.95 -46.14 74.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-O 120.755 0.312 . . . . 25.579999999999998 111.034 179.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 841' ' ' VAL . . . . . . . . . . . . . . . -75.0 -39.98 44.85 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 O-C-N 121.875 -0.515 . . . . 27.120000000000001 110.957 -174.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 842' ' ' MET . . . . . . . . . . . . . . . -70.61 -37.5 73.86 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 121.757 -0.59 . . . . 27.489999999999998 111.055 177.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 843' ' ' GLU . . . . . . . . . . . . . . . -65.43 -36.41 83.84 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 120.275 -0.57 . . . . 27.68 111.078 172.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 844' ' ' HIS . . . . . . . . . . . . . . . -74.33 -41.26 61.39 Favored 'General case' 0 N--CA 1.457 -0.116 0 N-CA-C 112.058 0.392 . . . . 29.370000000000001 112.058 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 845' ' ' ILE . . . . . . . . . . . . . . . -73.88 -39.76 52.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 O-C-N 121.61 -0.681 . . . . 28.57 110.585 178.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 846' ' ' ILE . . . . . . . . . . . . . . . -75.22 -18.93 16.09 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 O-C-N 121.646 -0.659 . . . . 28.550000000000001 110.5 179.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 847' ' ' TYR . . . . . . . . . . . . . . . -84.52 -23.04 29.96 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.404 -0.518 . . . . 31.460000000000001 111.062 167.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 848' ' ' SER . . . . . . . . . . . . . . . -70.39 -43.48 69.96 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.131 -0.628 . . . . 31.850000000000001 110.7 174.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 849' ' ' VAL . . . . . . . . . . . . . . . -64.07 -34.04 66.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-O 120.774 0.321 . . . . 34.140000000000001 110.357 175.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 850' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.599 0 O-C-N 121.778 -0.576 . . . . 34.759999999999998 111.896 175.769 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 295' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.457 0 N-CA-C 110.636 -0.135 . . . . 48.94 110.636 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 296' ' ' ILE . . . . . . . . . . . . . . . -77.84 -34.18 19.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-O 121.038 0.447 . . . . 45.57 110.978 -178.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 297' ' ' GLY . . . . . . . . . . . . . . . -79.57 -45.47 8.59 Favored Glycine 0 C--N 1.334 0.434 0 C-N-CA 120.336 -0.935 . . . . 47.04 114.146 -172.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 298' ' ' ILE . . . . . . . . . . . . . . . -67.3 -31.68 54.06 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.427 0 O-C-N 122.095 -0.65 . . . . 45.88 110.057 176.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . . . -66.75 -33.79 76.4 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 119.949 -0.701 . . . . 43.67 111.089 169.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 300' ' ' PHE . . . . . . . . . . . . . . . -68.15 -45.35 73.8 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 120.338 -0.545 . . . . 42.57 111.187 178.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' ALA . . . . . . . . . . . . . . . -72.86 -21.18 60.97 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 121.614 -0.679 . . . . 43.76 111.324 175.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' TRP . . . . . . . . . . . . . . . -72.33 -37.05 68.98 Favored 'General case' 0 CA--C 1.514 -0.436 0 O-C-N 121.63 -0.669 . . . . 41.67 110.619 173.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' LEU . . . . . . . . . . . . . . . -63.61 -34.77 78.56 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 119.99 -0.684 . . . . 39.97 109.891 167.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' GLY . . . . . . . . . . . . . . . -65.9 -41.6 95.36 Favored Glycine 0 C--O 1.224 -0.474 0 C-N-CA 120.713 -0.756 . . . . 38.46 113.949 175.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' TYR . . . . . . . . . . . . . . . -73.74 -39.47 64.23 Favored 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 121.797 -0.825 . . . . 36.8 110.8 -177.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' TYR . . . . . . . . . . . . . . . -65.75 -33.45 75.9 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 119.423 -0.911 . . . . 37.18 110.552 172.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' THR . . . . . . . . . . . . . . . -69.76 -37.04 76.26 Favored 'General case' 0 C--O 1.233 0.19 0 O-C-N 121.972 -0.455 . . . . 36.45 111.646 176.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' GLN . . . . . . . . . . . . . . . -71.51 -47.82 52.93 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 121.679 -0.638 . . . . 35.98 111.953 177.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' MET . . . . . . . . . . . . . . . -65.67 -34.44 78.21 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.206 -0.597 . . . . 34.62 111.19 177.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' LEU . . . . . 0.506 ' O ' ' HB2' ' A' ' 314' ' ' ALA . . . -68.14 -31.35 70.87 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.383 -0.527 . . . . 34.35 110.737 174.06 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' LEU . . . . . . . . . . . . . . . -71.96 -39.64 69.23 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.806 -0.559 . . . . 35.18 112.423 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' LEU . . . . . . . . . . . . . . . -72.1 -44.31 63.43 Favored 'General case' 0 C--O 1.242 0.694 0 O-C-N 120.971 -1.081 . . . . 34.35 111.008 -179.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -64.67 -23.48 67.27 Favored 'General case' 0 CA--C 1.518 -0.278 0 O-C-N 122.23 -0.294 . . . . 32.32 110.992 171.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' ALA . . . . . 0.506 ' HB2' ' O ' ' A' ' 310' ' ' LEU . . . -72.92 -31.59 64.74 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 112.218 0.451 . . . . 32.05 112.218 173.111 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' VAL . . . . . . . . . . . . . . . -69.01 -42.97 82.29 Favored 'Isoleucine or valine' 0 C--O 1.241 0.654 0 C-N-CA 120.188 -0.605 . . . . 34.13 110.217 174.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' VAL . . . . . . . . . . . . . . . -62.49 -40.74 89.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 CA-C-O 120.988 0.423 . . . . 31.46 110.613 174.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' GLY . . . . . . . . . . . . . . . -68.56 -34.86 79.81 Favored Glycine 0 C--O 1.225 -0.452 0 C-N-CA 120.831 -0.7 . . . . 30.52 113.51 177.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' VAL . . . . . . . . . . . . . . . -67.96 -36.0 73.99 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-N 117.358 0.579 . . . . 31.17 110.638 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' ALA . . . . . . . . . . . . . . . -63.46 -45.61 90.0 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 120.481 -0.488 . . . . 30.17 111.258 175.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' CYS . . . . . . . . . . . . . . . -70.72 -19.52 62.74 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 119.265 -0.974 . . . . 29.94 111.794 175.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' PHE . . . . . . . . . . . . . . . -76.03 -31.19 58.75 Favored 'General case' 0 C--O 1.237 0.442 0 O-C-N 121.994 -0.441 . . . . 29.65 112.105 176.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' LEU . . . . . . . . . . . . . . . -61.96 -36.76 82.37 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.369 -0.532 . . . . 31.71 110.708 172.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.845 0 CA-C-O 121.011 0.434 . . . . 30.42 109.846 166.632 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.57 0 N-CA-C 109.343 -0.614 . . . . 81.91 109.343 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 378' ' ' GLY . . . . . . . . . . . . . . . -72.13 -34.5 61.4 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.081 -1.057 . . . . 80.64 111.938 173.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 379' ' ' THR . . . . . . . . . . . . . . . -66.37 -40.66 89.87 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 122.283 -0.539 . . . . 78.13 110.967 172.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 380' ' ' LEU . . . . . . . . . . . . . . . -71.55 -30.85 66.35 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 121.011 -0.276 . . . . 79.8 111.41 174.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 381' ' ' ILE . . . . . . . . . . . . . . . -63.81 -41.5 92.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 119.879 -0.729 . . . . 78.57 110.034 171.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . . . -63.13 -34.12 76.94 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 116.698 -0.228 . . . . 78.89 111.177 172.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 383' ' ' ALA . . . . . . . . . . . . . . . -72.89 -49.3 30.64 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 120.94 -0.304 . . . . 78.94 111.272 -175.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . . . -66.1 -33.53 64.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 C-N-CA 120.421 -0.511 . . . . 80.52 110.188 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 385' ' ' PHE . . . . . . . . . . . . . . . -63.85 -35.24 79.97 Favored 'General case' 0 CA--C 1.519 -0.237 0 O-C-N 122.264 -0.273 . . . . 81.26 111.02 171.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 386' ' ' MET . . . . . . . . . . . . . . . -74.94 -29.25 60.88 Favored 'General case' 0 CA--C 1.515 -0.38 0 O-C-N 122.018 -0.426 . . . . 82.7 110.902 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 387' ' ' GLY . . . . . . . . . . . . . . . -65.21 -46.31 88.06 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.118 -1.039 . . . . 84.17 111.288 171.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . . . -63.61 -31.1 51.69 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.074 0 C-N-CA 120.904 -0.318 . . . . 84.86 110.589 172.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 389' ' ' TRP . . . . . . . . . . . . . . . -75.64 -35.49 60.42 Favored 'General case' 0 CA--C 1.514 -0.424 0 O-C-N 121.937 -0.477 . . . . 85.62 111.15 -177.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . . . -65.48 -40.71 89.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.398 -0.593 . . . . 85.39 109.398 174.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 391' ' ' THR . . . . . . . . . . . . . . . -64.47 -47.29 79.56 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-O 120.888 0.375 . . . . 85.95 111.714 176.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 392' ' ' LEU . . . . . . . . . . . . . . . -68.42 -32.07 71.84 Favored 'General case' 0 C--O 1.234 0.289 0 O-C-N 122.261 -0.275 . . . . 90.55 111.507 179.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 393' ' ' PHE . . . . . . . . . . . . . . . -66.44 -45.11 80.9 Favored 'General case' 0 CA--C 1.514 -0.418 0 O-C-N 122.276 -0.265 . . . . 92.57 110.785 177.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 394' ' ' LEU . . . . . . . . . . . . . . . -62.31 -38.55 89.85 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 120.851 -0.34 . . . . 91.11 111.426 174.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 395' ' ' GLU . . . . . . . . . . . . . . . -66.17 -52.86 44.15 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 112.047 0.388 . . . . 94.29 112.047 179.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 396' ' ' PHE . . . . . . . . . . . . . . . -69.49 -32.5 71.41 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 120.646 -0.422 . . . . 