data_6s37_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 6s37 _Structure_validation_residue.Date_analyzed 2020-10-23 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 ' 50' ' ' THR . . . . . 0.406 ' N ' ' O ' ' A' ' 706' ' ' HOH . 14.5 t . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.737 0.303 . . . . 97.0 110.988 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -61.45 -21.05 63.8 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.383 -0.527 . . . . 107.99 111.434 170.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.9 tp -62.35 -52.21 64.56 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 120.862 0.363 . . . . 88.19 111.007 173.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.83 -27.47 68.79 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 119.507 -0.877 . . . . 95.2 112.687 179.544 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.5 tm0? -76.29 -28.0 56.82 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.458 0.572 . . . . 97.22 112.077 175.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 68.3 p -69.9 -27.34 64.71 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.85 -0.74 . . . . 65.56 111.154 172.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.81 -36.42 64.97 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 121.036 -0.266 . . . . 66.83 111.462 177.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 51.9 m170 -66.77 -38.34 86.37 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.271 -0.572 . . . . 87.19 111.024 175.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -64.1 -36.1 82.93 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.44 -0.504 . . . . 49.15 111.258 175.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.9 -34.59 66.75 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 112.739 0.644 . . . . 57.75 112.739 -175.153 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . 0.534 ' OD2' ' NE2' ' B' ' 173' ' ' GLN . 0.7 OUTLIER -74.0 -33.87 63.97 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 112.907 0.706 . . . . 64.94 112.907 177.478 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 69.0 mtt85 -61.61 -39.46 91.32 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 118.703 -1.199 . . . . 54.78 109.745 156.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mt -64.34 -52.46 58.32 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.362 -0.381 . . . . 55.63 111.311 178.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -64.94 -39.19 93.12 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.684 -0.406 . . . . 36.3 111.487 -175.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 44.3 m-20 -68.24 -37.81 81.19 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.049 -0.66 . . . . 44.18 111.313 177.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.11 -45.44 85.13 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.554 -0.459 . . . . 33.3 111.165 -177.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 9.8 tp -71.51 -38.54 71.11 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 119.263 -0.975 . . . . 44.99 111.219 -178.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 35.6 tp -57.32 -49.83 74.88 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 119.567 -0.853 . . . . 44.36 110.887 178.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 59.0 mtm -70.75 -32.45 69.61 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 119.505 -0.878 . . . . 40.71 111.73 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.99 -41.58 96.75 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.06 -0.656 . . . . 27.88 111.271 176.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 32.8 mt -73.13 -37.72 53.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 120.068 -0.653 . . . . 34.93 110.553 178.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 66.8 mtp180 -59.51 -31.02 68.99 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.147 -0.621 . . . . 30.64 111.56 176.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.3 t -67.76 -42.66 81.4 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.615 -0.434 . . . . 36.7 111.125 179.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.65 -36.82 83.47 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.453 -0.499 . . . . 50.97 110.882 175.714 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.19 -30.04 70.17 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.384 -0.526 . . . . 32.68 111.435 175.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -79.93 -35.88 37.14 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.483 -0.487 . . . . 31.24 112.016 -177.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.6 p -67.31 -47.64 80.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 C-N-CA 119.616 -0.834 . . . . 33.7 110.776 -178.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 62.1 p -65.14 -47.82 75.73 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 121.672 -0.643 . . . . 50.53 110.894 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 93.2 p -66.1 -33.34 75.56 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.021 -0.672 . . . . 41.74 111.651 175.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -68.84 -36.39 81.94 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.116 -1.04 . . . . 35.49 112.589 175.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -59.64 -40.23 87.0 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 122.266 -0.55 . . . . 51.31 110.995 174.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 17.3 mt -68.32 -42.92 84.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 CA-C-O 120.825 0.345 . . . . 40.36 110.688 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -61.14 -34.95 75.81 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.462 -0.495 . . . . 47.63 111.141 177.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLN . . . . . 0.612 ' NE2' ' O ' ' A' ' 146' ' ' THR . 1.0 OUTLIER -63.07 -45.71 90.86 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.967 -0.693 . . . . 50.14 111.168 177.898 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 61.3 mt -66.8 -24.76 66.22 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.243 0.46 . . . . 56.5 112.243 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.71 2.56 78.74 Favored Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 114.664 0.626 . . . . 42.73 114.664 171.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.41 14.35 74.12 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 115.093 0.797 . . . . 43.77 115.093 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -96.65 74.47 2.75 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 122.502 1.144 . . . . 39.98 109.368 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -64.87 -42.14 95.1 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 114.517 -1.219 . . . . 87.18 111.583 -174.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.6 mp0 -63.82 -49.06 74.35 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.562 -0.455 . . . . 71.4 111.083 -178.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 8.3 t -62.07 -37.11 83.77 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.13 -0.628 . . . . 46.78 111.157 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.76 -38.24 86.22 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.423 -0.511 . . . . 33.14 111.259 179.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -63.85 -36.1 92.86 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.064 -1.065 . . . . 34.06 112.636 177.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 63.2 mttt -68.88 -36.24 77.84 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 122.251 -0.558 . . . . 75.05 111.396 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 3.7 mtt-85 -70.22 -35.49 73.91 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.106 -0.638 . . . . 40.33 111.082 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 38.1 mmt -59.8 -45.14 93.24 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.305 -0.558 . . . . 43.21 110.862 172.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.63 92.56 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.412 -0.515 . . . . 30.39 111.161 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 26.5 tp -64.74 -37.63 88.24 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.058 -0.657 . . . . 35.3 111.156 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 13.2 t -62.76 -41.99 99.48 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.33 -0.548 . . . . 34.33 111.31 175.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 74.6 t -58.95 -50.78 78.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-O 121.207 0.527 . . . . 36.92 110.177 175.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -63.05 -38.16 90.07 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 116.445 -0.343 . . . . 69.94 111.696 -175.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 59.3 mt -69.74 -43.59 71.99 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.068 -0.653 . . . . 32.2 111.443 -177.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -68.23 -33.0 73.6 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.226 -0.59 . . . . 46.74 111.695 179.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASN . . . . . 0.526 ' ND2' ' O ' ' A' ' 703' ' ' HOH . 85.7 m-20 -68.7 -43.61 75.71 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.4 -0.52 . . . . 45.04 111.049 175.556 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 71.4 mttt -61.42 -40.95 96.28 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.371 -0.531 . . . . 65.4 111.049 175.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 5.8 t -67.21 -39.94 86.36 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.818 -0.753 . . . . 50.68 111.352 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -70.51 -31.27 68.3 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.121 -0.631 . . . . 81.08 111.274 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -66.16 -42.15 89.36 Favored 'General case' 0 CA--C 1.518 -0.278 0 O-C-N 122.119 -0.363 . . . . 50.28 111.077 175.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 92.2 mt -65.07 -41.25 95.27 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.627 -0.429 . . . . 47.67 111.117 175.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 32.5 t -59.62 -44.43 93.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-O 121.004 0.43 . . . . 53.18 110.477 177.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ASP . . . . . 0.517 ' OD1' ' NE2' ' A' ' 129' ' ' GLN . 63.7 m-20 -66.78 -40.23 88.11 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.043 -0.663 . . . . 90.24 111.164 179.537 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -58.59 -35.11 71.9 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.051 -0.659 . . . . 58.44 111.297 172.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -65.52 -45.09 84.83 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.778 -0.369 . . . . 56.98 111.291 179.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 27.1 t -75.05 -21.96 16.8 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 C-N-CA 120.09 -0.644 . . . . 84.0 111.717 -177.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -66.42 -41.25 89.51 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.431 -0.908 . . . . 83.12 111.06 174.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -90.69 -1.36 57.87 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 113.183 0.808 . . . . 83.66 113.183 -175.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -92.96 95.22 9.35 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 107.458 -1.312 . . . . 86.11 107.458 175.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -102.37 -36.72 8.34 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 113.28 0.845 . . . . 106.68 113.28 -178.913 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.87 126.75 86.25 Favored Pre-proline 0 C--O 1.237 0.421 0 N-CA-C 109.294 -0.632 . . . . 107.56 109.294 -179.674 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -66.43 -18.62 55.07 Favored 'Trans proline' 0 C--O 1.237 0.449 0 N-CA-C 114.505 0.925 . . . . 99.05 114.505 -171.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.94 -14.23 52.09 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.024 0.829 . . . . 114.37 111.613 170.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.3 tp -112.92 -28.56 7.68 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 124.439 1.096 . . . . 99.63 113.558 -176.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 44.4 ttt85 -67.72 -32.37 72.95 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.148 -0.621 . . . . 99.09 112.17 -173.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -62.28 -39.48 97.77 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 119.787 -1.197 . . . . 81.0 113.079 -178.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 12.4 mt -82.06 -23.09 36.02 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 122.23 -0.571 . . . . 71.33 112.406 176.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.68 -49.45 58.88 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.694 -0.402 . . . . 76.02 111.402 -173.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 14.7 t -74.33 -24.59 59.22 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 119.54 -0.864 . . . . 95.82 112.566 -176.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 -63.65 -36.84 85.15 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 118.858 -1.137 . . . . 76.62 110.965 170.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 7.8 tp -66.08 -36.91 84.46 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.367 -0.533 . . . . 53.03 111.039 174.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLN . . . . . 0.517 ' NE2' ' OD1' ' A' ' 110' ' ' ASP . 34.3 tt0 -69.61 -46.61 65.86 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.741 -0.384 . . . . 69.17 111.111 178.763 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.55 -41.96 98.4 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.466 -0.494 . . . . 61.46 111.189 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 68.4 m -64.32 -35.35 80.57 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.339 -0.544 . . . . 64.12 111.011 177.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -71.33 -40.85 70.49 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 119.263 -0.975 . . . . 62.07 111.553 -177.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -57.15 -34.22 68.2 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.932 -0.707 . . . . 68.69 111.074 175.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -67.66 -41.29 83.99 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.514 0.197 . . . . 99.14 111.174 173.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -66.99 -38.57 86.26 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.676 -0.41 . . . . 47.52 111.385 178.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -65.33 -41.09 94.3 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.574 -0.451 . . . . 50.0 111.463 -177.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -68.0 -30.79 70.13 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.284 -0.566 . . . . 67.65 111.613 -179.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.0 -40.03 68.82 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.224 -0.59 . . . . 46.04 111.162 179.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 97.0 t -66.8 -39.59 83.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 C-N-CA 120.466 -0.494 . . . . 41.55 110.37 176.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.43 -33.42 72.5 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.347 -0.541 . . . . 42.03 111.352 172.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -69.9 -34.2 71.18 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.105 -1.045 . . . . 51.42 112.43 174.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' GLN . . . . . 0.476 ' OE1' ' ND2' ' A' ' 158' ' ' ASN . 26.0 mt-30 -65.63 -32.85 74.65 Favored 'General case' 0 C--O 1.238 0.457 0 O-C-N 122.237 -0.567 . . . . 59.0 111.427 173.939 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ARG . . . . . 0.549 ' NH2' ' O ' ' A' ' 602' ' ' ACT . 89.4 mtm-85 -71.74 -40.78 69.16 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.372 -0.531 . . . . 41.74 111.315 -179.634 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -68.46 -29.84 68.56 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 119.385 -0.926 . . . . 67.81 111.495 179.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -70.23 -33.79 72.08 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.884 -0.727 . . . . 53.59 110.791 172.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' THR . . . . . 0.612 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 93.2 m -64.52 -48.41 75.23 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.82 0.343 . . . . 51.34 110.875 175.951 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 76.2 mtt85 -63.58 -28.89 70.24 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.524 -0.47 . . . . 64.48 111.481 178.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -87.93 -9.05 54.79 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.161 0.801 . . . . 95.24 113.161 177.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 73.7 mtt-85 57.28 44.02 22.62 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.143 0.577 . . . . 87.52 111.669 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 1.4 t -120.52 114.36 21.65 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 109.324 -0.621 . . . . 77.75 109.324 -179.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 5.5 mt -63.21 -28.12 69.82 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.797 -0.638 . . . . 66.32 110.768 170.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -58.58 -58.3 9.15 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 121.056 -0.258 . . . . 103.14 110.961 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -65.1 -27.11 68.54 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.896 -0.322 . . . . 98.32 111.71 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -67.56 -49.4 63.38 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.271 -0.572 . . . . 60.72 111.132 -178.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -65.78 -22.95 66.61 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.551 -0.46 . . . . 74.57 111.873 175.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -63.9 -37.87 89.01 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.179 -0.608 . . . . 99.06 111.385 -177.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' VAL . . . . . . . . . . . . . 14.5 m -115.37 -1.17 9.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 113.051 0.76 . . . . 77.62 113.051 -175.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' ASN . . . . . 0.476 ' ND2' ' OE1' ' A' ' 142' ' ' GLN . 20.1 t-20 -72.85 -27.21 61.79 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 119.511 -0.876 . . . . 95.19 111.549 178.109 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 3.3 p -71.97 -36.96 69.97 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.035 -0.666 . . . . 