96.1 111.562 -177.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 397' ' ' TRP . . . . . . . . . . . . . . . -66.92 -34.37 77.62 Favored 'General case' 0 CA--C 1.518 -0.284 0 C-N-CA 120.586 -0.446 . . . . 97.13 110.588 174.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . . . -65.12 -38.55 91.04 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.376 -0.53 . . . . 97.95 111.151 172.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 399' ' ' ARG . . . . . . . . . . . . . . . -66.69 -46.12 76.61 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 120.431 -0.507 . . . . 98.66 111.911 -179.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 400' ' ' ARG . . . . . . . . . . . . . . . -68.88 -29.98 68.39 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.55 -0.46 . . . . 100.03 110.92 178.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' GLN . . . . . . . . . . . . . . . -62.01 -40.78 96.83 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 120.655 0.264 . . . . 101.91 110.978 172.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' ALA . . . . . . . . . . . . . . . -66.39 -44.03 84.2 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.815 -0.354 . . . . 100.83 111.477 176.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . . . -70.6 -31.31 68.25 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 112.418 0.525 . . . . 101.16 112.418 -175.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 404' ' ' LEU . . . . . . . . . . . . . . . -77.26 -44.81 28.5 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 113.049 0.759 . . . . 102.17 113.049 -163.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 405' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.281 0 O-C-N 121.896 -0.502 . . . . 100.82 112.344 -173.775 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.069 0 CA-C-O 120.937 0.399 . . . . 97.8 110.912 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 456' ' ' CYS . . . . . . . . . . . . . . . -68.36 -25.03 64.88 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.843 -0.617 . . . . 99.87 111.158 168.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 457' ' ' ALA . . . . . . . . . . . . . . . -66.19 -39.38 89.64 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 111.758 0.281 . . . . 101.63 111.758 178.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . . . -66.51 -36.19 82.09 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.431 -0.508 . . . . 98.9 110.994 175.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 459' ' ' ALA . . . . . . . . . . . . . . . -64.02 -34.1 77.24 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 120.897 -0.321 . . . . 97.95 111.109 172.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 460' ' ' VAL . . . . . . . . . . . . . . . -67.6 -43.36 87.01 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 CA-C-O 120.8 0.333 . . . . 97.29 110.526 178.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . . . -67.6 -34.19 76.51 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.345 -0.542 . . . . 97.39 111.415 178.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 462' ' ' PHE . . . . . . . . . . . . . . . -68.79 -39.83 79.95 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.587 -0.445 . . . . 99.0 111.474 175.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 463' ' ' TRP . . . . . . . . . . . . . . . -65.53 -29.15 69.75 Favored 'General case' 0 CA--C 1.517 -0.317 0 O-C-N 122.208 -0.308 . . . . 96.1 111.301 173.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . . . -69.9 -39.22 77.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 CA-C-O 121.497 0.665 . . . . 98.6 110.609 175.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 465' ' ' LEU . . . . . . . . . . . . . . . -63.88 -42.7 97.42 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 121.961 -0.462 . . . . 94.35 111.096 174.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . . . -65.76 -29.14 69.6 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 120.854 -0.339 . . . . 94.63 111.221 174.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 467' ' ' ILE . . . . . . . . . . . . . . . -65.92 -38.74 82.81 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.389 0 N-CA-C 109.924 -0.399 . . . . 93.13 109.924 174.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 468' ' ' ILE . . . . . . . . . . . . . . . -66.05 -35.25 74.59 Favored 'Isoleucine or valine' 0 C--O 1.241 0.641 0 CA-C-O 121.013 0.435 . . . . 92.6 110.382 174.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 469' ' ' ALA . . . . . . . . . . . . . . . -68.07 -38.98 83.03 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.478 -0.328 . . . . 91.84 111.532 178.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . . . -69.29 -30.54 68.65 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.458 -0.497 . . . . 89.07 110.593 172.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . . . -68.13 -34.45 66.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 C-N-CA 122.851 0.46 . . . . 86.6 110.986 -178.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 472' ' ' ILE . . . . . . . . . . . . . . . -61.66 -29.6 46.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 121.008 0.432 . . . . 89.79 110.897 173.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.774 0 N-CA-C 111.253 -0.739 . . . . 88.47 111.253 169.131 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.405 0 N-CA-C 109.315 -0.624 . . . . 65.87 109.315 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' THR . . . . . . . . . . . . . . . -68.12 -28.7 67.55 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.033 -0.53 . . . . 64.79 110.961 170.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.74 88.46 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 111.738 0.273 . . . . 64.6 111.738 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . . . -67.86 -29.62 68.79 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.125 -0.63 . . . . 63.51 111.153 174.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 515' ' ' ILE . . . . . . . . . . . . . . . -69.55 -42.6 80.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 C-N-CA 120.413 -0.515 . . . . 62.8 110.81 176.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 516' ' ' ILE . . . . . . . . . . . . . . . -67.82 -36.48 75.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 O-C-N 121.885 -0.509 . . . . 63.91 110.692 176.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . . . -67.16 -37.65 84.12 Favored 'General case' 0 CA--C 1.515 -0.395 0 O-C-N 122.075 -0.391 . . . . 62.91 111.231 176.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 518' ' ' PHE . . . . . . . . . . . . . . . -68.41 -33.14 73.69 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 120.514 -0.474 . . . . 65.07 110.908 175.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 519' ' ' ILE . . . . . . . . . . . . . . . -67.18 -51.09 57.19 Favored 'Isoleucine or valine' 0 C--O 1.24 0.603 0 C-N-CA 120.508 -0.477 . . . . 62.61 110.81 178.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 520' ' ' ILE . . . . . . . . . . . . . . . -68.45 -32.02 53.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 C-N-CA 120.647 -0.421 . . . . 65.34 110.834 179.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . . . -70.71 -31.32 45.59 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 O-C-N 121.734 -0.604 . . . . 65.53 109.879 177.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' MET . . . . . . . . . . . . . . . -66.64 -48.75 68.41 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.074 0.464 . . . . 67.39 111.268 174.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . . . -64.08 -43.23 97.45 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 C-N-CA 120.608 -0.437 . . . . 69.02 110.96 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . . . -67.55 -29.62 69.05 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 121.946 -0.471 . . . . 68.81 111.579 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 525' ' ' ASN . . . . . . . . . . . . . . . -68.39 -40.35 81.38 Favored 'General case' 0 CA--C 1.51 -0.573 0 O-C-N 122.257 -0.277 . . . . 68.62 111.005 175.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 526' ' ' THR . . . . . . . . . . . . . . . -66.62 -42.96 85.99 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.042 -0.663 . . . . 72.59 111.352 176.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . . . -65.03 -38.52 82.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-O 120.787 0.327 . . . . 71.72 111.042 177.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . . . -72.68 -35.5 67.69 Favored 'General case' 0 CA--C 1.517 -0.31 0 O-C-N 121.756 -0.59 . . . . 73.47 111.235 -179.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 529' ' ' GLU . . . . . . . . . . . . . . . -67.76 -33.97 75.89 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.837 -0.345 . . . . 74.73 110.958 174.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . . . -69.01 -33.26 73.36 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 119.822 -0.751 . . . . 74.6 110.977 171.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 531' ' ' VAL . . . . . . . . . . . . . . . -65.51 -27.91 42.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 120.815 0.34 . . . . 74.84 110.466 179.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 532' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.627 0 CA-C-O 121.777 0.798 . . . . 72.72 110.252 173.099 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 556' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 121.386 0.613 . . . . 28.28 110.21 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . . . -63.76 -30.42 71.52 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 119.792 -0.763 . . . . 30.52 110.281 158.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 558' ' ' PHE . . . . . . . . . . . . . . . -66.97 -42.67 84.76 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 120.716 -0.394 . . . . 30.11 111.546 171.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 559' ' ' GLN . . . . . . . . . . . . . . . -70.52 -41.27 72.8 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.663 -0.415 . . . . 33.41 111.547 -177.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 560' ' ' PHE . . . . . . . . . . . . . . . -62.97 -35.64 80.86 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 120.854 -0.339 . . . . 31.65 111.008 172.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 561' ' ' VAL . . . . . 0.503 ' O ' ' CB ' ' A' ' 565' ' ' SER . . . -62.65 -45.23 99.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 C-N-CA 120.747 -0.381 . . . . 32.8 110.715 175.285 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 562' ' ' ASN . . . . . . . . . . . . . . . -67.7 -41.46 83.56 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 122.094 -0.379 . . . . 33.25 111.613 -177.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . . . -74.22 -55.74 5.7 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 120.399 -0.52 . . . . 33.33 111.701 -178.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 564' ' ' TYR . . . . . . . . . . . . . . . -76.76 -15.51 59.74 Favored 'General case' 0 C--O 1.235 0.294 0 O-C-N 121.868 -0.52 . . . . 31.69 112.193 -172.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 565' ' ' SER . . . . . 0.503 ' CB ' ' O ' ' A' ' 561' ' ' VAL . . . -64.74 -35.87 82.45 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 112.6 0.593 . . . . 34.06 112.6 -174.521 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 566' ' ' SER . . . . . . . . . . . . . . . -67.64 -39.93 84.62 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.274 -0.57 . . . . 34.64 111.378 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 567' ' ' CYS . . . . . . . . . . . . . . . -69.96 -47.7 61.26 Favored 'General case' 0 C--O 1.241 0.633 0 O-C-N 122.154 -0.341 . . . . 33.18 111.321 -179.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 568' ' ' PHE . . . . . . . . . . . . . . . -64.96 -28.4 69.49 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 120.632 -0.427 . . . . 32.38 111.123 174.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 569' ' ' TYR . . . . . . . . . . . . . . . -69.07 -35.4 76.49 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 121.95 -0.469 . . . . 36.7 111.323 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . . . -66.21 -48.97 79.5 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 C-N-CA 120.331 -0.547 . . . . 35.81 109.689 174.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -63.8 -25.94 68.4 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.776 -0.647 . . . . 36.65 112.43 -177.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 572' ' ' PHE . . . . . . . . . . . . . . . -86.28 -23.02 26.49 Favored 'General case' 0 C--O 1.233 0.209 0 O-C-N 121.78 -0.575 . . . . 35.87 111.832 167.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 573' ' ' PHE . . . . . . . . . . . . . . . -74.84 -37.21 62.31 Favored 'General case' 0 CA--C 1.509 -0.629 0 O-C-N 122.224 -0.297 . . . . 37.87 111.606 -167.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 574' ' ' LYS . . . . . . . . . . . . . . . -66.29 -29.96 70.29 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 118.173 -1.411 . . . . 37.77 110.838 168.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.447 0 N-CA-C 118.034 1.973 . . . . 37.64 118.034 -178.354 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 604' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.214 -0.793 0 N-CA-C 109.458 -0.571 . . . . 28.09 109.458 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 605' ' ' LEU . . . . . 0.428 ' O ' ' CB ' ' A' ' 609' ' ' LEU . . . -62.64 -30.92 71.72 Favored 'General case' 0 CA--C 1.513 -0.463 0 O-C-N 124.194 0.934 . . . . 29.46 111.188 -176.666 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 606' ' ' THR . . . . . . . . . . . . . . . -62.86 -52.08 64.51 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 120.076 -0.65 . . . . 29.19 110.695 169.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . . . -72.25 -42.39 65.69 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 120.6 -0.44 . . . . 29.27 111.82 -177.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 608' ' ' GLN . . . . . . . . . . . . . . . -69.12 -40.03 78.56 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 120.387 -0.525 . . . . 30.23 111.259 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 609' ' ' LEU . . . . . 0.428 ' CB ' ' O ' ' A' ' 605' ' ' LEU . . . -65.69 -40.29 92.17 Favored 'General case' 0 CA--C 1.516 -0.344 0 O-C-N 122.03 -0.419 . . . . 31.47 111.289 175.806 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . . . -68.9 -42.62 76.63 Favored 'General case' 0 CA--C 1.517 -0.322 0 O-C-N 122.311 -0.243 . . . . 32.79 111.378 179.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 611' ' ' ILE . . . . . . . . . . . . . . . -74.51 -33.76 33.68 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.381 0 O-C-N 122.073 -0.392 . . . . 34.45 111.164 -178.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 612' ' ' ILE . . . . . . . . . . . . . . . -69.77 -43.22 80.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 O-C-N 121.394 -0.816 . . . . 36.44 110.347 175.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 613' ' ' MET . . . . . . . . . . . . . . . -66.74 -48.84 67.9 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 121.959 -0.463 . . . . 37.84 111.123 177.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 614' ' ' GLY . . . . . . . . . . . . . . . -66.04 -36.37 91.88 Favored Glycine 0 C--O 1.221 -0.657 0 C-N-CA 121.095 -0.574 . . . . 40.79 113.195 178.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . -72.39 -36.49 59.36 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.078 -1.058 . . . . 42.64 112.416 179.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 616' ' ' LYS . . . . . . . . . . . . . . . -66.26 -32.14 73.37 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 119.312 -0.955 . . . . 43.14 110.382 171.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -67.76 -46.43 72.07 Favored 'General case' 0 C--O 1.231 0.123 0 N-CA-C 112.076 0.399 . . . . 45.8 112.076 175.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . . . -71.2 -36.1 60.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 O-C-N 122.067 -0.395 . . . . 48.24 110.6 -178.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 619' ' ' TRP . . . . . . . . . . . . . . . -69.32 -36.3 76.83 Favored 'General case' 0 CA--C 1.516 -0.343 0 O-C-N 121.583 -0.698 . . . . 50.6 111.038 175.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 620' ' ' ASN . . . . . . . . . . . . . . . -67.3 -32.96 74.3 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.421 -0.512 . . . . 51.24 111.266 173.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 621' ' ' ASN . . . . . . . . . . . . . . . -70.49 -37.49 74.21 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.412 -0.515 . . . . 54.23 111.491 176.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 622' ' ' ILE . . . . . . . . . . . . . . . -65.12 -36.13 77.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 120.88 0.372 . . . . 55.25 110.518 174.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 623' ' ' GLN . . . . . . . . . . . . . . . -68.21 -33.66 74.83 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 121.902 -0.499 . . . . 55.99 111.593 173.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 624' ' ' GLU . . . . . . . . . . . . . . . -68.69 -34.17 75.21 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 122.243 -0.286 . . . . 54.75 111.547 177.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 625' ' ' VAL . . . . . . . . . . . . . . . -73.07 -41.11 59.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.072 -0.651 . . . . 57.69 110.573 174.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . . . -90.06 2.54 55.11 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.872 1.064 . . . . 59.08 113.872 -172.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 627' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 118.682 0.674 . . . . 60.33 111.347 177.444 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 665' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.622 0 N-CA-C 110.178 -0.304 . . . . 44.77 110.178 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 666' ' ' TYR . . . . . . . . . . . . . . . -64.31 -32.46 74.07 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.293 -0.563 . . . . 44.88 110.856 175.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 667' ' ' GLU . . . . . . . . . . . . . . . -67.62 -43.92 79.25 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 116.716 -0.22 . . . . 44.41 111.488 176.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 668' ' ' TYR . . . . . . . . . . . . . . . -69.22 -26.62 64.9 Favored 'General case' 0 CA--C 1.511 -0.522 0 C-N-CA 120.459 -0.496 . . . . 40.7 110.678 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . . . -64.12 -42.6 96.8 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.444 -0.502 . . . . 40.89 111.098 170.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . . . -66.91 -42.77 84.86 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.19 -0.604 . . . . 40.64 111.372 179.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 671' ' ' MET . . . . . . . . . . . . . . . -70.18 -30.29 67.39 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 119.741 -0.784 . . . . 40.85 111.596 179.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 672' ' ' ILE . . . . . . . . . . . . . . . -72.89 -32.58 40.59 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 C-N-CA 120.151 -0.62 . . . . 41.07 110.04 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . . . -64.32 -35.61 74.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 120.106 -0.638 . . . . 41.18 109.994 170.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 674' ' ' GLN . . . . . . . . . . . . . . . -69.72 -34.62 74.13 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 119.869 -0.732 . . . . 42.25 111.577 175.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 675' ' ' PHE . . . . . . . . . . . . . . . -69.08 -34.53 75.28 Favored 'General case' 0 CA--C 1.509 -0.605 0 O-C-N 121.758 -0.589 . . . . 39.21 110.756 176.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 676' ' ' GLY . . . . . . . . . . . . . . . -64.65 -36.0 92.61 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 119.794 -1.193 . . . . 37.36 111.83 170.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 677' ' ' PHE . . . . . . . . . . . . . . . -63.11 -49.57 73.88 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 120.608 -0.437 . . . . 36.64 111.375 175.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 678' ' ' VAL . . . . . . . . . . . . . . . -70.0 -49.44 56.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.757 0.313 . . . . 37.12 110.362 -176.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 679' ' ' THR . . . . . . . . . . . . . . . -77.2 -44.53 29.75 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.695 0.628 . . . . 36.4 112.695 -173.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 680' ' ' LEU . . . . . . . . . . . . . . . -75.03 -34.92 61.93 Favored 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 121.427 -0.796 . . . . 37.37 111.707 -175.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 681' ' ' PHE . . . . . . . . . . . . . . . -111.57 29.58 7.71 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.664 0.616 . . . . 39.74 112.664 -175.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 682' ' ' VAL . . . . . . . . . . . . . . . -59.24 -28.06 38.23 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 C-N-CA 125.312 1.445 . . . . 39.88 112.484 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 683' ' ' ALA . . . . . . . . . . . . . . . -72.89 -17.37 61.52 Favored 'General case' 0 C--N 1.318 -0.761 0 C-N-CA 118.187 -1.405 . . . . 41.1 112.956 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 684' ' ' SER . . . . . . . . . . . . . . . -74.27 -75.01 0.17 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-N 118.949 0.795 . . . . 35.44 111.579 -175.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . . . -122.23 131.24 24.43 Favored Pre-proline 0 N--CA 1.438 -1.049 0 N-CA-C 103.588 -2.745 . . . . 39.22 103.588 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 686' ' ' PRO . . . . . . . . . . . . . . . -88.66 -17.32 2.22 Favored 'Trans proline' 0 C--O 1.238 0.511 0 N-CA-C 114.165 0.794 . . . . 38.93 114.165 -173.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . . . -80.0 3.64 19.48 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 119.266 0.939 . . . . 37.97 112.75 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -68.54 -20.3 0.52 Allowed Pre-proline 0 C--O 1.264 1.825 0 CA-C-O 117.922 -1.037 . . . . 37.68 112.84 -173.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 689' ' ' PRO . . . . . . . . . . . . . . . -67.63 -46.35 2.73 Favored 'Trans proline' 0 C--O 1.243 0.758 0 CA-C-N 122.169 1.81 . . . . 36.22 113.763 -176.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . . . -59.22 -41.12 87.92 Favored 'General case' 0 C--N 1.349 0.546 0 O-C-N 123.302 0.376 . . . . 36.61 111.659 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . . . -61.23 -20.77 63.19 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.368 0.667 . . . . 40.13 112.074 -177.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 692' ' ' ALA . . . . . . . . . . . . . . . -72.75 -62.83 1.31 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 118.01 -1.476 . . . . 43.27 111.209 171.