81.1 110.87 173.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -60.73 -43.72 97.53 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.667 -0.413 . . . . 91.3 111.157 176.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -64.7 -39.76 94.21 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.506 -0.477 . . . . 47.81 111.248 -178.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . -66.97 -38.78 93.04 Favored Glycine 0 C--N 1.335 0.487 0 C-N-CA 120.067 -1.063 . . . . 52.19 112.864 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' ASN . . . . . 0.543 ' OD1' ' NH2' ' A' ' 167' ' ' ARG . 88.8 m-20 -65.8 -47.33 75.45 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 122.251 -0.558 . . . . 60.92 111.033 178.977 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' ALA . . . . . . . . . . . . . . . -65.21 -31.95 73.37 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.553 -0.459 . . . . 49.52 111.549 179.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 34.5 tpp -72.16 -34.98 68.89 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.25 -0.58 . . . . 55.63 111.524 177.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -63.7 -39.56 97.64 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 119.921 -1.133 . . . . 48.22 112.491 175.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' ARG . . . . . 0.543 ' NH2' ' OD1' ' A' ' 163' ' ' ASN . 39.0 mtm105 -74.3 -30.62 62.15 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 122.171 -0.605 . . . . 78.98 111.607 177.115 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 17.8 mt -64.43 -38.84 92.43 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.473 -0.491 . . . . 45.82 111.278 176.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -71.0 -37.23 72.68 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.44 -0.504 . . . . 61.84 111.421 -177.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' THR . . . . . . . . . . . . . 58.0 m -69.27 -39.4 78.42 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.246 -0.582 . . . . 55.32 110.727 176.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' LEU . . . . . . . . . . . . . 9.5 mt -63.75 -36.72 84.79 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.571 -0.452 . . . . 54.92 111.333 177.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' ARG . . . . . . . . . . . . . 37.3 ttt-85 -63.95 -44.32 93.16 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 119.79 -0.764 . . . . 45.97 110.951 175.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -57.18 -48.93 77.52 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.751 0.31 . . . . 63.0 111.288 179.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -63.28 -37.34 86.87 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.499 -0.48 . . . . 56.01 111.266 178.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 18.2 mt -71.58 -40.15 70.11 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.695 -0.402 . . . . 41.88 111.418 -179.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 78.5 t -63.5 -40.58 89.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 120.607 -0.437 . . . . 46.27 110.575 178.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' THR . . . . . . . . . . . . . 91.4 m -64.36 -41.63 96.63 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.42 -0.512 . . . . 46.05 111.142 177.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 55.7 m -65.44 -41.4 93.53 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.732 -0.387 . . . . 53.12 111.338 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 28.2 mt -66.38 -43.97 84.44 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.398 -0.521 . . . . 40.46 111.137 177.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 33.1 t -61.69 -34.22 75.38 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.946 -0.302 . . . . 51.86 111.601 176.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 69.8 tt0 -69.64 -39.59 77.04 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.548 -0.461 . . . . 59.39 111.228 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 24.4 tpt180 -67.08 -44.7 79.41 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.264 -0.574 . . . . 80.93 111.146 178.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -60.41 -43.67 98.45 Favored Glycine 0 C--N 1.334 0.428 0 C-N-CA 120.092 -1.051 . . . . 45.5 112.688 177.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -65.53 -33.54 76.16 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.065 -0.654 . . . . 71.2 111.456 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -59.81 -27.63 66.76 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 120.571 -0.452 . . . . 79.12 111.79 178.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 59.6 mt -74.78 -35.95 38.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 120.867 0.365 . . . . 79.05 110.874 -178.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.79 -32.9 74.8 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 113.097 0.777 . . . . 88.62 113.097 -177.904 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 118.297 0.498 . . . . 91.99 111.696 175.754 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.894 0.378 . . . . 74.49 110.939 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.24 -40.39 67.75 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.191 -0.603 . . . . 54.83 110.826 174.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' HIS . . . . . . . . . . . . . 33.0 m80 -67.35 -33.7 75.77 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.43 -0.508 . . . . 66.94 111.551 176.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -68.67 -41.07 79.77 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.21 -0.596 . . . . 44.1 111.364 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 1.4 m -66.9 -37.74 84.95 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.281 -0.567 . . . . 58.84 111.374 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -65.54 -43.23 90.57 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.26 -0.576 . . . . 64.15 111.143 176.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 64.2 mtt85 -58.53 -46.34 87.0 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.653 -0.419 . . . . 41.23 111.013 175.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 32.0 tp -67.22 -46.27 74.32 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.874 -0.33 . . . . 34.41 111.336 -176.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -69.92 -41.33 74.79 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.947 -0.701 . . . . 39.55 111.505 -176.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -68.35 -36.99 80.06 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 119.906 -0.718 . . . . 41.23 111.281 178.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.45 -40.49 91.33 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.213 -0.595 . . . . 29.02 111.257 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 6.9 mt -74.53 -43.33 56.31 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.189 -0.604 . . . . 38.42 111.8 -177.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 83.1 mt -61.95 -38.47 88.59 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.285 -0.566 . . . . 39.37 111.226 178.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' MET . . . . . . . . . . . . . 59.5 mtm -77.77 -22.6 49.94 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.813 -0.755 . . . . 43.89 111.484 178.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -74.35 -39.82 62.53 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 120.028 -0.669 . . . . 26.72 111.089 -179.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' ILE . . . . . . . . . . . . . 6.9 tp -69.95 -40.97 79.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 120.434 -0.506 . . . . 28.73 110.868 179.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 56.9 mtp180 -63.0 -31.65 72.84 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 121.654 -0.654 . . . . 42.61 111.191 174.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 15.2 t -63.7 -33.7 76.23 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.382 -0.527 . . . . 26.65 110.919 174.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 22.9 t -76.9 -47.23 21.69 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 120.88 -0.328 . . . . 28.05 111.48 178.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.29 -28.4 62.99 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 119.986 -0.685 . . . . 30.17 111.64 179.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -78.51 -38.74 40.01 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 120.624 -0.43 . . . . 32.27 112.123 -177.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' VAL . . . . . . . . . . . . . 14.6 p -56.6 -53.82 36.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 C-N-CA 118.791 -1.164 . . . . 27.42 110.941 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' SER . . . . . 0.425 ' OG ' ' OH ' ' B' ' 154' ' ' TYR . 66.7 m -60.0 -43.71 95.01 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.591 -0.693 . . . . 31.84 110.869 173.63 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.2 m -56.91 -45.81 82.4 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.628 -0.429 . . . . 60.82 110.614 171.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.45 -41.09 99.8 Favored Glycine 0 C--N 1.335 0.495 0 C-N-CA 120.264 -0.969 . . . . 35.35 113.028 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -59.82 -43.17 94.67 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 122.241 -0.564 . . . . 42.33 110.916 177.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 91.7 mt -65.49 -35.56 75.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 C-N-CA 120.809 -0.356 . . . . 41.31 110.708 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -66.58 -33.59 76.01 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.545 -0.722 . . . . 50.63 111.723 177.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -64.31 -37.88 89.05 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.243 -0.583 . . . . 59.36 110.928 174.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 30.0 mt -66.45 -29.8 70.02 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.863 -0.335 . . . . 44.99 111.568 178.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -90.9 6.65 81.83 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 115.255 0.862 . . . . 47.91 115.255 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.8 8.0 86.52 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 118.411 1.106 . . . . 51.56 115.433 179.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -89.71 71.08 7.78 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 122.678 1.228 . . . . 66.2 109.254 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -70.59 -40.22 73.36 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.517 -1.219 . . . . 77.61 111.716 -172.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -69.28 -40.25 77.86 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.465 -0.494 . . . . 73.31 110.999 176.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 33.3 t -69.52 -29.11 66.65 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.658 -0.417 . . . . 47.31 111.679 179.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.8 -39.04 80.32 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.221 -0.591 . . . . 40.1 111.227 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . -61.29 -33.37 84.19 Favored Glycine 0 C--N 1.336 0.528 0 C-N-CA 120.271 -0.966 . . . . 44.18 112.856 176.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt -71.47 -36.15 71.08 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.763 -0.375 . . . . 55.29 110.811 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' ARG . . . . . . . . . . . . . 11.2 mmt180 -65.37 -39.2 92.0 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.711 -0.395 . . . . 68.06 111.162 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 26.9 tpp -64.6 -43.05 95.02 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.746 -0.381 . . . . 43.9 111.323 179.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.85 -41.92 95.31 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.544 -0.462 . . . . 36.64 111.344 -179.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 35.0 tp -64.2 -34.78 78.87 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.376 -0.529 . . . . 45.38 111.101 177.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' SER . . . . . . . . . . . . . 11.7 t -66.48 -39.15 88.62 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.299 -0.56 . . . . 34.38 111.433 177.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' VAL . . . . . . . . . . . . . 56.6 t -61.53 -46.76 95.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.264 0.554 . . . . 32.32 110.131 175.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -65.5 -44.26 87.59 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 122.059 -0.401 . . . . 79.55 111.569 -176.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 57.7 mt -62.29 -34.26 76.24 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.265 -0.574 . . . . 34.57 111.445 177.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 27.5 t30 -68.85 -44.05 74.16 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.371 -0.532 . . . . 50.84 111.209 177.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -62.35 -41.78 98.86 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.397 -0.521 . . . . 46.96 111.172 178.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -70.69 -40.29 72.97 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.385 -0.526 . . . . 59.29 111.428 -178.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 21.9 p -70.2 -36.62 74.72 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.966 -0.694 . . . . 42.57 111.224 -179.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -60.66 -39.9 90.06 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.499 -0.48 . . . . 49.62 111.156 174.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.96 -39.25 93.2 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.473 -0.491 . . . . 33.0 111.321 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 23.2 mt -66.9 -42.02 86.16 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.22 -0.592 . . . . 35.39 111.36 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 55.5 t -59.37 -39.13 78.25 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 120.609 -0.436 . . . . 36.95 110.411 177.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -67.34 -45.26 76.93 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.215 -0.594 . . . . 66.73 111.267 -179.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -57.04 -42.55 80.7 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.62 -0.432 . . . . 83.08 111.291 174.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -61.37 -47.38 86.12 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.936 -0.306 . . . . 37.62 111.17 -177.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 75.0 t -65.32 -37.12 79.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 CA-C-O 120.836 0.351 . . . . 61.75 110.756 -176.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -71.87 -23.23 61.48 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 121.845 -0.534 . . . . 69.2 111.661 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -99.32 4.73 46.54 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 112.94 0.718 . . . . 54.3 112.94 -177.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -105.46 92.05 4.03 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.325 -1.361 . . . . 75.44 107.325 177.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 -109.63 -36.45 5.95 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 113.963 1.097 . . . . 90.47 113.963 -175.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' GLU . . . . . 0.581 ' N ' ' OE2' ' B' ' 118' ' ' GLU . 7.3 pm0 -51.78 123.49 24.72 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.577 -0.527 . . . . 81.51 109.577 175.419 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.99 -18.31 16.54 Favored 'Trans proline' 0 N--CA 1.477 0.553 0 N-CA-C 115.368 1.257 . . . . 91.94 115.368 -173.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' ALA . . . . . . . . . . . . . . . -66.56 -21.01 66.15 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 118.437 0.562 . . . . 78.61 112.027 172.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 mt -113.24 -13.42 12.96 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 114.342 1.238 . . . . 79.64 114.342 -178.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' ARG . . . . . . . . . . . . . 7.6 ttp180 -63.68 -44.57 93.34 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.446 0.567 . . . . 105.47 111.647 -170.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -71.21 -38.22 63.23 Favored Glycine 0 C--N 1.335 0.492 0 C-N-CA 119.924 -1.132 . . . . 51.01 112.669 179.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 3.1 tp -69.15 -35.7 76.64 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 122.228 -0.572 . . . . 56.72 111.323 178.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -66.2 -40.25 90.26 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.274 -0.57 . . . . 41.35 111.201 177.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' THR . . . . . . . . . . . . . 85.1 m -67.81 -35.93 79.5 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.288 -0.565 . . . . 48.65 111.136 178.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' GLU . . . . . . . . . . . . . 70.2 tt0 -65.14 -39.85 93.61 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.246 -0.582 . . . . 49.71 111.044 175.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 10.8 tp -60.91 -43.98 97.8 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.589 -0.445 . . . . 40.57 111.066 174.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -59.27 -47.14 86.49 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.739 0.304 . . . . 56.74 111.323 -179.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.36 -40.14 77.65 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.452 -0.499 . . . . 35.85 111.533 -177.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 84.8 m -67.11 -38.5 85.73 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.148 -0.621 . . . . 37.21 110.937 178.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -63.31 -36.08 82.49 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.361 -0.536 . . . . 43.09 111.03 174.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.28 -39.05 93.5 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.529 -0.469 . . . . 35.43 111.131 177.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -59.27 -46.15 89.29 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.183 -0.607 . . . . 41.54 111.097 176.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -64.6 -48.69 73.98 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.683 -0.407 . . . . 30.28 111.372 -179.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.79 -40.11 87.18 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.566 -0.454 . . . . 