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . . . -67.74 -35.37 78.62 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 120.638 0.256 . . . . 42.6 111.347 -159.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 694' ' ' VAL . . . . . . . . . . . . . . . -55.54 -49.49 73.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 C-N-CA 123.303 0.641 . . . . 44.28 110.127 176.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 695' ' ' ASN . . . . . . . . . . . . . . . -62.37 -40.19 95.63 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 116.4 -0.364 . . . . 45.04 110.916 176.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 696' ' ' ASN . . . . . . . . . . . . . . . -63.18 -32.21 73.55 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.242 -0.436 . . . . 45.7 111.464 -178.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . . . -68.73 -30.07 45.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 C-N-CA 118.864 -1.134 . . . . 43.83 109.91 -175.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 698' ' ' LEU . . . . . . . . . . . . . . . -67.4 -24.58 65.69 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 120.572 -0.451 . . . . 44.29 111.773 175.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . . . -62.29 -31.83 72.48 Favored 'General case' 0 C--N 1.344 0.333 0 O-C-N 122.422 -0.174 . . . . 44.68 111.366 174.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 700' ' ' ILE . . . . . . . . . . . . . . . -61.86 -35.58 68.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 C-N-CA 120.348 -0.541 . . . . 42.54 109.923 173.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 701' ' ' ARG . . . . . . . . . . . . . . . -60.84 -36.13 78.31 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 116.232 -0.44 . . . . 44.65 111.931 174.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 702' ' ' VAL . . . . . . . . . . . . . . . -66.41 -33.68 65.1 Favored 'Isoleucine or valine' 0 C--N 1.345 0.385 0 C-N-CA 120.398 -0.521 . . . . 42.08 110.336 177.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 703' ' ' ASP . . . . . . . . . . . . . . . -69.14 -29.8 67.92 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 119.456 -0.898 . . . . 43.13 110.387 172.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 704' ' ' ALA . . . . . . . . . . . . . . . -78.34 -23.78 46.83 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 112.445 0.535 . . . . 41.31 112.445 -174.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 705' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.254 0 N-CA-C 113.122 0.786 . . . . 40.67 113.122 -174.781 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 726' ' ' GLN . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.509 0 N-CA-C 110.369 -0.234 . . . . 34.41 110.369 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 727' ' ' PRO . . . . . . . . . . . . . . . -68.38 -42.68 5.13 Favored 'Trans proline' 0 C--O 1.237 0.425 0 O-C-N 123.247 1.13 . . . . 33.34 113.835 -176.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 728' ' ' ILE . . . . . . . . . . . . . . . -66.84 -33.39 63.12 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 C-N-CA 120.012 -0.675 . . . . 33.44 110.113 171.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 729' ' ' MET . . . . . . . . . . . . . . . -71.7 -43.67 65.53 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 120.138 -0.625 . . . . 33.64 111.87 179.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 730' ' ' GLN . . . . . . . . . . . . . . . -68.41 -29.81 68.57 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 120.043 -0.663 . . . . 32.01 110.912 176.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 731' ' ' GLY . . . . . . . . . . . . . . . -65.51 -41.64 96.13 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 119.849 -1.167 . . . . 33.8 112.299 170.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 732' ' ' ILE . . . . . . . . . . . . . . . -65.93 -25.8 36.99 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 O-C-N 122.664 -0.315 . . . . 33.82 110.262 174.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 733' ' ' ALA . . . . . . . . . . . . . . . -77.96 -41.29 36.62 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.776 -0.577 . . . . 33.5 112.159 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 734' ' ' ILE . . . . . . . . . . . . . . . -68.74 -39.64 80.46 Favored 'Isoleucine or valine' 0 C--O 1.241 0.63 0 C-N-CA 119.784 -0.767 . . . . 32.45 110.153 175.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . . . -65.45 -27.02 68.21 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 116.411 -0.358 . . . . 34.19 111.101 171.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 736' ' ' ALA . . . . . . . . . . . . . . . -75.7 -32.57 60.14 Favored 'General case' 0 CA--C 1.512 -0.508 0 O-C-N 122.09 -0.381 . . . . 33.76 111.686 176.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 737' ' ' VAL . . . . . . . . . . . . . . . -63.63 -49.69 81.25 Favored 'Isoleucine or valine' 0 C--O 1.242 0.692 0 C-N-CA 119.769 -0.772 . . . . 33.63 109.515 172.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 738' ' ' VAL . . . . . . . . . . . . . . . -63.64 -35.7 73.76 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.096 0 O-C-N 121.989 -0.444 . . . . 32.58 111.058 174.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 739' ' ' THR . . . . . . . . . . . . . . . -78.75 -37.69 40.57 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 121.756 -0.59 . . . . 31.63 111.374 -173.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 740' ' ' ASN . . . . . . . . . . . . . . . -73.53 -32.77 64.39 Favored 'General case' 0 CA--C 1.512 -0.491 0 O-C-N 121.824 -0.547 . . . . 30.32 110.385 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -65.85 -39.49 90.8 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 120.277 -0.569 . . . . 30.34 110.998 170.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . . . -74.82 -24.38 58.62 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.104 -0.638 . . . . 31.04 111.358 174.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 743' ' ' ILE . . . . . . . . . . . . . . . -73.52 -42.14 56.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 O-C-N 121.769 -0.582 . . . . 30.99 109.837 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . . . -67.06 -44.45 88.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 120.234 -0.586 . . . . 30.09 110.761 171.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 745' ' ' ALA . . . . . . . . . . . . . . . -76.41 -52.76 9.23 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 121.449 -0.782 . . . . 29.07 112.906 -172.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . . . -85.22 -52.15 6.12 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 121.177 -0.952 . . . . 31.01 110.692 -179.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 747' ' ' THR . . . . . . . . . . . . . . . -74.17 -41.12 61.98 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 118.061 -1.456 . . . . 32.2 112.644 -173.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 748' ' ' SER . . . . . . . . . . . . . . . -78.83 -36.24 42.84 Favored 'General case' 0 C--N 1.345 0.374 0 C-N-CA 118.155 -1.418 . . . . 31.53 114.016 -154.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 749' ' ' ASP . . . . . . . . . . . . . . . 52.08 52.45 14.36 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.903 0.881 . . . . 34.38 110.614 -159.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 750' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.742 0 C-N-CA 125.096 1.358 . . . . 36.8 111.641 176.638 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 829' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.532 0 CA-C-O 121.718 0.771 . . . . 15.59 110.352 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 830' ' ' HIS . . . . . . . . . . . . . . . -77.49 -29.61 52.66 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 114.482 -1.235 . . . . 15.68 113.093 -160.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . . . -71.53 -35.27 55.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 C-N-CA 119.998 -0.681 . . . . 17.61 111.435 -156.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 832' ' ' ILE . . . . . . . . . . . . . . . -64.15 -37.99 81.3 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 CA-C-O 121.369 0.604 . . . . 17.85 109.751 174.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 833' ' ' ALA . . . . . 0.461 ' HB2' ' HB2' ' B' ' 833' ' ' ALA . . . -69.96 -37.77 75.9 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 115.932 -0.576 . . . . 18.0 111.77 179.365 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 834' ' ' ALA . . . . . . . . . . . . . . . -76.18 -30.63 58.12 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.048 -0.661 . . . . 17.47 111.413 179.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 835' ' ' LYS . . . . . . . . . . . . . . . -64.51 -42.3 95.89 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 120.09 -0.644 . . . . 17.91 110.189 172.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 836' ' ' LEU . . . . . . . . . . . . . . . -66.75 -34.88 78.8 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.752 0.311 . . . . 19.33 111.012 175.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 837' ' ' ALA . . . . . . . . . . . . . . . -73.14 -35.15 66.43 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 122.156 -0.34 . . . . 19.43 111.788 179.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 838' ' ' PHE . . . . . . . . . . . . . . . -70.11 -36.57 74.93 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 117.88 0.309 . . . . 19.9 110.551 175.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 839' ' ' ILE . . . . . . . . . . . . . . . -61.73 -39.7 84.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 C-N-CA 120.379 -0.528 . . . . 21.1 109.846 172.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 840' ' ' ILE . . . . . . . . . . . . . . . -70.09 -46.12 73.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.811 0.338 . . . . 22.07 111.031 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 841' ' ' VAL . . . . . . . . . . . . . . . -75.03 -39.87 44.49 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 O-C-N 121.882 -0.511 . . . . 23.45 110.963 -174.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 842' ' ' MET . . . . . . . . . . . . . . . -70.72 -37.48 73.52 Favored 'General case' 0 CA--C 1.512 -0.512 0 O-C-N 121.756 -0.59 . . . . 23.51 110.999 177.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 843' ' ' GLU . . . . . . . . . . . . . . . -65.53 -36.35 83.56 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 120.257 -0.577 . . . . 24.55 111.093 172.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 844' ' ' HIS . . . . . . . . . . . . . . . -74.32 -41.21 61.5 Favored 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 112.065 0.395 . . . . 26.79 112.065 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 845' ' ' ILE . . . . . . . . . . . . . . . -73.93 -39.69 51.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 O-C-N 121.598 -0.689 . . . . 26.3 110.658 178.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 846' ' ' ILE . . . . . . . . . . . . . . . -75.2 -18.99 16.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.259 0 O-C-N 121.702 -0.624 . . . . 26.93 110.468 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 847' ' ' TYR . . . . . . . . . . . . . . . -84.48 -23.1 30.02 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.868 -0.52 . . . . 29.6 111.032 167.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 848' ' ' SER . . . . . . . . . . . . . . . -70.31 -43.64 69.92 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.159 -0.616 . . . . 29.96 110.691 174.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 849' ' ' VAL . . . . . . . . . . . . . . . -63.93 -34.13 66.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.84 0.352 . . . . 30.54 110.42 175.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 850' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.619 0 O-C-N 121.785 -0.572 . . . . 29.74 111.922 175.831 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 295' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.476 0 N-CA-C 110.628 -0.138 . . . . 47.56 110.628 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 296' ' ' ILE . . . . . . . . . . . . . . . -77.84 -34.21 19.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 120.95 0.405 . . . . 42.44 110.915 -178.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 297' ' ' GLY . . . . . . . . . . . . . . . -79.57 -45.38 8.66 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.349 -0.929 . . . . 42.09 114.113 -172.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . . . -67.45 -31.48 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.39 0 C-N-CA 120.103 -0.639 . . . . 40.76 110.077 176.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 299' ' ' TYR . . . . . . . . . . . . . . . -66.88 -33.74 76.27 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 119.915 -0.714 . . . . 39.98 111.05 169.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 300' ' ' PHE . . . . . . . . . . . . . . . -68.15 -45.35 73.79 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.337 -0.545 . . . . 39.02 111.22 178.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' ALA . . . . . . . . . . . . . . . -72.92 -21.13 60.94 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 121.61 -0.681 . . . . 38.44 111.331 175.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' TRP . . . . . . . . . . . . . . . -72.27 -37.1 69.12 Favored 'General case' 0 CA--C 1.512 -0.483 0 O-C-N 121.622 -0.674 . . . . 38.05 110.695 173.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' LEU . . . . . . . . . . . . . . . -63.54 -34.84 78.68 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 120.06 -0.656 . . . . 35.72 109.838 167.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 304' ' ' GLY . . . . . . . . . . . . . . . -65.96 -41.58 95.25 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.625 -0.798 . . . . 34.7 113.934 175.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 305' ' ' TYR . . . . . . . . . . . . . . . -73.74 -39.42 64.26 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 121.831 -0.805 . . . . 33.83 110.745 -177.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 306' ' ' TYR . . . . . . . . . . . . . . . -65.81 -33.38 75.71 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 119.404 -0.918 . . . . 33.55 110.566 172.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 307' ' ' THR . . . . . . . . . . . . . . . -69.71 -37.16 76.46 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.902 0.382 . . . . 33.86 111.631 176.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 308' ' ' GLN . . . . . . . . . . . . . . . -71.43 -47.84 53.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 121.677 -0.639 . . . . 32.63 111.954 178.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 309' ' ' MET . . . . . . . . . . . . . . . -65.65 -34.52 78.4 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.192 -0.603 . . . . 31.92 111.131 177.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 310' ' ' LEU . . . . . 0.507 ' O ' ' HB2' ' B' ' 314' ' ' ALA . . . -68.1 -31.32 70.84 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 120.406 -0.518 . . . . 30.65 110.763 174.115 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 311' ' ' LEU . . . . . . . . . . . . . . . -71.9 -39.69 69.37 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.82 -0.55 . . . . 32.63 112.432 174.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 312' ' ' LEU . . . . . . . . . . . . . . . -72.17 -44.16 63.46 Favored 'General case' 0 C--O 1.243 0.733 0 C-N-CA 119.135 -1.026 . . . . 32.25 111.067 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 313' ' ' ALA . . . . . . . . . . . . . . . -64.76 -23.35 67.22 Favored 'General case' 0 CA--C 1.518 -0.262 0 O-C-N 122.21 -0.306 . . . . 28.73 111.048 170.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 314' ' ' ALA . . . . . 0.507 ' HB2' ' O ' ' B' ' 310' ' ' LEU . . . -72.92 -31.65 64.78 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 112.205 0.446 . . . . 28.7 112.205 173.037 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 315' ' ' VAL . . . . . . . . . . . . . . . -69.13 -42.86 81.93 Favored 'Isoleucine or valine' 0 C--O 1.241 0.651 0 C-N-CA 120.16 -0.616 . . . . 30.64 110.206 174.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 316' ' ' VAL . . . . . . . . . . . . . . . -62.53 -40.66 89.07 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 CA-C-O 121.081 0.467 . . . . 28.47 110.679 174.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 317' ' ' GLY . . . . . . . . . . . . . . . -68.57 -34.93 79.96 Favored Glycine 0 C--O 1.225 -0.438 0 C-N-CA 120.785 -0.722 . . . . 27.96 113.558 177.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 318' ' ' VAL . . . . . . . . . . . . . . . -67.9 -35.92 73.87 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-N 117.348 0.574 . . . . 27.7 110.681 176.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 319' ' ' ALA . . . . . . . . . . . . . . . -63.57 -45.62 89.61 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.533 -0.467 . . . . 28.15 111.156 175.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 320' ' ' CYS . . . . . . . . . . . . . . . -70.71 -19.49 62.75 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 119.206 -0.998 . . . . 28.1 111.804 175.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 321' ' ' PHE . . . . . . . . . . . . . . . -76.11 -31.15 58.53 Favored 'General case' 0 C--O 1.237 0.425 0 O-C-N 121.877 -0.514 . . . . 28.71 112.079 176.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 322' ' ' LEU . . . . . . . . . . . . . . . -61.93 -36.86 82.62 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.365 -0.534 . . . . 29.75 110.708 172.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 323' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.801 0 CA-C-O 121.0 0.429 . . . . 27.92 109.881 166.601 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 377' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.596 0 N-CA-C 109.257 -0.646 . . . . 84.63 109.257 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 378' ' ' GLY . . . . . . . . . . . . . . . -72.11 -34.5 61.48 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.171 -1.014 . . . . 82.1 111.932 173.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 379' ' ' THR . . . . . . . . . . . . . . . -66.49 -40.51 89.31 Favored 'General case' 0 C--O 1.232 0.183 0 O-C-N 122.368 -0.489 . . . . 79.62 110.965 172.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . . . -71.55 -30.92 66.43 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 122.21 -0.306 . . . . 81.59 111.399 174.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 381' ' ' ILE . . . . . . . . . . . . . . . -63.7 -41.55 92.98 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 C-N-CA 119.855 -0.738 . . . . 82.18 110.074 171.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 382' ' ' PHE . . . . . . . . . . . . . . . -63.17 -34.04 76.77 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 116.696 -0.229 . . . . 81.67 111.156 172.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . -72.91 -49.25 30.77 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.87 -0.332 . . . . 81.98 111.331 -175.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 384' ' ' VAL . . . . . . . . . . . . . . . -66.13 -33.54 64.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 C-N-CA 120.373 -0.531 . . . . 82.03 110.214 175.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 385' ' ' PHE . . . . . . . . . . . . . . . -63.83 -35.19 79.81 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 121.122 -0.231 . . . . 84.84 111.071 171.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 386' ' ' MET . . . . . . . . . . . . . . . -74.9 -29.27 60.93 Favored 'General case' 0 CA--C 1.514 -0.411 0 O-C-N 122.028 -0.42 . . . . 84.32 110.967 179.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 387' ' ' GLY . . . . . . . . . . . . . . . -65.31 -46.31 87.26 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.044 -1.074 . . . . 87.38 111.224 171.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . . . -63.48 -31.12 51.69 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.092 0 C-N-CA 120.881 -0.327 . . . . 88.47 110.649 172.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 389' ' ' TRP . . . . . . . . . . . . . . . -75.49 -35.63 60.76 Favored 'General case' 0 CA--C 1.515 -0.375 0 O-C-N 121.957 -0.464 . . . . 88.6 111.185 -177.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 390' ' ' VAL . . . . . . . . . . . . . . . -65.47 -40.75 89.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 109.355 -0.609 . . . . 89.96 109.355 174.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 391' ' ' THR . . . . . . . . . . . . . . . -64.43 -47.34 79.47 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 120.899 0.38 . . . . 90.9 111.763 176.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 392' ' ' LEU . . . . . . . . . . . . . . . -68.3 -32.07 71.95 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 122.345 -0.222 . . . . 94.38 111.554 178.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 393' ' ' PHE . . . . . . . . . . . . . . . -66.58 -44.88 81.01 Favored 'General case' 0 CA--C 1.514 -0.438 0 O-C-N 122.279 -0.263 . . . . 94.87 110.808 177.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 394' ' ' LEU . . . . . . . . . . . . . . . -62.45 -38.49 89.97 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 120.823 -0.351 . . . . 95.99 111.434 174.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 395' ' ' GLU . . . . . . . . . . . . . . . -66.14 -52.81 44.91 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.706 -0.398 . . . . 100.06 112.06 179.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 396' ' ' PHE . . . . . . . . . . . . . . . -69.63 -32.39 71.04 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.69 -0.404 . . . . 103.19 111.562 -177.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 397' ' ' TRP . . . . . . . . . . . . . . . -66.99 -34.44 77.76 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 120.556 -0.458 . . . . 104.61 110.545 174.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 398' ' ' LYS . . . . . . . . . . . . . . . -65.02 -38.6 91.42 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.38 -0.528 . . . . 106.14 111.169 172.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 399' ' ' ARG . . . . . . . . . . . . . . . -66.7 -46.08 76.7 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 120.49 -0.484 . . . . 106.66 111.883 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 400' ' ' ARG . . . . . . . . . . . . . . . -68.92 -30.07 68.47 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.592 -0.443 . . . . 108.13 110.815 178.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 401' ' ' GLN . . . . . . . . . . . . . . . -61.95 -40.7 96.45 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 120.694 0.283 . . . . 109.03 111.041 173.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 402' ' ' ALA . . . . . . . . . . . . . . . -66.44 -44.01 84.06 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 120.797 -0.361 . . . . 109.96 111.419 176.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 403' ' ' GLU . . . . . . . . . . . . . . . -70.66 -31.37 68.26 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.392 0.516 . . . . 108.42 112.392 -175.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 404' ' ' LEU . . . . . . . . . . . . . . . -77.2 -44.86 28.56 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 113.034 0.753 . . . . 109.66 113.034 -163.