31.44 111.21 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -62.75 -39.93 95.69 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.295 -0.562 . . . . 75.38 111.197 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.75 -41.51 83.26 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.396 -0.521 . . . . 32.72 111.273 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' VAL . . . . . . . . . . . . . 84.3 t -65.45 -36.19 77.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 C-N-CA 120.641 -0.424 . . . . 33.99 110.446 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.12 -34.3 76.09 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.125 -0.63 . . . . 37.24 111.207 171.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' GLY . . . . . . . . . . . . . . . -69.57 -33.14 71.59 Favored Glycine 0 C--N 1.335 0.499 0 C-N-CA 120.221 -0.99 . . . . 36.83 112.873 173.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -63.42 -39.58 94.88 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 117.389 0.594 . . . . 36.07 110.893 172.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 86.6 mtm-85 -65.63 -44.21 87.15 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.841 -0.344 . . . . 38.25 111.338 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' GLU . . . . . 0.426 ' OE1' ' O ' ' B' ' 601' ' ' HOH . 38.9 tp10 -71.05 -34.27 71.08 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 119.232 -0.987 . . . . 76.2 111.444 -178.626 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.28 -30.06 71.27 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.612 -0.835 . . . . 38.22 111.13 172.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' THR . . . . . . . . . . . . . 98.5 m -73.61 -42.26 61.73 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.606 -0.437 . . . . 43.75 111.201 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' ARG . . . . . 0.723 ' NH1' ' O ' ' B' ' 601' ' ' HOH . 77.1 mtt85 -62.85 -36.23 82.58 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.502 -0.479 . . . . 60.18 111.636 178.514 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -87.88 1.51 53.85 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.442 0.534 . . . . 89.78 112.442 175.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 7.1 mtt180 53.47 43.6 31.07 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.567 0.699 . . . . 85.09 111.422 174.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' SER . . . . . . . . . . . . . 7.8 t -110.12 114.5 28.05 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.294 -0.632 . . . . 46.25 109.294 -176.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' LEU . . . . . . . . . . . . . 18.7 mt -68.35 -34.51 76.21 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.38 -0.528 . . . . 48.89 111.623 175.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' GLU . . . . . . . . . . . . . 46.9 tp10 -72.98 -42.46 63.3 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.26 -0.576 . . . . 72.44 111.489 -176.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -62.55 -33.26 74.58 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.29 -0.564 . . . . 80.28 111.529 175.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' TYR . . . . . 0.425 ' OH ' ' OG ' ' B' ' 77' ' ' SER . 5.1 t80 -65.6 -40.01 92.2 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.983 -0.687 . . . . 45.28 111.055 177.09 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -67.65 -30.72 70.35 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.532 -0.467 . . . . 48.47 111.833 -178.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -75.48 -28.67 59.31 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.973 0.416 . . . . 66.85 111.041 -177.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' VAL . . . . . . . . . . . . . 26.1 m -95.54 -9.15 9.35 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 N-CA-C 112.728 0.64 . . . . 51.28 112.728 -174.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -66.85 -36.32 82.07 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 118.318 0.508 . . . . 61.04 111.423 -175.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' SER . . . . . . . . . . . . . 66.2 p -68.37 -34.19 75.62 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.077 -0.649 . . . . 36.47 111.523 177.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 160' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -65.54 -38.15 88.8 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.409 -0.517 . . . . 68.69 111.201 178.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -70.53 -41.63 72.27 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.589 -0.444 . . . . 33.2 111.298 178.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 162' ' ' GLY . . . . . . . . . . . . . . . -66.51 -41.23 94.31 Favored Glycine 0 C--N 1.335 0.474 0 C-N-CA 120.097 -1.049 . . . . 31.42 112.898 -177.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' ASN . . . . . 0.464 ' ND2' ' O ' ' B' ' 609' ' ' HOH . 92.0 m-20 -71.14 -39.16 72.14 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.163 -0.615 . . . . 36.34 111.331 -179.654 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' ALA . . . . . . . . . . . . . . . -64.94 -41.64 95.34 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.129 -0.628 . . . . 29.81 111.238 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 165' ' ' MET . . . . . . . . . . . . . 32.1 tpp -69.43 -33.76 73.43 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.617 -0.433 . . . . 42.64 111.686 179.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . -61.68 -35.18 90.82 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 119.773 -1.203 . . . . 39.84 112.052 172.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 24.7 tpt180 -74.27 -37.16 63.79 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 122.262 -0.552 . . . . 48.79 111.085 176.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 168' ' ' LEU . . . . . . . . . . . . . 79.7 mt -63.81 -33.52 75.85 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.481 -0.488 . . . . 32.77 111.479 177.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 169' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -61.78 -45.17 95.02 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.841 -0.343 . . . . 60.19 111.022 177.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 170' ' ' THR . . . . . . . . . . . . . 69.4 p -73.66 -34.66 65.04 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.118 -0.633 . . . . 51.71 111.248 178.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 1.7 mt -64.62 -41.26 96.3 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.578 -0.449 . . . . 47.61 111.425 178.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 41.8 ttp85 -63.01 -42.26 99.78 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.367 -0.533 . . . . 55.31 111.281 -179.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 173' ' ' GLN . . . . . 0.534 ' NE2' ' OD2' ' A' ' 60' ' ' ASP . 54.9 tp60 -58.55 -48.45 80.85 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.813 -0.355 . . . . 66.87 111.008 177.668 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -63.56 -33.04 74.72 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.448 -0.501 . . . . 77.02 111.541 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 175' ' ' LEU . . . . . . . . . . . . . 10.5 mt -71.28 -34.3 70.54 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.112 -0.635 . . . . 53.52 112.008 -177.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 176' ' ' VAL . . . . . . . . . . . . . 27.3 m -82.16 -21.3 9.91 Favored 'Isoleucine or valine' 0 C--O 1.241 0.652 0 C-N-CA 119.918 -0.713 . . . . 93.24 112.544 -178.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 177' ' ' THR . . . . . . . . . . . . . 11.7 p -74.54 -32.27 62.39 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 119.525 -0.87 . . . . 95.85 111.643 169.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 178' ' ' THR . . . . . . . . . . . . . 3.6 m -75.07 -16.36 60.58 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 120.408 -0.517 . . . . 82.02 111.317 172.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 179' ' ' LEU . . . . . . . . . . . . . 27.1 mt -87.81 14.95 7.69 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 112.794 0.665 . . . . 86.97 112.794 175.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 44.3 m . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 118.161 0.437 . . . . 99.03 111.321 179.185 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 601' ' ' SAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 602' ' ' ACT . . . . . 0.549 ' O ' ' NH2' ' A' ' 143' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 701' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 702' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 703' ' ' HOH . . . . . 0.526 ' O ' ' ND2' ' A' ' 103' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 704' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 705' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 706' ' ' HOH . . . . . 0.406 ' O ' ' N ' ' A' ' 50' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 707' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 708' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 709' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 710' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 711' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 712' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 713' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 714' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 715' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 716' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 717' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 718' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 719' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 720' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 721' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 722' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 723' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 601' ' ' HOH . . . . . 0.723 ' O ' ' NH1' ' B' ' 147' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 606' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 609' ' ' HOH . . . . . 0.464 ' O ' ' ND2' ' B' ' 163' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 612' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 613' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 614' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 615' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 616' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 622' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 624' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 627' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 628' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 629' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 631' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 50' ' ' THR . . . . . 0.406 ' N ' ' O ' ' A' ' 706' ' ' HOH . 14.5 t . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.737 0.303 . . . . 97.0 110.988 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -61.45 -21.05 63.8 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.383 -0.527 . . . . 107.98999999999999 111.434 170.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.9 tp -62.35 -52.21 64.56 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 120.862 0.363 . . . . 88.189999999999998 111.007 173.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.83 -27.47 68.79 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 119.507 -0.877 . . . . 95.200000000000003 112.687 179.544 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLN . . . . . 0.48 HE22 ' HB3' ' A' ' 115' ' ' ASN . 5.5 tm0? -76.29 -28.0 56.82 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.458 0.572 . . . . 97.219999999999999 112.077 175.039 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 68.3 p -69.9 -27.34 64.71 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.85 -0.74 . . . . 65.560000000000002 111.154 172.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.81 -36.42 64.97 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 121.036 -0.266 . . . . 66.829999999999998 111.462 177.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 51.9 m170 -66.77 -38.34 86.37 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.271 -0.572 . . . . 87.189999999999998 111.024 175.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -64.1 -36.1 82.93 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.44 -0.504 . . . . 49.149999999999999 111.258 175.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.9 -34.59 66.75 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 112.739 0.644 . . . . 57.75 112.739 -175.153 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . 0.5 ' OD2' ' NE2' ' B' ' 173' ' ' GLN . 0.7 OUTLIER -74.0 -33.87 63.97 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 112.907 0.706 . . . . 64.939999999999998 112.907 177.478 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 69.0 mtt85 -61.61 -39.46 91.32 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 118.703 -1.199 . . . . 54.780000000000001 109.745 156.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mt -64.34 -52.46 58.32 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.362 -0.381 . . . . 55.630000000000003 111.311 178.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -64.94 -39.19 93.12 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.684 -0.406 . . . . 36.299999999999997 111.487 -175.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 44.3 m-20 -68.24 -37.81 81.19 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.049 -0.66 . . . . 44.18 111.313 177.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.11 -45.44 85.13 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.554 -0.459 . . . . 33.299999999999997 111.165 -177.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . 0.471 ' O ' HG13 ' A' ' 70' ' ' ILE . 9.8 tp -71.51 -38.54 71.11 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 119.263 -0.975 . . . . 44.990000000000002 111.219 -178.332 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 35.6 tp -57.32 -49.83 74.88 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 119.567 -0.853 . . . . 44.359999999999999 110.887 178.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 59.0 mtm -70.75 -32.45 69.61 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 119.505 -0.878 . . . . 40.710000000000001 111.73 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.99 -41.58 96.75 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.06 -0.656 . . . . 27.879999999999999 111.271 176.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 66' ' ' LEU . 32.8 mt -73.13 -37.72 53.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 120.068 -0.653 . . . . 34.93 110.553 178.442 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 66.8 mtp180 -59.51 -31.02 68.99 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.147 -0.621 . . . . 30.640000000000001 111.56 176.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.3 t -67.76 -42.66 81.4 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.615 -0.434 . . . . 36.700000000000003 111.125 179.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.65 -36.82 83.47 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.453 -0.499 . . . . 50.969999999999999 110.882 175.714 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.19 -30.04 70.17 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.384 -0.526 . . . . 32.68 111.435 175.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -79.93 -35.88 37.14 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.483 -0.487 . . . . 31.239999999999998 112.016 -177.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.6 p -67.31 -47.64 80.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 C-N-CA 119.616 -0.834 . . . . 33.700000000000003 110.776 -178.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 62.1 p -65.14 -47.82 75.73 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 121.672 -0.643 . . . . 50.530000000000001 110.894 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SER . . . . . 0.428 ' HB2' HD21 ' B' ' 158' ' ' ASN . 93.2 p -66.1 -33.34 75.56 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.021 -0.672 . . . . 41.740000000000002 111.651 175.519 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -68.84 -36.39 81.94 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.116 -1.04 . . . . 35.490000000000002 112.589 175.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -59.64 -40.23 87.0 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 122.266 -0.55 . . . . 51.310000000000002 110.995 174.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 17.3 mt -68.32 -42.92 84.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 CA-C-O 120.825 0.345 . . . . 40.359999999999999 110.688 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -61.14 -34.95 75.81 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.462 -0.495 . . . . 47.630000000000003 111.141 177.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLN . . . . . 0.521 ' NE2' ' O ' ' A' ' 146' ' ' THR . 1.0 OUTLIER -63.07 -45.71 90.86 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.967 -0.693 . . . . 50.140000000000001 111.168 177.898 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 61.3 mt -66.8 -24.76 66.22 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.243 0.46 . . . . 56.5 112.243 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.71 2.56 78.74 Favored Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 114.664 0.626 . . . . 42.729999999999997 114.664 171.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.41 14.35 74.12 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 115.093 0.797 . . . . 43.770000000000003 115.093 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -96.65 74.47 2.75 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 122.502 1.144 . . . . 39.979999999999997 109.368 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -64.87 -42.14 95.1 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 114.517 -1.219 . . . . 87.180000000000007 111.583 -174.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.6 mp0 -63.82 -49.06 74.35 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.562 -0.455 . . . . 71.400000000000006 111.083 -178.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 8.3 t -62.07 -37.11 83.77 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.13 -0.628 . . . . 46.780000000000001 111.157 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.76 -38.24 86.22 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.423 -0.511 . . . . 33.140000000000001 111.259 179.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -63.85 -36.1 92.86 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.064 -1.065 . . . . 34.060000000000002 112.636 177.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 63.2 mttt -68.88 -36.24 77.84 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 122.251 -0.558 . . . . 