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 405' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.31 0 O-C-N 121.902 -0.499 . . . . 111.75 112.34 -173.769 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 455' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.071 0 CA-C-O 121.042 0.449 . . . . 97.4 110.958 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 456' ' ' CYS . . . . . . . . . . . . . . . -68.4 -25.0 64.83 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.827 -0.624 . . . . 95.61 111.167 168.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 457' ' ' ALA . . . . . . . . . . . . . . . -66.2 -39.33 89.57 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 111.79 0.292 . . . . 97.17 111.79 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 458' ' ' SER . . . . . . . . . . . . . . . -66.54 -36.12 81.91 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 120.459 -0.496 . . . . 95.73 110.989 175.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 459' ' ' ALA . . . . . . . . . . . . . . . -64.12 -34.04 77.14 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 120.858 -0.337 . . . . 94.83 111.078 172.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 460' ' ' VAL . . . . . . . . . . . . . . . -67.63 -43.31 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.293 0 CA-C-O 120.798 0.332 . . . . 93.99 110.586 178.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 461' ' ' PHE . . . . . . . . . . . . . . . -67.6 -34.22 76.56 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.348 -0.541 . . . . 92.49 111.48 178.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 462' ' ' PHE . . . . . . . . . . . . . . . -68.81 -39.82 79.85 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.571 -0.452 . . . . 92.04 111.44 175.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 463' ' ' TRP . . . . . . . . . . . . . . . -65.49 -29.14 69.76 Favored 'General case' 0 CA--C 1.517 -0.319 0 O-C-N 122.205 -0.309 . . . . 90.44 111.253 173.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 464' ' ' ILE . . . . . . . . . . . . . . . -69.9 -39.26 77.42 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 CA-C-O 121.516 0.674 . . . . 94.42 110.608 175.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 465' ' ' LEU . . . . . . . . . . . . . . . -63.87 -42.69 97.47 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 121.966 -0.459 . . . . 90.87 111.066 174.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . . . -65.85 -29.16 69.57 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 120.914 -0.314 . . . . 92.04 111.233 174.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 467' ' ' ILE . . . . . . . . . . . . . . . -65.81 -38.84 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 109.992 -0.373 . . . . 91.3 109.992 174.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 468' ' ' ILE . . . . . . . . . . . . . . . -65.93 -35.15 74.41 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-O 121.04 0.448 . . . . 90.83 110.547 174.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 469' ' ' ALA . . . . . . . . . . . . . . . -68.18 -38.92 82.55 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.398 -0.365 . . . . 89.88 111.514 178.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 470' ' ' SER . . . . . . . . . . . . . . . -69.39 -30.46 68.45 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.343 -0.543 . . . . 87.89 110.596 172.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 471' ' ' VAL . . . . . . . . . . . . . . . -68.15 -34.41 66.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 C-N-CA 122.78 0.432 . . . . 84.98 110.992 -178.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 472' ' ' ILE . . . . . . . . . . . . . . . -61.67 -29.62 46.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-O 121.047 0.451 . . . . 85.66 110.95 173.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 473' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.821 0 N-CA-C 111.287 -0.725 . . . . 86.08 111.287 169.078 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 511' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.404 0 N-CA-C 109.404 -0.591 . . . . 64.64 109.404 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 512' ' ' THR . . . . . . . . . . . . . . . -68.17 -28.73 67.54 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.013 -0.54 . . . . 63.34 110.989 170.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.53 -37.81 88.73 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.57 -0.286 . . . . 62.52 111.758 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 514' ' ' SER . . . . . . . . . . . . . . . -67.74 -29.7 69.0 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.088 -0.645 . . . . 60.99 111.247 174.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 515' ' ' ILE . . . . . . . . . . . . . . . -69.54 -42.58 80.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 120.292 -0.563 . . . . 60.78 110.804 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 516' ' ' ILE . . . . . . . . . . . . . . . -67.82 -36.54 76.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 O-C-N 121.918 -0.489 . . . . 61.61 110.629 176.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 517' ' ' SER . . . . . . . . . . . . . . . -67.03 -37.72 84.63 Favored 'General case' 0 CA--C 1.515 -0.393 0 O-C-N 122.038 -0.414 . . . . 61.7 111.234 176.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 518' ' ' PHE . . . . . . . . . . . . . . . -68.34 -33.21 73.88 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.531 -0.468 . . . . 61.43 110.933 175.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 519' ' ' ILE . . . . . . . . . . . . . . . -67.2 -51.12 56.7 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 120.434 -0.506 . . . . 60.6 110.73 178.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 520' ' ' ILE . . . . . . . . . . . . . . . -68.39 -32.1 54.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.632 -0.427 . . . . 61.19 110.809 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 521' ' ' ILE . . . . . . . . . . . . . . . -70.69 -31.23 45.33 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 O-C-N 121.778 -0.576 . . . . 63.35 109.996 177.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 522' ' ' MET . . . . . . . . . . . . . . . -66.65 -48.68 68.62 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-O 121.12 0.486 . . . . 62.9 111.297 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 523' ' ' ILE . . . . . . . . . . . . . . . -64.19 -43.19 97.29 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 C-N-CA 120.619 -0.432 . . . . 61.45 110.89 178.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . . . -67.56 -29.72 69.16 Favored 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 122.033 -0.417 . . . . 61.05 111.474 178.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . . . -68.38 -40.35 81.41 Favored 'General case' 0 CA--C 1.509 -0.612 0 C-N-CA 120.98 -0.288 . . . . 60.56 110.992 175.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 526' ' ' THR . . . . . . . . . . . . . . . -66.62 -42.93 86.04 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.026 -0.67 . . . . 63.5 111.383 176.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 527' ' ' ILE . . . . . . . . . . . . . . . -65.01 -38.53 83.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 120.816 0.341 . . . . 61.44 111.047 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 528' ' ' TYR . . . . . . . . . . . . . . . -72.62 -35.5 67.84 Favored 'General case' 0 CA--C 1.518 -0.276 0 O-C-N 121.649 -0.657 . . . . 63.58 111.308 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . . . -67.77 -33.96 75.85 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.836 -0.346 . . . . 65.06 110.989 174.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 530' ' ' LYS . . . . . . . . . . . . . . . -68.93 -33.35 73.58 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.859 -0.736 . . . . 64.66 110.986 171.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 531' ' ' VAL . . . . . . . . . . . . . . . -65.46 -27.93 43.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-O 120.918 0.39 . . . . 63.74 110.516 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 532' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.629 0 CA-C-O 121.885 0.85 . . . . 63.1 110.328 173.126 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 556' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.509 0 CA-C-O 121.388 0.614 . . . . 40.8 110.154 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 557' ' ' LEU . . . . . . . . . . . . . . . -63.71 -30.43 71.54 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 119.849 -0.74 . . . . 40.21 110.254 158.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 558' ' ' PHE . . . . . . . . . . . . . . . -67.04 -42.66 84.45 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 120.788 -0.365 . . . . 41.22 111.474 171.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 559' ' ' GLN . . . . . . . . . . . . . . . -70.61 -41.26 72.52 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 120.69 -0.404 . . . . 43.24 111.521 -177.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 560' ' ' PHE . . . . . . . . . . . . . . . -62.91 -35.67 80.83 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 120.872 -0.331 . . . . 41.97 110.993 171.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 561' ' ' VAL . . . . . 0.512 ' O ' ' CB ' ' B' ' 565' ' ' SER . . . -62.7 -45.26 99.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 C-N-CA 120.788 -0.365 . . . . 42.26 110.687 175.362 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 562' ' ' ASN . . . . . . . . . . . . . . . -67.73 -41.29 83.69 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 122.082 -0.386 . . . . 43.43 111.672 -177.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 563' ' ' TYR . . . . . . . . . . . . . . . -74.22 -55.77 5.67 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 120.452 -0.499 . . . . 44.56 111.688 -178.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 564' ' ' TYR . . . . . . . . . . . . . . . -76.81 -15.5 59.71 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 121.944 -0.472 . . . . 43.94 112.207 -172.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 565' ' ' SER . . . . . 0.512 ' CB ' ' O ' ' B' ' 561' ' ' VAL . . . -64.68 -35.89 82.49 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 112.631 0.604 . . . . 46.77 112.631 -174.541 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 566' ' ' SER . . . . . . . . . . . . . . . -67.63 -39.91 84.63 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.253 -0.579 . . . . 49.43 111.39 178.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 567' ' ' CYS . . . . . . . . . . . . . . . -70.01 -47.74 60.91 Favored 'General case' 0 C--O 1.241 0.627 0 O-C-N 122.127 -0.358 . . . . 48.82 111.307 -179.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . . . -64.9 -28.46 69.55 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 120.599 -0.441 . . . . 47.41 111.119 173.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 569' ' ' TYR . . . . . . . . . . . . . . . -69.06 -35.47 76.58 Favored 'General case' 0 CA--C 1.515 -0.38 0 O-C-N 121.975 -0.453 . . . . 52.46 111.268 175.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 570' ' ' ILE . . . . . . . . . . . . . . . -66.07 -49.01 79.62 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 CA-C-O 121.247 0.546 . . . . 54.03 109.754 174.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 571' ' ' ALA . . . . . . . . . . . . . . . -63.77 -25.89 68.39 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.749 -0.66 . . . . 55.67 112.48 -177.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . . . -86.36 -22.99 26.36 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 121.821 -0.55 . . . . 