75.049999999999997 111.396 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 3.7 mtt-85 -70.22 -35.49 73.91 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.106 -0.638 . . . . 40.329999999999998 111.082 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 38.1 mmt -59.8 -45.14 93.24 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.305 -0.558 . . . . 43.210000000000001 110.862 172.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.63 92.56 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.412 -0.515 . . . . 30.390000000000001 111.161 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 26.5 tp -64.74 -37.63 88.24 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.058 -0.657 . . . . 35.299999999999997 111.156 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 13.2 t -62.76 -41.99 99.48 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.33 -0.548 . . . . 34.329999999999998 111.31 175.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 74.6 t -58.95 -50.78 78.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-O 121.207 0.527 . . . . 36.920000000000002 110.177 175.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -63.05 -38.16 90.07 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 116.445 -0.343 . . . . 69.939999999999998 111.696 -175.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 59.3 mt -69.74 -43.59 71.99 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.068 -0.653 . . . . 32.200000000000003 111.443 -177.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -68.23 -33.0 73.6 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.226 -0.59 . . . . 46.740000000000002 111.695 179.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -68.7 -43.61 75.71 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.4 -0.52 . . . . 45.039999999999999 111.049 175.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 71.4 mttt -61.42 -40.95 96.28 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.371 -0.531 . . . . 65.400000000000006 111.049 175.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 5.8 t -67.21 -39.94 86.36 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.818 -0.753 . . . . 50.68 111.352 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLN . . . . . 0.449 ' HB2' ' HE2' ' A' ' 132' ' ' PHE . 1.6 tt0 -70.51 -31.27 68.3 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.121 -0.631 . . . . 81.079999999999998 111.274 -179.27 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -66.16 -42.15 89.36 Favored 'General case' 0 CA--C 1.518 -0.278 0 O-C-N 122.119 -0.363 . . . . 50.280000000000001 111.077 175.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 92.2 mt -65.07 -41.25 95.27 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.627 -0.429 . . . . 47.670000000000002 111.117 175.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 32.5 t -59.62 -44.43 93.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-O 121.004 0.43 . . . . 53.18 110.477 177.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ASP . . . . . 0.549 ' O ' ' HG2' ' A' ' 114' ' ' GLU . 63.7 m-20 -66.78 -40.23 88.11 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.043 -0.663 . . . . 90.239999999999995 111.164 179.537 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -58.59 -35.11 71.9 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.051 -0.659 . . . . 58.439999999999998 111.297 172.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -65.52 -45.09 84.83 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.778 -0.369 . . . . 56.979999999999997 111.291 179.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 27.1 t -75.05 -21.96 16.8 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 C-N-CA 120.09 -0.644 . . . . 84.0 111.717 -177.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' A' ' 110' ' ' ASP . 43.0 mm-40 -66.42 -41.25 89.51 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.431 -0.908 . . . . 83.120000000000005 111.06 174.086 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ASN . . . . . 0.48 ' HB3' HE22 ' A' ' 54' ' ' GLN . 70.5 m-80 -90.69 -1.36 57.87 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 113.183 0.808 . . . . 83.659999999999997 113.183 -175.299 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -92.96 95.22 9.35 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 107.458 -1.312 . . . . 86.109999999999999 107.458 175.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ARG . . . . . 0.4 ' HA ' ' HD2' ' A' ' 117' ' ' ARG . 0.1 OUTLIER -102.37 -36.72 8.34 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 113.28 0.845 . . . . 122.2 113.28 -178.913 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.87 126.75 86.25 Favored Pre-proline 0 C--O 1.237 0.421 0 N-CA-C 109.294 -0.632 . . . . 107.56 109.294 -179.674 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -66.43 -18.62 55.07 Favored 'Trans proline' 0 C--O 1.237 0.449 0 N-CA-C 114.505 0.925 . . . . 99.049999999999997 114.505 -171.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.94 -14.23 52.09 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.024 0.829 . . . . 114.37 111.613 170.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.3 tp -112.92 -28.56 7.68 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 124.439 1.096 . . . . 99.629999999999995 113.558 -176.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 44.4 ttt85 -67.72 -32.37 72.95 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.148 -0.621 . . . . 99.090000000000003 112.17 -173.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -62.28 -39.48 97.77 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 119.787 -1.197 . . . . 81.0 113.079 -178.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 12.4 mt -82.06 -23.09 36.02 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 122.23 -0.571 . . . . 71.329999999999998 112.406 176.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.68 -49.45 58.88 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.694 -0.402 . . . . 76.019999999999996 111.402 -173.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 14.7 t -74.33 -24.59 59.22 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 119.54 -0.864 . . . . 95.819999999999993 112.566 -176.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 -63.65 -36.84 85.15 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 118.858 -1.137 . . . . 76.620000000000005 110.965 170.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 7.8 tp -66.08 -36.91 84.46 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.367 -0.533 . . . . 53.030000000000001 111.039 174.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLN . . . . . 0.437 ' NE2' ' OD1' ' A' ' 110' ' ' ASP . 34.3 tt0 -69.61 -46.61 65.86 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.741 -0.384 . . . . 69.170000000000002 111.111 178.763 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.55 -41.96 98.4 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.466 -0.494 . . . . 61.460000000000001 111.189 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 68.4 m -64.32 -35.35 80.57 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.339 -0.544 . . . . 64.120000000000005 111.011 177.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' PHE . . . . . 0.449 ' HE2' ' HB2' ' A' ' 106' ' ' GLN . 69.1 t80 -71.33 -40.85 70.49 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 119.263 -0.975 . . . . 62.07 111.553 -177.719 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -57.15 -34.22 68.2 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.932 -0.707 . . . . 68.689999999999998 111.074 175.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -67.66 -41.29 83.99 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.514 0.197 . . . . 99.140000000000001 111.174 173.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -66.99 -38.57 86.26 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.676 -0.41 . . . . 47.520000000000003 111.385 178.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -65.33 -41.09 94.3 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.574 -0.451 . . . . 50.0 111.463 -177.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -68.0 -30.79 70.13 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.284 -0.566 . . . . 67.650000000000006 111.613 -179.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.0 -40.03 68.82 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.224 -0.59 . . . . 46.039999999999999 111.162 179.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' VAL . . . . . 0.41 ' HA ' HE21 ' A' ' 142' ' ' GLN . 97.0 t -66.8 -39.59 83.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 C-N-CA 120.466 -0.494 . . . . 41.549999999999997 110.37 176.115 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.43 -33.42 72.5 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.347 -0.541 . . . . 42.030000000000001 111.352 172.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -69.9 -34.2 71.18 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.105 -1.045 . . . . 51.420000000000002 112.43 174.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' GLN . . . . . 0.457 ' OE1' ' ND2' ' A' ' 158' ' ' ASN . 26.0 mt-30 -65.63 -32.85 74.65 Favored 'General case' 0 C--O 1.238 0.457 0 O-C-N 122.237 -0.567 . . . . 59.0 111.427 173.939 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ARG . . . . . 0.414 ' NH2' ' O ' ' A' ' 602' ' ' ACT . 89.4 mtm-85 -71.74 -40.78 69.16 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.372 -0.531 . . . . 41.740000000000002 111.315 -179.634 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -68.46 -29.84 68.56 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 119.385 -0.926 . . . . 67.810000000000002 111.495 179.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -70.23 -33.79 72.08 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.884 -0.727 . . . . 53.590000000000003 110.791 172.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' THR . . . . . 0.521 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 93.2 m -64.52 -48.41 75.23 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.82 0.343 . . . . 51.340000000000003 110.875 175.951 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 76.2 mtt85 -63.58 -28.89 70.24 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.524 -0.47 . . . . 64.480000000000004 111.481 178.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -87.93 -9.05 54.79 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.161 0.801 . . . . 95.239999999999995 113.161 177.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 73.7 mtt-85 57.28 44.02 22.62 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.143 0.577 . . . . 88.480000000000004 111.669 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' SER . . . . . 0.489 ' OG ' ' HG3' ' A' ' 153' ' ' GLN . 1.4 t -120.52 114.36 21.65 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 109.324 -0.621 . . . . 77.75 109.324 -179.683 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 5.5 mt -63.21 -28.12 69.82 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.797 -0.638 . . . . 66.319999999999993 110.768 170.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -58.58 -58.3 9.15 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 121.056 -0.258 . . . . 103.14 110.961 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' GLN . . . . . 0.489 ' HG3' ' OG ' ' A' ' 150' ' ' SER . 6.4 mt-30 -65.1 -27.11 68.54 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.896 -0.322 . . . . 98.319999999999993 111.71 -179.088 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -67.56 -49.4 63.38 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.271 -0.572 . . . . 60.719999999999999 111.132 -178.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -65.78 -22.95 66.61 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.551 -0.46 . . . . 74.569999999999993 111.873 175.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -63.9 -37.87 89.01 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.179 -0.608 . . . . 102.15000000000001 111.385 -177.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' VAL . . . . . . . . . . . . . 14.5 m -115.37 -1.17 9.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 113.051 0.76 . . . . 77.620000000000005 113.051 -175.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' ASN . . . . . 0.457 ' ND2' ' OE1' ' A' ' 142' ' ' GLN . 20.1 t-20 -72.85 -27.21 61.79 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 119.511 -0.876 . . . . 95.189999999999998 111.549 178.109 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 3.3 p -71.97 -36.96 69.97 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.035 -0.666 . . . . 81.099999999999994 110.87 173.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -60.73 -43.72 97.53 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.667 -0.413 . . . . 91.299999999999997 111.157 176.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -64.7 -39.76 94.21 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.506 -0.477 . . . . 47.810000000000002 111.248 -178.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . -66.97 -38.78 93.04 Favored Glycine 0 C--N 1.335 0.487 0 C-N-CA 120.067 -1.063 . . . . 52.189999999999998 112.864 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -65.8 -47.33 75.45 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 122.251 -0.558 . . . . 60.920000000000002 111.033 178.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' ALA . . . . . . . . . . . . . . . -65.21 -31.95 73.37 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.553 -0.459 . . . . 49.520000000000003 111.549 179.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 34.5 tpp -72.16 -34.98 68.89 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.25 -0.58 . . . . 55.630000000000003 111.524 177.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -63.7 -39.56 97.64 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 119.921 -1.133 . . . . 48.219999999999999 112.491 175.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 39.0 mtm105 -74.3 -30.62 62.15 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 122.171 -0.605 . . . . 78.980000000000004 111.607 177.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 17.8 mt -64.43 -38.84 92.43 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.473 -0.491 . . . . 45.82 111.278 176.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -71.0 -37.23 72.68 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.44 -0.504 . . . . 61.840000000000003 111.421 -177.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' THR . . . . . . . . . . . . . 58.0 m -69.27 -39.4 78.42 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.246 -0.582 . . . . 55.32 110.727 176.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' LEU . . . . . . . . . . . . . 9.5 mt -63.75 -36.72 84.79 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.571 -0.452 . . . . 54.920000000000002 111.333 177.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' ARG . . . . . . . . . . . . . 37.3 ttt-85 -63.95 -44.32 93.16 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 119.79 -0.764 . . . . 45.969999999999999 110.951 175.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -57.18 -48.93 77.52 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.751 0.31 . . . . 63.0 111.288 179.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -63.28 -37.34 86.87 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.499 -0.48 . . . . 56.009999999999998 111.266 178.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 18.2 mt -71.58 -40.15 70.11 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.695 -0.402 . . . . 41.880000000000003 111.418 -179.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 78.5 t -63.5 -40.58 89.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 120.607 -0.437 . . . . 46.270000000000003 110.575 178.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' THR . . . . . . . . . . . . . 91.4 m -64.36 -41.63 96.63 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.42 -0.512 . . . . 46.049999999999997 111.142 177.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 55.7 m -65.44 -41.4 93.53 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.732 -0.387 . . . . 53.119999999999997 111.338 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 28.2 mt -66.38 -43.97 84.44 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.398 -0.521 . . . . 40.460000000000001 111.137 177.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 33.1 t -61.69 -34.22 75.38 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.946 -0.302 . . . . 51.859999999999999 111.601 176.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 69.8 tt0 -69.64 -39.59 77.04 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.548 -0.461 . . . . 59.390000000000001 111.228 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 24.4 tpt180 -67.08 -44.7 79.41 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.264 -0.574 . . . . 80.930000000000007 111.146 178.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -60.41 -43.67 98.45 Favored Glycine 0 C--N 1.334 0.428 0 C-N-CA 120.092 -1.051 . . . . 45.5 112.688 177.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 184' ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -65.53 -33.54 76.16 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.065 -0.654 . . . . 71.200000000000003 111.456 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -59.81 -27.63 66.76 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 120.571 -0.452 . . . . 79.120000000000005 111.79 178.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 59.6 mt -74.78 -35.95 38.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 120.867 0.365 . . . . 79.049999999999997 110.874 -178.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 187' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.79 -32.9 74.8 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 113.097 0.777 . . . . 88.620000000000005 113.097 -177.904 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 118.297 0.498 . . . . 91.989999999999995 111.696 175.754 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.894 0.378 . . . . 74.489999999999995 110.939 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.24 -40.39 67.75 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.191 -0.603 . . . . 54.829999999999998 110.826 174.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' HIS . . . . . . . . . . . . . 33.0 m80 -67.35 -33.7 75.77 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.43 -0.508 . . . . 66.939999999999998 111.551 176.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -68.67 -41.07 79.77 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.21 -0.596 . . . . 44.100000000000001 111.364 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 1.4 m -66.9 -37.74 84.95 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.281 -0.567 . . . . 58.840000000000003 111.374 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -65.54 -43.23 90.57 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.26 -0.576 . . . . 64.150000000000006 111.143 176.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 64.2 mtt85 -58.53 -46.34 87.0 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.653 -0.419 . . . . 41.229999999999997 111.013 175.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 32.0 tp -67.22 -46.27 74.32 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.874 -0.33 . . . . 34.409999999999997 111.336 -176.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -69.92 -41.33 74.79 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.947 -0.701 . . . . 39.549999999999997 111.505 -176.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -68.35 -36.99 80.06 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 119.906 -0.718 . . . . 41.229999999999997 111.281 178.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.45 -40.49 91.33 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.213 -0.595 . . . . 29.02 111.257 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' LEU . . . . . 0.497 HD12 ' HD3' ' B' ' 172' ' ' ARG . 6.9 mt -74.53 -43.33 56.31 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.189 -0.604 . . . . 38.420000000000002 111.8 -177.157 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 83.1 mt -61.95 -38.47 88.59 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.285 -0.566 . . . . 39.369999999999997 111.226 178.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' MET . . . . . . . . . . . . . 59.5 mtm -77.77 -22.6 49.94 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.813 -0.755 . . . . 43.890000000000001 111.484 178.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -74.35 -39.82 62.53 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 120.028 -0.669 . . . . 26.719999999999999 111.089 -179.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' ILE . . . . . . . . . . . . . 6.9 tp -69.95 -40.97 79.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 120.434 -0.506 . . . . 31.960000000000001 110.868 179.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 56.9 mtp180 -63.0 -31.65 72.84 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 121.654 -0.654 . . . . 42.609999999999999 111.191 174.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 15.2 t -63.7 -33.7 76.23 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.382 -0.527 . . . . 26.649999999999999 110.919 174.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 22.9 t -76.9 -47.23 21.69 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 120.88 -0.328 . . . . 28.050000000000001 111.48 178.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.29 -28.4 62.99 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 119.986 -0.685 . . . . 30.170000000000002 111.64 179.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -78.51 -38.74 40.01 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 120.624 -0.43 . . . . 32.270000000000003 112.123 -177.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' VAL . . . . . . . . . . . . . 14.6 p -56.6 -53.82 36.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 C-N-CA 118.791 -1.164 . . . . 27.420000000000002 110.941 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 66.7 m -60.0 -43.71 95.01 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.591 -0.693 . . . . 31.84 110.869 173.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.2 m -56.91 -45.81 82.4 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.628 -0.429 . . . . 60.82 110.614 171.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.45 -41.09 99.8 Favored Glycine 0 C--N 1.335 0.495 0 C-N-CA 120.264 -0.969 . . . . 35.350000000000001 113.028 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -59.82 -43.17 94.67 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 122.241 -0.564 . . . . 42.329999999999998 110.916 177.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 91.7 mt -65.49 -35.56 75.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 C-N-CA 120.809 -0.356 . . . . 41.310000000000002 110.708 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -66.58 -33.59 76.01 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.545 -0.722 . . . . 50.630000000000003 111.723 177.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -64.31 -37.88 89.05 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.243 -0.583 . . . . 59.359999999999999 110.928 174.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 30.0 mt -66.45 -29.8 70.02 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.863 -0.335 . . . . 44.990000000000002 111.568 178.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -90.9 6.65 81.83 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 115.255 0.862 . . . . 47.909999999999997 115.255 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.8 8.0 86.52 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 118.411 1.106 . . . . 51.560000000000002 115.433 179.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -89.71 71.08 7.78 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 122.678 1.228 . . . . 66.200000000000003 109.254 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -70.59 -40.22 73.36 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.517 -1.219 . . . . 77.609999999999999 111.716 -172.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -69.28 -40.25 77.86 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.465 -0.494 . . . . 73.310000000000002 110.999 176.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 33.3 t -69.52 -29.11 66.65 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.658 -0.417 . . . . 51.280000000000001 111.679 179.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' ALA . . . . . 0.432 ' O ' ' HG2' ' B' ' 95' ' ' MET . . . -68.8 -39.04 80.32 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.221 -0.591 . . . . 40.100000000000001 111.227 178.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . -61.29 -33.37 84.19 Favored Glycine 0 C--N 1.336 0.528 0 C-N-CA 120.271 -0.966 . . . . 44.18 112.856 176.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt -71.47 -36.15 71.08 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.763 -0.375 . . . . 55.759999999999998 110.811 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' ARG . . . . . . . . . . . . . 11.2 mmt180 -65.37 -39.2 92.0 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.711 -0.395 . . . . 68.060000000000002 111.162 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' MET . . . . . 0.432 ' HG2' ' O ' ' B' ' 91' ' ' ALA . 26.9 tpp -64.6 -43.05 95.02 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.746 -0.381 . . . . 43.899999999999999 111.323 179.786 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.85 -41.92 95.31 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.544 -0.462 . . . . 36.640000000000001 111.344 -179.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 35.0 tp -64.2 -34.78 78.87 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.376 -0.529 . . . . 45.380000000000003 111.101 177.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' SER . . . . . . . . . . . . . 11.7 t -66.48 -39.15 88.62 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.299 -0.56 . . . . 34.380000000000003 111.433 177.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' VAL . . . . . . . . . . . . . 56.6 t -61.53 -46.76 95.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.264 0.554 . . . . 32.32 110.131 175.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -65.5 -44.26 87.59 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 122.059 -0.401 . . . . 79.549999999999997 111.569 -176.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 57.7 mt -62.29 -34.26 76.24 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.265 -0.574 . . . . 34.57 111.445 177.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 27.5 t30 -68.85 -44.05 74.16 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.371 -0.532 . . . . 50.840000000000003 111.209 177.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -62.35 -41.78 98.86 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.397 -0.521 . . . . 46.960000000000001 111.172 178.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -70.69 -40.29 72.97 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.385 -0.526 . . . . 59.289999999999999 111.428 -178.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 21.9 p -70.2 -36.62 74.72 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.966 -0.694 . . . . 42.57 111.224 -179.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -60.66 -39.9 90.06 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.499 -0.48 . . . . 49.619999999999997 111.156 174.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.96 -39.25 93.2 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.473 -0.491 . . . . 33.0 111.321 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 23.2 mt -66.9 -42.02 86.16 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.22 -0.592 . . . . 35.390000000000001 111.36 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 55.5 t -59.37 -39.13 78.25 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 120.609 -0.436 . . . . 36.950000000000003 110.411 177.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' ASP . . . . . 0.509 ' O ' ' HG3' ' B' ' 114' ' ' GLU . 77.9 m-20 -67.34 -45.26 76.93 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.215 -0.594 . . . . 66.730000000000004 111.267 -179.903 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -57.04 -42.55 80.7 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.62 -0.432 . . . . 83.079999999999998 111.291 174.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -61.37 -47.38 86.12 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.936 -0.306 . . . . 37.619999999999997 111.17 -177.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 75.0 t -65.32 -37.12 79.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 CA-C-O 120.836 0.351 . . . . 61.75 110.756 -176.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' B' ' 110' ' ' ASP . 16.1 tt0 -71.87 -23.23 61.48 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 121.845 -0.534 . . . . 69.200000000000003 111.661 179.248 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 115' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -99.32 4.73 46.54 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 112.94 0.718 . . . . 54.299999999999997 112.94 -177.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -105.46 92.05 4.03 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.325 -1.361 . . . . 75.439999999999998 107.325 177.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' ARG . . . . . 0.431 ' HD3' ' O ' ' B' ' 114' ' ' GLU . 16.9 mmm180 -109.63 -36.45 5.95 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 113.963 1.097 . . . . 90.469999999999999 113.963 -175.468 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 118' ' ' GLU . . . . . 0.469 ' HG3' ' H ' ' B' ' 120' ' ' ALA . 7.3 pm0 -51.78 123.49 24.72 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.577 -0.527 . . . . 81.730000000000004 109.577 175.419 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.99 -18.31 16.54 Favored 'Trans proline' 0 N--CA 1.477 0.553 0 N-CA-C 115.368 1.257 . . . . 91.939999999999998 115.368 -173.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' ALA . . . . . 0.469 ' H ' ' HG3' ' B' ' 118' ' ' GLU . . . -66.56 -21.01 66.15 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 118.437 0.562 . . . . 78.609999999999999 112.027 172.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 mt -113.24 -13.42 12.96 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 114.342 1.238 . . . . 79.640000000000001 114.342 -178.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' ARG . . . . . . . . . . . . . 7.6 ttp180 -63.68 -44.57 93.34 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.446 0.567 . . . . 105.47 111.647 -170.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -71.21 -38.22 63.23 Favored Glycine 0 C--N 1.335 0.492 0 C-N-CA 119.924 -1.132 . . . . 51.009999999999998 112.669 179.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' B' ' 124' ' ' LEU . 3.1 tp -69.15 -35.7 76.64 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 122.228 -0.572 . . . . 56.719999999999999 111.323 178.908 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -66.2 -40.25 90.26 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.274 -0.57 . . . . 41.350000000000001 111.201 177.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' THR . . . . . . . . . . . . . 85.1 m -67.81 -35.93 79.5 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.288 -0.565 . . . . 48.649999999999999 111.136 178.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' GLU . . . . . 0.482 ' HG2' HD11 ' B' ' 171' ' ' LEU . 70.2 tt0 -65.14 -39.85 93.61 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.246 -0.582 . . . . 49.710000000000001 111.044 175.865 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 10.8 tp -60.91 -43.98 97.8 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.589 -0.445 . . . . 40.57 111.066 174.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -59.27 -47.14 86.49 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.739 0.304 . . . . 56.740000000000002 111.323 -179.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.36 -40.14 77.65 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.452 -0.499 . . . . 35.850000000000001 111.533 -177.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 84.8 m -67.11 -38.5 85.73 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.148 -0.621 . . . . 37.210000000000001 110.937 178.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -63.31 -36.08 82.49 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.361 -0.536 . . . . 43.090000000000003 111.03 174.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.28 -39.05 93.5 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.529 -0.469 . . . . 35.43 111.131 177.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -59.27 -46.15 89.29 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.183 -0.607 . . . . 41.539999999999999 111.097 176.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 135' ' ' TYR . . . . . 0.401 ' CE1' ' HB2' ' B' ' 165' ' ' MET . 76.5 t80 -64.6 -48.69 73.98 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.683 -0.407 . . . . 30.280000000000001 111.372 -179.955 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.79 -40.11 87.18 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.566 -0.454 . . . . 31.440000000000001 111.21 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -62.75 -39.93 95.69 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.295 -0.562 . . . . 75.379999999999995 111.197 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.75 -41.51 83.26 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.396 -0.521 . . . . 32.719999999999999 111.273 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' VAL . . . . . . . . . . . . . 84.3 t -65.45 -36.19 77.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 C-N-CA 120.641 -0.424 . . . . 33.990000000000002 110.446 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.12 -34.3 76.09 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.125 -0.63 . . . . 37.240000000000002 111.207 171.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' GLY . . . . . . . . . . . . . . . -69.57 -33.14 71.59 Favored Glycine 0 C--N 1.335 0.499 0 C-N-CA 120.221 -0.99 . . . . 36.829999999999998 112.873 173.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -63.42 -39.58 94.88 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 117.389 0.594 . . . . 36.07 110.893 172.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 86.6 mtm-85 -65.63 -44.21 87.15 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.841 -0.344 . . . . 38.25 111.338 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' GLU . . . . . 0.426 ' OE1' ' O ' ' B' ' 601' ' ' HOH . 38.9 tp10 -71.05 -34.27 71.08 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 119.232 -0.987 . . . . 76.200000000000003 111.444 -178.626 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.28 -30.06 71.27 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.612 -0.835 . . . . 38.219999999999999 111.13 172.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' THR . . . . . . . . . . . . . 98.5 m -73.61 -42.26 61.73 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.606 -0.437 . . . . 43.75 111.201 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 147' ' ' ARG . . . . . 0.723 ' NH1' ' O ' ' B' ' 601' ' ' HOH . 77.1 mtt85 -62.85 -36.23 82.58 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.502 -0.479 . . . . 60.270000000000003 111.636 178.514 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 148' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -87.88 1.51 53.85 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.442 0.534 . . . . 89.780000000000001 112.442 175.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 7.1 mtt180 53.47 43.6 31.07 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.567 0.699 . . . . 85.090000000000003 111.422 174.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 150' ' ' SER . . . . . . . . . . . . . 7.8 t -110.12 114.5 28.05 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.294 -0.632 . . . . 46.25 109.294 -176.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 151' ' ' LEU . . . . . . . . . . . . . 18.7 mt -68.35 -34.51 76.21 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.38 -0.528 . . . . 48.890000000000001 111.623 175.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 152' ' ' GLU . . . . . 0.451 ' HG3' ' HE2' ' B' ' 156' ' ' LYS . 46.9 tp10 -72.98 -42.46 63.3 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.26 -0.576 . . . . 72.439999999999998 111.489 -176.492 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 153' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -62.55 -33.26 74.58 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.29 -0.564 . . . . 80.280000000000001 111.529 175.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 154' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -65.6 -40.01 92.2 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.983 -0.687 . . . . 45.280000000000001 111.055 177.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 155' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -67.65 -30.72 70.35 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.532 -0.467 . . . . 48.469999999999999 111.833 -178.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 156' ' ' LYS . . . . . 0.451 ' HE2' ' HG3' ' B' ' 152' ' ' GLU . 71.4 mmtt -75.48 -28.67 59.31 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.973 0.416 . . . . 66.849999999999994 111.041 -177.891 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 157' ' ' VAL . . . . . . . . . . . . . 26.1 m -95.54 -9.15 9.35 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 N-CA-C 112.728 0.64 . . . . 51.280000000000001 112.728 -174.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 158' ' ' ASN . . . . . 0.428 HD21 ' HB2' ' A' ' 78' ' ' SER . 4.4 t30 -66.85 -36.32 82.07 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 118.318 0.508 . . . . 