55.05 111.814 167.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 573' ' ' PHE . . . . . . . . . . . . . . . -74.87 -37.16 62.25 Favored 'General case' 0 CA--C 1.508 -0.637 0 O-C-N 122.23 -0.294 . . . . 55.54 111.649 -167.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 574' ' ' LYS . . . . . . . . . . . . . . . -66.39 -29.81 70.05 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 118.117 -1.433 . . . . 55.36 110.879 168.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 575' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.461 0 N-CA-C 118.016 1.966 . . . . 56.18 118.016 -178.411 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 604' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.213 -0.829 0 N-CA-C 109.461 -0.57 . . . . 23.64 109.461 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 605' ' ' LEU . . . . . 0.427 ' O ' ' CB ' ' B' ' 609' ' ' LEU . . . -62.68 -30.87 71.72 Favored 'General case' 0 CA--C 1.513 -0.462 0 O-C-N 124.216 0.948 . . . . 26.07 111.199 -176.647 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 606' ' ' THR . . . . . . . . . . . . . . . -62.9 -52.09 64.41 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 120.112 -0.635 . . . . 26.55 110.653 169.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 607' ' ' THR . . . . . . . . . . . . . . . -72.15 -42.48 65.89 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 120.653 -0.419 . . . . 26.95 111.82 -177.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 608' ' ' GLN . . . . . . . . . . . . . . . -69.1 -40.01 78.64 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 120.369 -0.532 . . . . 28.93 111.23 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 609' ' ' LEU . . . . . 0.427 ' CB ' ' O ' ' B' ' 605' ' ' LEU . . . -65.7 -40.37 92.22 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 120.658 -0.417 . . . . 29.28 111.265 175.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 610' ' ' THR . . . . . . . . . . . . . . . -68.77 -42.66 77.15 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 121.115 -0.234 . . . . 30.32 111.434 179.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 611' ' ' ILE . . . . . . . . . . . . . . . -74.51 -33.74 33.58 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.349 0 O-C-N 122.065 -0.397 . . . . 32.18 111.087 -178.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 612' ' ' ILE . . . . . . . . . . . . . . . -69.83 -43.16 79.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 O-C-N 121.497 -0.752 . . . . 34.94 110.385 175.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 613' ' ' MET . . . . . . . . . . . . . . . -66.72 -48.85 67.93 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.909 -0.495 . . . . 36.37 111.144 177.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 614' ' ' GLY . . . . . . . . . . . . . . . -65.98 -36.38 91.96 Favored Glycine 0 C--O 1.221 -0.685 0 C-N-CA 121.16 -0.543 . . . . 39.2 113.197 178.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 615' ' ' GLY . . . . . . . . . . . . . . . -72.47 -36.39 59.11 Favored Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 120.035 -1.079 . . . . 39.49 112.435 179.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 616' ' ' LYS . . . . . . . . . . . . . . . -66.27 -32.17 73.43 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.418 -0.913 . . . . 42.05 110.357 171.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 617' ' ' ALA . . . . . . . . . . . . . . . -67.78 -46.35 72.23 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 112.118 0.414 . . . . 43.8 112.118 175.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 618' ' ' ILE . . . . . . . . . . . . . . . -71.26 -36.04 60.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 O-C-N 121.968 -0.457 . . . . 46.65 110.596 -178.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 619' ' ' TRP . . . . . . . . . . . . . . . -69.49 -36.18 76.27 Favored 'General case' 0 CA--C 1.517 -0.309 0 O-C-N 121.566 -0.709 . . . . 48.25 111.02 176.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 620' ' ' ASN . . . . . . . . . . . . . . . -67.19 -33.03 74.51 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.398 -0.521 . . . . 49.61 111.382 173.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 621' ' ' ASN . . . . . . . . . . . . . . . -70.4 -37.54 74.49 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.396 -0.522 . . . . 51.06 111.498 176.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 622' ' ' ILE . . . . . . . . . . . . . . . -65.17 -36.06 76.86 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 120.902 0.382 . . . . 52.18 110.508 174.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 623' ' ' GLN . . . . . . . . . . . . . . . -68.23 -33.7 74.89 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 121.891 -0.506 . . . . 55.34 111.581 173.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 624' ' ' GLU . . . . . . . . . . . . . . . -68.61 -34.26 75.46 Favored 'General case' 0 C--O 1.234 0.249 0 O-C-N 122.141 -0.349 . . . . 54.33 111.597 177.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 625' ' ' VAL . . . . . . . . . . . . . . . -72.99 -41.12 59.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 C-N-CA 120.087 -0.645 . . . . 55.71 110.641 174.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 626' ' ' LEU . . . . . . . . . . . . . . . -90.02 2.58 55.02 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 113.969 1.1 . . . . 56.3 113.969 -172.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 627' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 118.723 0.692 . . . . 57.26 111.372 177.391 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 665' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.603 0 N-CA-C 110.186 -0.302 . . . . 45.13 110.186 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 666' ' ' TYR . . . . . . . . . . . . . . . -64.39 -32.46 74.08 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 120.176 -0.61 . . . . 42.77 110.782 175.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . . . -67.48 -43.97 79.7 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 111.557 0.206 . . . . 43.93 111.557 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 668' ' ' TYR . . . . . . . . . . . . . . . -69.29 -26.55 64.79 Favored 'General case' 0 CA--C 1.512 -0.519 0 C-N-CA 120.399 -0.52 . . . . 39.92 110.698 176.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . . . -64.08 -42.59 96.91 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.421 -0.511 . . . . 39.07 111.194 170.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 670' ' ' GLU . . . . . . . . . . . . . . . -66.91 -42.77 84.9 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.262 -0.575 . . . . 37.34 111.42 179.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 671' ' ' MET . . . . . . . . . . . . . . . -70.22 -30.26 67.3 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 119.776 -0.769 . . . . 38.02 111.542 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 672' ' ' ILE . . . . . . . . . . . . . . . -72.87 -32.62 40.82 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.436 0 C-N-CA 120.129 -0.629 . . . . 36.7 110.073 177.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 673' ' ' ILE . . . . . . . . . . . . . . . -64.26 -35.61 74.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.109 -0.636 . . . . 36.15 109.992 170.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 674' ' ' GLN . . . . . . . . . . . . . . . -69.75 -34.68 74.15 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 119.895 -0.722 . . . . 36.49 111.49 175.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 675' ' ' PHE . . . . . . . . . . . . . . . -69.12 -34.44 75.06 Favored 'General case' 0 CA--C 1.51 -0.593 0 O-C-N 121.855 -0.528 . . . . 33.16 110.795 176.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 676' ' ' GLY . . . . . . . . . . . . . . . -64.58 -36.07 92.7 Favored Glycine 0 N--CA 1.443 -0.859 0 C-N-CA 119.839 -1.172 . . . . 32.99 111.823 170.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 677' ' ' PHE . . . . . . . . . . . . . . . -63.18 -49.53 73.92 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 120.612 -0.435 . . . . 32.17 111.342 175.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 678' ' ' VAL . . . . . . . . . . . . . . . -69.99 -49.44 56.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.738 0.304 . . . . 31.39 110.371 -176.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 679' ' ' THR . . . . . . . . . . . . . . . -77.26 -44.45 29.8 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.764 0.653 . . . . 30.34 112.764 -173.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 680' ' ' LEU . . . . . . . . . . . . . . . -75.07 -34.84 61.84 Favored 'General case' 0 CA--C 1.513 -0.476 0 O-C-N 121.466 -0.771 . . . . 31.76 111.684 -175.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 681' ' ' PHE . . . . . . . . . . . . . . . -111.69 29.6 7.71 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.665 0.617 . . . . 33.91 112.665 -175.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 682' ' ' VAL . . . . . . . . . . . . . . . -59.19 -28.07 38.11 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.554 0 C-N-CA 125.339 1.456 . . . . 34.38 112.484 -176.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 683' ' ' ALA . . . . . . . . . . . . . . . -72.89 -17.38 61.52 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 118.136 -1.426 . . . . 35.77 112.959 -179.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 684' ' ' SER . . . . . . . . . . . . . . . -74.24 -74.88 0.17 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-N 118.918 0.781 . . . . 31.35 111.675 -175.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . . . -122.38 131.29 24.41 Favored Pre-proline 0 N--CA 1.438 -1.051 0 N-CA-C 103.505 -2.776 . . . . 34.68 103.505 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 686' ' ' PRO . . . . . . . . . . . . . . . -88.6 -17.39 2.24 Favored 'Trans proline' 0 C--O 1.239 0.55 0 N-CA-C 114.124 0.778 . . . . 36.6 114.124 -173.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 687' ' ' LEU . . . . . . . . . . . . . . . -79.97 3.61 19.5 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 119.365 0.984 . . . . 35.59 112.778 178.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 688' ' ' ALA . . . . . . . . . . . . . . . -68.37 -20.51 0.54 Allowed Pre-proline 0 C--O 1.262 1.73 0 CA-C-O 117.91 -1.043 . . . . 34.98 112.822 -173.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 689' ' ' PRO . . . . . . . . . . . . . . . -67.59 -46.28 2.81 Favored 'Trans proline' 0 C--O 1.244 0.778 0 CA-C-N 122.143 1.801 . . . . 34.04 113.759 -176.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 690' ' ' LEU . . . . . . . . . . . . . . . -59.27 -41.24 88.42 Favored 'General case' 0 C--O 1.239 0.507 0 O-C-N 123.334 0.396 . . . . 34.42 111.606 -179.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . . . -61.1 -20.75 63.0 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.388 0.675 . . . . 38.79 112.091 -177.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 692' ' ' ALA . . . . . . . . . . . . . . . -72.83 -62.71 1.36 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 117.981 -1.488 . . . . 42.54 111.221 171.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 693' ' ' LEU . . . . . . . . . . . . . . . -67.8 -35.46 78.69 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 120.638 0.256 . . . . 43.27 111.243 -159.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 694' ' ' VAL . . . . . . . . . . . . . . . -55.54 -49.46 73.41 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 C-N-CA 123.353 0.661 . . . . 46.42 110.069 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 695' ' ' ASN . . . . . . . . . . . . . . . -62.39 -40.15 95.53 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 116.426 -0.352 . . . . 47.9 110.945 176.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 696' ' ' ASN . . . . . . . . . . . . . . . -63.33 -31.96 73.26 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.262 -0.426 . . . . 50.68 111.485 -178.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . . . -68.83 -30.12 45.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 118.817 -1.153 . . . . 49.28 109.892 -175.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 698' ' ' LEU . . . . . . . . . . . . . . . -67.35 -24.55 65.72 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 120.585 -0.446 . . . . 53.23 111.812 175.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 699' ' ' GLU . . . . . . . . . . . . . . . -62.33 -31.73 72.4 Favored 'General case' 0 C--N 1.342 0.282 0 N-CA-C 111.408 0.151 . . . . 54.67 111.408 174.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 700' ' ' ILE . . . . . . . . . . . . . . . -62.01 -35.5 68.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 C-N-CA 120.34 -0.544 . . . . 54.64 109.89 173.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 701' ' ' ARG . . . . . . . . . . . . . . . -60.85 -36.11 78.3 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 116.301 -0.408 . . . . 56.44 111.884 174.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 702' ' ' VAL . . . . . . . . . . . . . . . -66.45 -33.65 64.9 Favored 'Isoleucine or valine' 0 C--N 1.346 0.433 0 C-N-CA 120.374 -0.53 . . . . 55.24 110.314 178.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 703' ' ' ASP . . . . . . . . . . . . . . . -69.05 -29.85 68.08 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 119.488 -0.885 . . . . 57.16 110.383 172.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 704' ' ' ALA . . . . . . . . . . . . . . . -78.35 -23.78 46.78 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 112.411 0.523 . . . . 55.88 112.411 -174.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 705' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.213 0 N-CA-C 113.112 0.782 . . . . 58.13 113.112 -174.769 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 726' ' ' GLN . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.504 0 N-CA-C 110.348 -0.242 . . . . 33.2 110.348 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 727' ' ' PRO . . . . . . . . . . . . . . . -68.28 -42.74 5.22 Favored 'Trans proline' 0 C--O 1.237 0.466 0 O-C-N 123.219 1.115 . . . . 33.67 113.849 -176.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 728' ' ' ILE . . . . . . . . . . . . . . . -66.76 -33.48 63.71 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.327 0 C-N-CA 120.07 -0.652 . . . . 34.03 110.114 171.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 729' ' ' MET . . . . . . . . . . . . . . . -71.69 -43.63 65.64 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 120.094 -0.642 . . . . 33.37 111.869 179.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 730' ' ' GLN . . . . . . . . . . . . . . . -68.4 -29.85 68.63 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 119.988 -0.685 . . . . 32.68 110.946 176.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 731' ' ' GLY . . . . . . . . . . . . . . . -65.45 -41.74 96.21 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 119.853 -1.165 . . . . 35.79 112.282 170.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 732' ' ' ILE . . . . . . . . . . . . . . . -65.78 -25.96 37.61 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.154 0 O-C-N 122.651 -0.323 . . . . 36.13 110.233 174.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 733' ' ' ALA . . . . . . . . . . . . . . . -77.85 -41.32 37.31 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 121.903 -0.498 . . . . 36.03 112.194 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 734' ' ' ILE . . . . . . . . . . . . . . . -68.74 -39.65 80.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.599 0 C-N-CA 119.786 -0.766 . . . . 34.71 110.13 175.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 735' ' ' LEU . . . . . . . . . . . . . . . -65.39 -27.07 68.29 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.443 -0.344 . . . . 35.58 111.104 171.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 736' ' ' ALA . . . . . . . . . . . . . . . -75.73 -32.53 60.06 Favored 'General case' 0 CA--C 1.512 -0.507 0 O-C-N 122.077 -0.389 . . . . 34.5 111.672 176.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 737' ' ' VAL . . . . . . . . . . . . . . . -63.7 -49.66 81.26 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 C-N-CA 119.766 -0.774 . . . . 34.01 109.473 172.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 738' ' ' VAL . . . . . . . . . . . . . . . -63.66 -35.63 73.53 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 O-C-N 122.089 -0.382 . . . . 32.25 111.078 174.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 739' ' ' THR . . . . . . . . . . . . . . . -78.74 -37.82 40.35 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.74 -0.6 . . . . 31.26 111.33 -173.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 740' ' ' ASN . . . . . . . . . . . . . . . -73.42 -32.82 64.62 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 121.824 -0.547 . . . . 29.22 110.404 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 741' ' ' ALA . . . . . . . . . . . . . . . -65.79 -39.47 90.97 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.337 -0.545 . . . . 29.39 111.091 170.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 742' ' ' MET . . . . . . . . . . . . . . . -74.76 -24.54 58.7 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.102 -0.639 . . . . 29.92 111.346 174.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 743' ' ' ILE . . . . . . . . . . . . . . . -73.51 -42.1 56.12 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 O-C-N 121.81 -0.556 . . . . 29.61 109.848 178.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 744' ' ' ILE . . . . . . . . . . . . . . . -66.96 -44.53 88.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 O-C-N 121.799 -0.563 . . . . 28.98 110.846 171.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 745' ' ' ALA . . . . . . . . . . . . . . . -76.41 -52.7 9.36 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.437 -0.789 . . . . 27.93 112.971 -172.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 746' ' ' PHE . . . . . . . . . . . . . . . -85.22 -52.23 6.06 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 121.033 -1.042 . . . . 30.42 110.62 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 747' ' ' THR . . . . . . . . . . . . . . . -74.11 -41.22 61.97 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 118.112 -1.435 . . . . 30.74 112.627 -173.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 748' ' ' SER . . . . . . . . . . . . . . . -78.71 -36.27 43.67 Favored 'General case' 0 C--N 1.346 0.438 0 C-N-CA 118.103 -1.439 . . . . 30.54 114.044 -154.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 749' ' ' ASP . . . . . . . . . . . . . . . 52.06 52.5 14.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.873 0.869 . . . . 32.62 110.68 -159.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 750' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.717 0 C-N-CA 125.034 1.334 . . . . 34.47 111.651 176.664 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 829' ' ' TRP . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.434 0 CA-C-O 121.678 0.751 . . . . 16.69 110.352 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 830' ' ' HIS . . . . . . . . . . . . . . . -77.41 -29.69 53.14 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 114.495 -1.23 . . . . 16.88 113.078 -160.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 831' ' ' VAL . . . . . . . . . . . . . . . -71.48 -35.31 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 C-N-CA 120.028 -0.669 . . . . 21.06 111.382 -156.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 832' ' ' ILE . . . . . . . . . . . . . . . -64.13 -37.96 81.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 CA-C-O 121.495 0.664 . . . . 20.33 109.824 174.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 833' ' ' ALA . . . . . 0.461 ' HB2' ' HB2' ' A' ' 833' ' ' ALA . . . -69.94 -37.84 75.99 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 115.856 -0.611 . . . . 19.87 111.746 179.339 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 834' ' ' ALA . . . . . . . . . . . . . . . -76.16 -30.55 58.15 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 120.005 -0.678 . . . . 20.66 111.443 179.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 835' ' ' LYS . . . . . . . . . . . . . . . -64.48 -42.28 95.98 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 120.058 -0.657 . . . . 20.99 110.265 172.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 836' ' ' LEU . . . . . . . . . . . . . . . -66.75 -34.83 78.69 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.909 0.385 . . . . 21.92 111.055 175.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 837' ' ' ALA . . . . . . . . . . . . . . . -73.2 -35.11 66.29 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 122.044 -0.41 . . . . 22.85 111.816 179.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 838' ' ' PHE . . . . . . . . . . . . . . . -70.12 -36.6 74.94 Favored 'General case' 0 CA--C 1.508 -0.672 0 C-N-CA 120.939 -0.305 . . . . 22.91 110.58 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 839' ' ' ILE . . . . . . . . . . . . . . . -61.63 -39.86 84.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 C-N-CA 120.371 -0.532 . . . . 24.26 109.841 172.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 840' ' ' ILE . . . . . . . . . . . . . . . -69.95 -46.14 74.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-O 120.755 0.312 . . . . 25.58 111.034 179.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 841' ' ' VAL . . . . . . . . . . . . . . . -75.0 -39.98 44.85 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 O-C-N 121.875 -0.515 . . . . 27.12 110.957 -174.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 842' ' ' MET . . . . . . . . . . . . . . . -70.61 -37.5 73.86 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 121.757 -0.59 . . . . 27.49 111.055 177.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 843' ' ' GLU . . . . . . . . . . . . . . . -65.43 -36.41 83.84 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 120.275 -0.57 . . . . 27.68 111.078 172.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 844' ' ' HIS . . . . . . . . . . . . . . . -74.33 -41.26 61.39 Favored 'General case' 0 N--CA 1.457 -0.116 0 N-CA-C 112.058 0.392 . . . . 29.37 112.058 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 845' ' ' ILE . . . . . . . . . . . . . . . -73.88 -39.76 52.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 O-C-N 121.61 -0.681 . . . . 28.57 110.585 178.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 846' ' ' ILE . . . . . . . . . . . . . . . -75.22 -18.93 16.09 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 O-C-N 121.646 -0.659 . . . . 28.55 110.5 179.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 847' ' ' TYR . . . . . . . . . . . . . . . -84.52 -23.04 29.96 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.404 -0.518 . . . . 31.46 111.062 167.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 848' ' ' SER . . . . . . . . . . . . . . . -70.39 -43.48 69.96 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.131 -0.628 . . . . 31.85 110.7 174.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 849' ' ' VAL . . . . . . . . . . . . . . . -64.07 -34.04 66.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-O 120.774 0.321 . . . . 34.14 110.357 175.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 850' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.599 0 O-C-N 121.778 -0.576 . . . . 34.76 111.896 175.769 . . . . . . . . 0 0 . 1 stop_ save_