61.039999999999999 111.423 -175.809 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 159' ' ' SER . . . . . . . . . . . . . 66.2 p -68.37 -34.19 75.62 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.077 -0.649 . . . . 36.469999999999999 111.523 177.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 160' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -65.54 -38.15 88.8 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.409 -0.517 . . . . 68.689999999999998 111.201 178.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -70.53 -41.63 72.27 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.589 -0.444 . . . . 33.200000000000003 111.298 178.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 162' ' ' GLY . . . . . . . . . . . . . . . -66.51 -41.23 94.31 Favored Glycine 0 C--N 1.335 0.474 0 C-N-CA 120.097 -1.049 . . . . 31.420000000000002 112.898 -177.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -71.14 -39.16 72.14 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.163 -0.615 . . . . 36.340000000000003 111.331 -179.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 164' ' ' ALA . . . . . . . . . . . . . . . -64.94 -41.64 95.34 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.129 -0.628 . . . . 29.809999999999999 111.238 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 165' ' ' MET . . . . . 0.401 ' HB2' ' CE1' ' B' ' 135' ' ' TYR . 32.1 tpp -69.43 -33.76 73.43 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.617 -0.433 . . . . 42.640000000000001 111.686 179.492 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . -61.68 -35.18 90.82 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 119.773 -1.203 . . . . 39.840000000000003 112.052 172.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 24.7 tpt180 -74.27 -37.16 63.79 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 122.262 -0.552 . . . . 48.789999999999999 111.085 176.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 168' ' ' LEU . . . . . . . . . . . . . 79.7 mt -63.81 -33.52 75.85 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.481 -0.488 . . . . 32.770000000000003 111.479 177.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 169' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -61.78 -45.17 95.02 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.841 -0.343 . . . . 60.189999999999998 111.022 177.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 170' ' ' THR . . . . . . . . . . . . . 69.4 p -73.66 -34.66 65.04 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.118 -0.633 . . . . 51.710000000000001 111.248 178.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 171' ' ' LEU . . . . . 0.482 HD11 ' HG2' ' B' ' 127' ' ' GLU . 1.7 mt -64.62 -41.26 96.3 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.578 -0.449 . . . . 47.609999999999999 111.425 178.923 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 172' ' ' ARG . . . . . 0.497 ' HD3' HD12 ' B' ' 66' ' ' LEU . 41.8 ttp85 -63.01 -42.26 99.78 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.367 -0.533 . . . . 55.310000000000002 111.281 -179.891 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 173' ' ' GLN . . . . . 0.5 ' NE2' ' OD2' ' A' ' 60' ' ' ASP . 54.9 tp60 -58.55 -48.45 80.85 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.813 -0.355 . . . . 66.870000000000005 111.008 177.668 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -63.56 -33.04 74.72 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.448 -0.501 . . . . 77.019999999999996 111.541 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 175' ' ' LEU . . . . . . . . . . . . . 10.5 mt -71.28 -34.3 70.54 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.112 -0.635 . . . . 53.520000000000003 112.008 -177.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 176' ' ' VAL . . . . . . . . . . . . . 27.3 m -82.16 -21.3 9.91 Favored 'Isoleucine or valine' 0 C--O 1.241 0.652 0 C-N-CA 119.918 -0.713 . . . . 93.239999999999995 112.544 -178.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 177' ' ' THR . . . . . 0.439 HG23 ' O ' ' B' ' 173' ' ' GLN . 11.7 p -74.54 -32.27 62.39 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 119.525 -0.87 . . . . 95.849999999999994 111.643 169.154 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 178' ' ' THR . . . . . . . . . . . . . 3.6 m -75.07 -16.36 60.58 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 120.408 -0.517 . . . . 82.019999999999996 111.317 172.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 179' ' ' LEU . . . . . . . . . . . . . 27.1 mt -87.81 14.95 7.69 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 112.794 0.665 . . . . 86.969999999999999 112.794 175.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 44.3 m . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 118.161 0.437 . . . . 99.030000000000001 111.321 179.185 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 601' ' ' SAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 602' ' ' ACT . . . . . 0.414 ' O ' ' NH2' ' A' ' 143' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 701' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 702' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 703' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 704' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 705' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 706' ' ' HOH . . . . . 0.406 ' O ' ' N ' ' A' ' 50' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 707' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 708' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 709' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 710' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 711' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 712' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 713' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 714' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 715' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 716' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 717' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 718' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 719' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 720' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 721' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 722' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 723' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 601' ' ' HOH . . . . . 0.723 ' O ' ' NH1' ' B' ' 147' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 606' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 612' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 613' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 614' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 615' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 616' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 622' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 624' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 627' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 628' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 629' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 631' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' THR . . . . . 0.406 ' N ' ' O ' ' A' ' 706' ' ' HOH . 14.5 t . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.737 0.303 . . . . 97.0 110.988 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -61.45 -21.05 63.8 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.383 -0.527 . . . . 107.99 111.434 170.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.9 tp -62.35 -52.21 64.56 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 120.862 0.363 . . . . 88.19 111.007 173.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.83 -27.47 68.79 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 119.507 -0.877 . . . . 95.2 112.687 179.544 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.48 HE22 ' HB3' ' A' ' 115' ' ' ASN . 5.5 tm0? -76.29 -28.0 56.82 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.458 0.572 . . . . 97.22 112.077 175.039 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 68.3 p -69.9 -27.34 64.71 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 119.85 -0.74 . . . . 65.56 111.154 172.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.81 -36.42 64.97 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 121.036 -0.266 . . . . 66.83 111.462 177.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' HIS . . . . . . . . . . . . . 51.9 m170 -66.77 -38.34 86.37 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.271 -0.572 . . . . 87.19 111.024 175.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -64.1 -36.1 82.93 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.44 -0.504 . . . . 49.15 111.258 175.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.9 -34.59 66.75 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 112.739 0.644 . . . . 57.75 112.739 -175.153 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.5 ' OD2' ' NE2' ' B' ' 173' ' ' GLN . 0.7 OUTLIER -74.0 -33.87 63.97 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 112.907 0.706 . . . . 64.94 112.907 177.478 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 69.0 mtt85 -61.61 -39.46 91.32 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 118.703 -1.199 . . . . 54.78 109.745 156.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mt -64.34 -52.46 58.32 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.362 -0.381 . . . . 55.63 111.311 178.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -64.94 -39.19 93.12 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.684 -0.406 . . . . 36.3 111.487 -175.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 44.3 m-20 -68.24 -37.81 81.19 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.049 -0.66 . . . . 44.18 111.313 177.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.11 -45.44 85.13 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.554 -0.459 . . . . 33.3 111.165 -177.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.471 ' O ' HG13 ' A' ' 70' ' ' ILE . 9.8 tp -71.51 -38.54 71.11 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 119.263 -0.975 . . . . 44.99 111.219 -178.332 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 35.6 tp -57.32 -49.83 74.88 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 119.567 -0.853 . . . . 44.36 110.887 178.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 59.0 mtm -70.75 -32.45 69.61 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 119.505 -0.878 . . . . 40.71 111.73 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.99 -41.58 96.75 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.06 -0.656 . . . . 27.88 111.271 176.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 66' ' ' LEU . 32.8 mt -73.13 -37.72 53.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 C-N-CA 120.068 -0.653 . . . . 34.93 110.553 178.442 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 66.8 mtp180 -59.51 -31.02 68.99 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.147 -0.621 . . . . 30.64 111.56 176.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.3 t -67.76 -42.66 81.4 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.615 -0.434 . . . . 36.7 111.125 179.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.65 -36.82 83.47 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.453 -0.499 . . . . 50.97 110.882 175.714 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.19 -30.04 70.17 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.384 -0.526 . . . . 32.68 111.435 175.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -79.93 -35.88 37.14 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.483 -0.487 . . . . 31.24 112.016 -177.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.6 p -67.31 -47.64 80.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 C-N-CA 119.616 -0.834 . . . . 33.7 110.776 -178.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 62.1 p -65.14 -47.82 75.73 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 121.672 -0.643 . . . . 50.53 110.894 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SER . . . . . 0.428 ' HB2' HD21 ' B' ' 158' ' ' ASN . 93.2 p -66.1 -33.34 75.56 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.021 -0.672 . . . . 41.74 111.651 175.519 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -68.84 -36.39 81.94 Favored Glycine 0 C--N 1.334 0.465 0 C-N-CA 120.116 -1.04 . . . . 35.49 112.589 175.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -59.64 -40.23 87.0 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 122.266 -0.55 . . . . 51.31 110.995 174.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 17.3 mt -68.32 -42.92 84.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 CA-C-O 120.825 0.345 . . . . 40.36 110.688 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -61.14 -34.95 75.81 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.462 -0.495 . . . . 47.63 111.141 177.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.521 ' NE2' ' O ' ' A' ' 146' ' ' THR . 1.0 OUTLIER -63.07 -45.71 90.86 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.967 -0.693 . . . . 50.14 111.168 177.898 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 61.3 mt -66.8 -24.76 66.22 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.243 0.46 . . . . 56.5 112.243 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.71 2.56 78.74 Favored Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 114.664 0.626 . . . . 42.73 114.664 171.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.41 14.35 74.12 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 115.093 0.797 . . . . 43.77 115.093 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -96.65 74.47 2.75 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 122.502 1.144 . . . . 39.98 109.368 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -64.87 -42.14 95.1 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 114.517 -1.219 . . . . 87.18 111.583 -174.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.6 mp0 -63.82 -49.06 74.35 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.562 -0.455 . . . . 71.4 111.083 -178.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 8.3 t -62.07 -37.11 83.77 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.13 -0.628 . . . . 46.78 111.157 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.76 -38.24 86.22 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.423 -0.511 . . . . 33.14 111.259 179.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -63.85 -36.1 92.86 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.064 -1.065 . . . . 34.06 112.636 177.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 63.2 mttt -68.88 -36.24 77.84 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 122.251 -0.558 . . . . 75.05 111.396 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 3.7 mtt-85 -70.22 -35.49 73.91 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.106 -0.638 . . . . 40.33 111.082 177.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 38.1 mmt -59.8 -45.14 93.24 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.305 -0.558 . . . . 43.21 110.862 172.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.63 92.56 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.412 -0.515 . . . . 30.39 111.161 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 26.5 tp -64.74 -37.63 88.24 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.058 -0.657 . . . . 35.3 111.156 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 13.2 t -62.76 -41.99 99.48 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.33 -0.548 . . . . 34.33 111.31 175.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 74.6 t -58.95 -50.78 78.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-O 121.207 0.527 . . . . 36.92 110.177 175.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -63.05 -38.16 90.07 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 116.445 -0.343 . . . . 69.94 111.696 -175.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 59.3 mt -69.74 -43.59 71.99 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.068 -0.653 . . . . 32.2 111.443 -177.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -68.23 -33.0 73.6 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.226 -0.59 . . . . 46.74 111.695 179.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -68.7 -43.61 75.71 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.4 -0.52 . . . . 45.04 111.049 175.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 71.4 mttt -61.42 -40.95 96.28 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.371 -0.531 . . . . 65.4 111.049 175.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 5.8 t -67.21 -39.94 86.36 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.818 -0.753 . . . . 50.68 111.352 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.449 ' HB2' ' HE2' ' A' ' 132' ' ' PHE . 1.6 tt0 -70.51 -31.27 68.3 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.121 -0.631 . . . . 81.08 111.274 -179.27 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -66.16 -42.15 89.36 Favored 'General case' 0 CA--C 1.518 -0.278 0 O-C-N 122.119 -0.363 . . . . 50.28 111.077 175.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 92.2 mt -65.07 -41.25 95.27 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.627 -0.429 . . . . 47.67 111.117 175.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 32.5 t -59.62 -44.43 93.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-O 121.004 0.43 . . . . 53.18 110.477 177.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.549 ' O ' ' HG2' ' A' ' 114' ' ' GLU . 63.7 m-20 -66.78 -40.23 88.11 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.043 -0.663 . . . . 90.24 111.164 179.537 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -58.59 -35.11 71.9 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.051 -0.659 . . . . 58.44 111.297 172.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -65.52 -45.09 84.83 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.778 -0.369 . . . . 56.98 111.291 179.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 27.1 t -75.05 -21.96 16.8 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 C-N-CA 120.09 -0.644 . . . . 84.0 111.717 -177.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' A' ' 110' ' ' ASP . 43.0 mm-40 -66.42 -41.25 89.51 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.431 -0.908 . . . . 83.12 111.06 174.086 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.48 ' HB3' HE22 ' A' ' 54' ' ' GLN . 70.5 m-80 -90.69 -1.36 57.87 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 113.183 0.808 . . . . 83.66 113.183 -175.299 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -92.96 95.22 9.35 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 107.458 -1.312 . . . . 86.11 107.458 175.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.4 ' HA ' ' HD2' ' A' ' 117' ' ' ARG . 0.1 OUTLIER -102.37 -36.72 8.34 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 113.28 0.845 . . . . 122.2 113.28 -178.913 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.87 126.75 86.25 Favored Pre-proline 0 C--O 1.237 0.421 0 N-CA-C 109.294 -0.632 . . . . 107.56 109.294 -179.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -66.43 -18.62 55.07 Favored 'Trans proline' 0 C--O 1.237 0.449 0 N-CA-C 114.505 0.925 . . . . 99.05 114.505 -171.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.94 -14.23 52.09 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.024 0.829 . . . . 114.37 111.613 170.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.3 tp -112.92 -28.56 7.68 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 124.439 1.096 . . . . 99.63 113.558 -176.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 44.4 ttt85 -67.72 -32.37 72.95 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.148 -0.621 . . . . 99.09 112.17 -173.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -62.28 -39.48 97.77 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 119.787 -1.197 . . . . 81.0 113.079 -178.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 12.4 mt -82.06 -23.09 36.02 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 122.23 -0.571 . . . . 71.33 112.406 176.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.68 -49.45 58.88 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.694 -0.402 . . . . 76.02 111.402 -173.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 14.7 t -74.33 -24.59 59.22 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 119.54 -0.864 . . . . 95.82 112.566 -176.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 -63.65 -36.84 85.15 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 118.858 -1.137 . . . . 76.62 110.965 170.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 7.8 tp -66.08 -36.91 84.46 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.367 -0.533 . . . . 53.03 111.039 174.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.437 ' NE2' ' OD1' ' A' ' 110' ' ' ASP . 34.3 tt0 -69.61 -46.61 65.86 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.741 -0.384 . . . . 69.17 111.111 178.763 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.55 -41.96 98.4 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.466 -0.494 . . . . 61.46 111.189 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 68.4 m -64.32 -35.35 80.57 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.339 -0.544 . . . . 64.12 111.011 177.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' PHE . . . . . 0.449 ' HE2' ' HB2' ' A' ' 106' ' ' GLN . 69.1 t80 -71.33 -40.85 70.49 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 119.263 -0.975 . . . . 62.07 111.553 -177.719 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -57.15 -34.22 68.2 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.932 -0.707 . . . . 68.69 111.074 175.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -67.66 -41.29 83.99 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.514 0.197 . . . . 99.14 111.174 173.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -66.99 -38.57 86.26 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.676 -0.41 . . . . 47.52 111.385 178.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -65.33 -41.09 94.3 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.574 -0.451 . . . . 50.0 111.463 -177.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -68.0 -30.79 70.13 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.284 -0.566 . . . . 67.65 111.613 -179.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.0 -40.03 68.82 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.224 -0.59 . . . . 46.04 111.162 179.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' VAL . . . . . 0.41 ' HA ' HE21 ' A' ' 142' ' ' GLN . 97.0 t -66.8 -39.59 83.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 C-N-CA 120.466 -0.494 . . . . 41.55 110.37 176.115 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.43 -33.42 72.5 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.347 -0.541 . . . . 42.03 111.352 172.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -69.9 -34.2 71.18 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.105 -1.045 . . . . 51.42 112.43 174.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' GLN . . . . . 0.457 ' OE1' ' ND2' ' A' ' 158' ' ' ASN . 26.0 mt-30 -65.63 -32.85 74.65 Favored 'General case' 0 C--O 1.238 0.457 0 O-C-N 122.237 -0.567 . . . . 59.0 111.427 173.939 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ARG . . . . . 0.414 ' NH2' ' O ' ' A' ' 602' ' ' ACT . 89.4 mtm-85 -71.74 -40.78 69.16 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.372 -0.531 . . . . 41.74 111.315 -179.634 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -68.46 -29.84 68.56 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 119.385 -0.926 . . . . 67.81 111.495 179.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -70.23 -33.79 72.08 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 119.884 -0.727 . . . . 53.59 110.791 172.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' THR . . . . . 0.521 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 93.2 m -64.52 -48.41 75.23 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.82 0.343 . . . . 51.34 110.875 175.951 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 76.2 mtt85 -63.58 -28.89 70.24 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.524 -0.47 . . . . 64.48 111.481 178.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -87.93 -9.05 54.79 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.161 0.801 . . . . 95.24 113.161 177.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 73.7 mtt-85 57.28 44.02 22.62 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.143 0.577 . . . . 88.48 111.669 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' SER . . . . . 0.489 ' OG ' ' HG3' ' A' ' 153' ' ' GLN . 1.4 t -120.52 114.36 21.65 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 109.324 -0.621 . . . . 77.75 109.324 -179.683 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 5.5 mt -63.21 -28.12 69.82 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.797 -0.638 . . . . 66.32 110.768 170.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -58.58 -58.3 9.15 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 121.056 -0.258 . . . . 103.14 110.961 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' GLN . . . . . 0.489 ' HG3' ' OG ' ' A' ' 150' ' ' SER . 6.4 mt-30 -65.1 -27.11 68.54 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.896 -0.322 . . . . 98.32 111.71 -179.088 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -67.56 -49.4 63.38 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.271 -0.572 . . . . 60.72 111.132 -178.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -65.78 -22.95 66.61 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.551 -0.46 . . . . 74.57 111.873 175.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -63.9 -37.87 89.01 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.179 -0.608 . . . . 102.15 111.385 -177.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' VAL . . . . . . . . . . . . . 14.5 m -115.37 -1.17 9.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 113.051 0.76 . . . . 77.62 113.051 -175.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.457 ' ND2' ' OE1' ' A' ' 142' ' ' GLN . 20.1 t-20 -72.85 -27.21 61.79 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 119.511 -0.876 . . . . 95.19 111.549 178.109 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 3.3 p -71.97 -36.96 69.97 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.035 -0.666 . . . . 81.1 110.87 173.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -60.73 -43.72 97.53 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.667 -0.413 . . . . 91.3 111.157 176.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -64.7 -39.76 94.21 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.506 -0.477 . . . . 47.81 111.248 -178.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . -66.97 -38.78 93.04 Favored Glycine 0 C--N 1.335 0.487 0 C-N-CA 120.067 -1.063 . . . . 52.19 112.864 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -65.8 -47.33 75.45 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 122.251 -0.558 . . . . 60.92 111.033 178.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' ALA . . . . . . . . . . . . . . . -65.21 -31.95 73.37 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.553 -0.459 . . . . 49.52 111.549 179.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' MET . . . . . . . . . . . . . 34.5 tpp -72.16 -34.98 68.89 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.25 -0.58 . . . . 55.63 111.524 177.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -63.7 -39.56 97.64 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 119.921 -1.133 . . . . 48.22 112.491 175.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 39.0 mtm105 -74.3 -30.62 62.15 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 122.171 -0.605 . . . . 78.98 111.607 177.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 17.8 mt -64.43 -38.84 92.43 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.473 -0.491 . . . . 45.82 111.278 176.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -71.0 -37.23 72.68 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.44 -0.504 . . . . 61.84 111.421 -177.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' THR . . . . . . . . . . . . . 58.0 m -69.27 -39.4 78.42 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.246 -0.582 . . . . 55.32 110.727 176.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' LEU . . . . . . . . . . . . . 9.5 mt -63.75 -36.72 84.79 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.571 -0.452 . . . . 54.92 111.333 177.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' ARG . . . . . . . . . . . . . 37.3 ttt-85 -63.95 -44.32 93.16 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 119.79 -0.764 . . . . 45.97 110.951 175.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -57.18 -48.93 77.52 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.751 0.31 . . . . 63.0 111.288 179.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -63.28 -37.34 86.87 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.499 -0.48 . . . . 56.01 111.266 178.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 18.2 mt -71.58 -40.15 70.11 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.695 -0.402 . . . . 41.88 111.418 -179.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 78.5 t -63.5 -40.58 89.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 120.607 -0.437 . . . . 46.27 110.575 178.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' THR . . . . . . . . . . . . . 91.4 m -64.36 -41.63 96.63 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.42 -0.512 . . . . 46.05 111.142 177.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 55.7 m -65.44 -41.4 93.53 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.732 -0.387 . . . . 53.12 111.338 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 28.2 mt -66.38 -43.97 84.44 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.398 -0.521 . . . . 40.46 111.137 177.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 33.1 t -61.69 -34.22 75.38 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.946 -0.302 . . . . 51.86 111.601 176.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 69.8 tt0 -69.64 -39.59 77.04 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.548 -0.461 . . . . 59.39 111.228 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 24.4 tpt180 -67.08 -44.7 79.41 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.264 -0.574 . . . . 80.93 111.146 178.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -60.41 -43.67 98.45 Favored Glycine 0 C--N 1.334 0.428 0 C-N-CA 120.092 -1.051 . . . . 45.5 112.688 177.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -65.53 -33.54 76.16 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.065 -0.654 . . . . 71.2 111.456 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -59.81 -27.63 66.76 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 120.571 -0.452 . . . . 79.12 111.79 178.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 59.6 mt -74.78 -35.95 38.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 120.867 0.365 . . . . 79.05 110.874 -178.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.79 -32.9 74.8 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 113.097 0.777 . . . . 88.62 113.097 -177.904 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 118.297 0.498 . . . . 91.99 111.696 175.754 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.894 0.378 . . . . 74.49 110.939 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.24 -40.39 67.75 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.191 -0.603 . . . . 54.83 110.826 174.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' HIS . . . . . . . . . . . . . 33.0 m80 -67.35 -33.7 75.77 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.43 -0.508 . . . . 66.94 111.551 176.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -68.67 -41.07 79.77 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.21 -0.596 . . . . 44.1 111.364 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 1.4 m -66.9 -37.74 84.95 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.281 -0.567 . . . . 58.84 111.374 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -65.54 -43.23 90.57 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.26 -0.576 . . . . 64.15 111.143 176.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 64.2 mtt85 -58.53 -46.34 87.0 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.653 -0.419 . . . . 41.23 111.013 175.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 32.0 tp -67.22 -46.27 74.32 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.874 -0.33 . . . . 34.41 111.336 -176.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -69.92 -41.33 74.79 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.947 -0.701 . . . . 39.55 111.505 -176.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -68.35 -36.99 80.06 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 119.906 -0.718 . . . . 41.23 111.281 178.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.45 -40.49 91.33 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.213 -0.595 . . . . 29.02 111.257 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.497 HD12 ' HD3' ' B' ' 172' ' ' ARG . 6.9 mt -74.53 -43.33 56.31 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.189 -0.604 . . . . 38.42 111.8 -177.157 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 83.1 mt -61.95 -38.47 88.59 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.285 -0.566 . . . . 39.37 111.226 178.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' MET . . . . . . . . . . . . . 59.5 mtm -77.77 -22.6 49.94 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.813 -0.755 . . . . 43.89 111.484 178.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -74.35 -39.82 62.53 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 120.028 -0.669 . . . . 26.72 111.089 -179.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' ILE . . . . . . . . . . . . . 6.9 tp -69.95 -40.97 79.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 120.434 -0.506 . . . . 31.96 110.868 179.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 56.9 mtp180 -63.0 -31.65 72.84 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 121.654 -0.654 . . . . 42.61 111.191 174.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 15.2 t -63.7 -33.7 76.23 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.382 -0.527 . . . . 26.65 110.919 174.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 22.9 t -76.9 -47.23 21.69 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 120.88 -0.328 . . . . 28.05 111.48 178.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.29 -28.4 62.99 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 119.986 -0.685 . . . . 30.17 111.64 179.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -78.51 -38.74 40.01 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 120.624 -0.43 . . . . 32.27 112.123 -177.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' VAL . . . . . . . . . . . . . 14.6 p -56.6 -53.82 36.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 C-N-CA 118.791 -1.164 . . . . 27.42 110.941 178.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 66.7 m -60.0 -43.71 95.01 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.591 -0.693 . . . . 31.84 110.869 173.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.2 m -56.91 -45.81 82.4 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.628 -0.429 . . . . 60.82 110.614 171.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.45 -41.09 99.8 Favored Glycine 0 C--N 1.335 0.495 0 C-N-CA 120.264 -0.969 . . . . 35.35 113.028 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -59.82 -43.17 94.67 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 122.241 -0.564 . . . . 42.33 110.916 177.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 91.7 mt -65.49 -35.56 75.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 C-N-CA 120.809 -0.356 . . . . 41.31 110.708 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -66.58 -33.59 76.01 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.545 -0.722 . . . . 50.63 111.723 177.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -64.31 -37.88 89.05 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.243 -0.583 . . . . 59.36 110.928 174.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 30.0 mt -66.45 -29.8 70.02 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.863 -0.335 . . . . 44.99 111.568 178.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -90.9 6.65 81.83 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 115.255 0.862 . . . . 47.91 115.255 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' GLY . . . . . . . . . . . . . . . 82.8 8.0 86.52 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 118.411 1.106 . . . . 51.56 115.433 179.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -89.71 71.08 7.78 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 122.678 1.228 . . . . 66.2 109.254 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -70.59 -40.22 73.36 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.517 -1.219 . . . . 77.61 111.716 -172.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -69.28 -40.25 77.86 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.465 -0.494 . . . . 73.31 110.999 176.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 33.3 t -69.52 -29.11 66.65 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.658 -0.417 . . . . 51.28 111.679 179.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' ALA . . . . . 0.432 ' O ' ' HG2' ' B' ' 95' ' ' MET . . . -68.8 -39.04 80.32 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.221 -0.591 . . . . 40.1 111.227 178.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . -61.29 -33.37 84.19 Favored Glycine 0 C--N 1.336 0.528 0 C-N-CA 120.271 -0.966 . . . . 44.18 112.856 176.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt -71.47 -36.15 71.08 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.763 -0.375 . . . . 55.76 110.811 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' ARG . . . . . . . . . . . . . 11.2 mmt180 -65.37 -39.2 92.0 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.711 -0.395 . . . . 68.06 111.162 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' MET . . . . . 0.432 ' HG2' ' O ' ' B' ' 91' ' ' ALA . 26.9 tpp -64.6 -43.05 95.02 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.746 -0.381 . . . . 43.9 111.323 179.786 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.85 -41.92 95.31 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.544 -0.462 . . . . 36.64 111.344 -179.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 35.0 tp -64.2 -34.78 78.87 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.376 -0.529 . . . . 45.38 111.101 177.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' SER . . . . . . . . . . . . . 11.7 t -66.48 -39.15 88.62 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.299 -0.56 . . . . 34.38 111.433 177.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' VAL . . . . . . . . . . . . . 56.6 t -61.53 -46.76 95.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.264 0.554 . . . . 32.32 110.131 175.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -65.5 -44.26 87.59 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 122.059 -0.401 . . . . 79.55 111.569 -176.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 57.7 mt -62.29 -34.26 76.24 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.265 -0.574 . . . . 34.57 111.445 177.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 27.5 t30 -68.85 -44.05 74.16 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.371 -0.532 . . . . 50.84 111.209 177.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -62.35 -41.78 98.86 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.397 -0.521 . . . . 46.96 111.172 178.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -70.69 -40.29 72.97 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.385 -0.526 . . . . 59.29 111.428 -178.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 21.9 p -70.2 -36.62 74.72 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.966 -0.694 . . . . 42.57 111.224 -179.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -60.66 -39.9 90.06 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.499 -0.48 . . . . 49.62 111.156 174.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.96 -39.25 93.2 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.473 -0.491 . . . . 33.0 111.321 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 23.2 mt -66.9 -42.02 86.16 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.22 -0.592 . . . . 35.39 111.36 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 55.5 t -59.37 -39.13 78.25 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 120.609 -0.436 . . . . 36.95 110.411 177.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' ASP . . . . . 0.509 ' O ' ' HG3' ' B' ' 114' ' ' GLU . 77.9 m-20 -67.34 -45.26 76.93 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.215 -0.594 . . . . 66.73 111.267 -179.903 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -57.04 -42.55 80.7 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.62 -0.432 . . . . 83.08 111.291 174.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -61.37 -47.38 86.12 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.936 -0.306 . . . . 37.62 111.17 -177.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 75.0 t -65.32 -37.12 79.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 CA-C-O 120.836 0.351 . . . . 61.75 110.756 -176.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' B' ' 110' ' ' ASP . 16.1 tt0 -71.87 -23.23 61.48 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 121.845 -0.534 . . . . 69.2 111.661 179.248 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -99.32 4.73 46.54 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 112.94 0.718 . . . . 54.3 112.94 -177.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -105.46 92.05 4.03 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.325 -1.361 . . . . 75.44 107.325 177.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' ARG . . . . . 0.431 ' HD3' ' O ' ' B' ' 114' ' ' GLU . 16.9 mmm180 -109.63 -36.45 5.95 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 113.963 1.097 . . . . 90.47 113.963 -175.468 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' GLU . . . . . 0.469 ' HG3' ' H ' ' B' ' 120' ' ' ALA . 7.3 pm0 -51.78 123.49 24.72 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.577 -0.527 . . . . 81.73 109.577 175.419 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.99 -18.31 16.54 Favored 'Trans proline' 0 N--CA 1.477 0.553 0 N-CA-C 115.368 1.257 . . . . 91.94 115.368 -173.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' ALA . . . . . 0.469 ' H ' ' HG3' ' B' ' 118' ' ' GLU . . . -66.56 -21.01 66.15 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 118.437 0.562 . . . . 78.61 112.027 172.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 mt -113.24 -13.42 12.96 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 114.342 1.238 . . . . 79.64 114.342 -178.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' ARG . . . . . . . . . . . . . 7.6 ttp180 -63.68 -44.57 93.34 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.446 0.567 . . . . 105.47 111.647 -170.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -71.21 -38.22 63.23 Favored Glycine 0 C--N 1.335 0.492 0 C-N-CA 119.924 -1.132 . . . . 51.01 112.669 179.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' B' ' 124' ' ' LEU . 3.1 tp -69.15 -35.7 76.64 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 122.228 -0.572 . . . . 56.72 111.323 178.908 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -66.2 -40.25 90.26 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.274 -0.57 . . . . 41.35 111.201 177.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' THR . . . . . . . . . . . . . 85.1 m -67.81 -35.93 79.5 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.288 -0.565 . . . . 48.65 111.136 178.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' GLU . . . . . 0.482 ' HG2' HD11 ' B' ' 171' ' ' LEU . 70.2 tt0 -65.14 -39.85 93.61 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.246 -0.582 . . . . 49.71 111.044 175.865 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 10.8 tp -60.91 -43.98 97.8 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.589 -0.445 . . . . 40.57 111.066 174.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -59.27 -47.14 86.49 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.739 0.304 . . . . 56.74 111.323 -179.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.36 -40.14 77.65 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.452 -0.499 . . . . 35.85 111.533 -177.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 84.8 m -67.11 -38.5 85.73 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.148 -0.621 . . . . 37.21 110.937 178.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -63.31 -36.08 82.49 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.361 -0.536 . . . . 43.09 111.03 174.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.28 -39.05 93.5 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.529 -0.469 . . . . 35.43 111.131 177.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -59.27 -46.15 89.29 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.183 -0.607 . . . . 41.54 111.097 176.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' TYR . . . . . 0.401 ' CE1' ' HB2' ' B' ' 165' ' ' MET . 76.5 t80 -64.6 -48.69 73.98 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.683 -0.407 . . . . 30.28 111.372 -179.955 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.79 -40.11 87.18 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.566 -0.454 . . . . 31.44 111.21 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -62.75 -39.93 95.69 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 120.295 -0.562 . . . . 75.38 111.197 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.75 -41.51 83.26 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.396 -0.521 . . . . 32.72 111.273 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' VAL . . . . . . . . . . . . . 84.3 t -65.45 -36.19 77.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 C-N-CA 120.641 -0.424 . . . . 33.99 110.446 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.12 -34.3 76.09 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.125 -0.63 . . . . 37.24 111.207 171.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' GLY . . . . . . . . . . . . . . . -69.57 -33.14 71.59 Favored Glycine 0 C--N 1.335 0.499 0 C-N-CA 120.221 -0.99 . . . . 36.83 112.873 173.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -63.42 -39.58 94.88 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 117.389 0.594 . . . . 36.07 110.893 172.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 86.6 mtm-85 -65.63 -44.21 87.15 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.841 -0.344 . . . . 38.25 111.338 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' GLU . . . . . 0.426 ' OE1' ' O ' ' B' ' 601' ' ' HOH . 38.9 tp10 -71.05 -34.27 71.08 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 119.232 -0.987 . . . . 76.2 111.444 -178.626 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.28 -30.06 71.27 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.612 -0.835 . . . . 38.22 111.13 172.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' THR . . . . . . . . . . . . . 98.5 m -73.61 -42.26 61.73 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.606 -0.437 . . . . 43.75 111.201 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' ARG . . . . . 0.723 ' NH1' ' O ' ' B' ' 601' ' ' HOH . 77.1 mtt85 -62.85 -36.23 82.58 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.502 -0.479 . . . . 60.27 111.636 178.514 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -87.88 1.51 53.85 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.442 0.534 . . . . 89.78 112.442 175.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 7.1 mtt180 53.47 43.6 31.07 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.567 0.699 . . . . 85.09 111.422 174.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' SER . . . . . . . . . . . . . 7.8 t -110.12 114.5 28.05 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.294 -0.632 . . . . 46.25 109.294 -176.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' LEU . . . . . . . . . . . . . 18.7 mt -68.35 -34.51 76.21 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.38 -0.528 . . . . 48.89 111.623 175.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' GLU . . . . . 0.451 ' HG3' ' HE2' ' B' ' 156' ' ' LYS . 46.9 tp10 -72.98 -42.46 63.3 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.26 -0.576 . . . . 72.44 111.489 -176.492 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -62.55 -33.26 74.58 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.29 -0.564 . . . . 80.28 111.529 175.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -65.6 -40.01 92.2 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.983 -0.687 . . . . 45.28 111.055 177.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -67.65 -30.72 70.35 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.532 -0.467 . . . . 48.47 111.833 -178.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' LYS . . . . . 0.451 ' HE2' ' HG3' ' B' ' 152' ' ' GLU . 71.4 mmtt -75.48 -28.67 59.31 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.973 0.416 . . . . 66.85 111.041 -177.891 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' VAL . . . . . . . . . . . . . 26.1 m -95.54 -9.15 9.35 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 N-CA-C 112.728 0.64 . . . . 51.28 112.728 -174.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' ASN . . . . . 0.428 HD21 ' HB2' ' A' ' 78' ' ' SER . 4.4 t30 -66.85 -36.32 82.07 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 118.318 0.508 . . . . 61.04 111.423 -175.809 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' SER . . . . . . . . . . . . . 66.2 p -68.37 -34.19 75.62 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.077 -0.649 . . . . 36.47 111.523 177.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 160' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -65.54 -38.15 88.8 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.409 -0.517 . . . . 68.69 111.201 178.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -70.53 -41.63 72.27 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.589 -0.444 . . . . 33.2 111.298 178.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 162' ' ' GLY . . . . . . . . . . . . . . . -66.51 -41.23 94.31 Favored Glycine 0 C--N 1.335 0.474 0 C-N-CA 120.097 -1.049 . . . . 31.42 112.898 -177.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -71.14 -39.16 72.14 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.163 -0.615 . . . . 36.34 111.331 -179.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' ALA . . . . . . . . . . . . . . . -64.94 -41.64 95.34 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.129 -0.628 . . . . 29.81 111.238 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 165' ' ' MET . . . . . 0.401 ' HB2' ' CE1' ' B' ' 135' ' ' TYR . 32.1 tpp -69.43 -33.76 73.43 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.617 -0.433 . . . . 42.64 111.686 179.492 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 166' ' ' GLY . . . . . . . . . . . . . . . -61.68 -35.18 90.82 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 119.773 -1.203 . . . . 39.84 112.052 172.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 24.7 tpt180 -74.27 -37.16 63.79 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 122.262 -0.552 . . . . 48.79 111.085 176.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 168' ' ' LEU . . . . . . . . . . . . . 79.7 mt -63.81 -33.52 75.85 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.481 -0.488 . . . . 32.77 111.479 177.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 169' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -61.78 -45.17 95.02 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.841 -0.343 . . . . 60.19 111.022 177.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 170' ' ' THR . . . . . . . . . . . . . 69.4 p -73.66 -34.66 65.04 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.118 -0.633 . . . . 51.71 111.248 178.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.482 HD11 ' HG2' ' B' ' 127' ' ' GLU . 1.7 mt -64.62 -41.26 96.3 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.578 -0.449 . . . . 47.61 111.425 178.923 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 172' ' ' ARG . . . . . 0.497 ' HD3' HD12 ' B' ' 66' ' ' LEU . 41.8 ttp85 -63.01 -42.26 99.78 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.367 -0.533 . . . . 55.31 111.281 -179.891 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 173' ' ' GLN . . . . . 0.5 ' NE2' ' OD2' ' A' ' 60' ' ' ASP . 54.9 tp60 -58.55 -48.45 80.85 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.813 -0.355 . . . . 66.87 111.008 177.668 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 174' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -63.56 -33.04 74.72 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.448 -0.501 . . . . 77.02 111.541 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 175' ' ' LEU . . . . . . . . . . . . . 10.5 mt -71.28 -34.3 70.54 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.112 -0.635 . . . . 53.52 112.008 -177.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 176' ' ' VAL . . . . . . . . . . . . . 27.3 m -82.16 -21.3 9.91 Favored 'Isoleucine or valine' 0 C--O 1.241 0.652 0 C-N-CA 119.918 -0.713 . . . . 93.24 112.544 -178.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 177' ' ' THR . . . . . 0.439 HG23 ' O ' ' B' ' 173' ' ' GLN . 11.7 p -74.54 -32.27 62.39 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 119.525 -0.87 . . . . 95.85 111.643 169.154 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 178' ' ' THR . . . . . . . . . . . . . 3.6 m -75.07 -16.36 60.58 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 120.408 -0.517 . . . . 82.02 111.317 172.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 179' ' ' LEU . . . . . . . . . . . . . 27.1 mt -87.81 14.95 7.69 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 112.794 0.665 . . . . 86.97 112.794 175.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 44.3 m . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 118.161 0.437 . . . . 99.03 111.321 179.185 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 601' ' ' SAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 602' ' ' ACT . . . . . 0.414 ' O ' ' NH2' ' A' ' 143' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 701' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 702' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 703' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 704' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 705' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 706' ' ' HOH . . . . . 0.406 ' O ' ' N ' ' A' ' 50' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 707' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 708' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 709' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 710' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 711' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 712' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 713' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 714' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 715' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 716' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 717' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 718' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 719' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 720' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 721' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 722' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 723' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 601' ' ' HOH . . . . . 0.723 ' O ' ' NH1' ' B' ' 147' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 606' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 612' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 613' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 614' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 615' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 616' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 622' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 624' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 627' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 628' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 629' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 631' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_