data_6lji_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 6lji _Structure_validation_residue.Date_analyzed 2020-08-07 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 ' 1' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 110.693 -0.114 . . . . 36.950000000000003 110.693 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 38.5 m -90.1 120.64 31.45 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 109.226 -0.657 . . . . 25.440000000000001 109.226 169.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -109.42 153.14 24.43 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.826 -0.805 . . . . 22.98 108.826 174.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -119.47 150.03 40.89 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.886 -0.597 . . . . 27.510000000000002 110.508 -177.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -124.64 123.4 39.96 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.403 -0.817 . . . . 11.68 109.017 177.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.0 mm -100.12 125.85 53.75 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 N-CA-C 106.918 -1.512 . . . . 18.780000000000001 106.918 169.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.9 mp -113.06 115.8 28.91 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 107.916 -1.142 . . . . 14.970000000000001 107.916 178.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -112.43 108.9 18.21 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 107.559 -1.274 . . . . 26.140000000000001 107.559 -177.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.87 58.65 0.4 Allowed Glycine 0 CA--C 1.52 0.402 0 CA-C-O 121.456 0.476 . . . . 29.440000000000001 112.087 177.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.5 m -86.89 -12.57 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 115.988 -0.551 . . . . 27.719999999999999 109.767 179.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.0 mt -106.91 142.6 36.28 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.031 0.532 . . . . 22.670000000000002 110.416 -178.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . . . -138.67 157.6 45.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.889 -0.596 . . . . 16.359999999999999 109.686 -176.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -158.33 173.46 35.45 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 108.956 -1.657 . . . . 16.870000000000001 108.956 179.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -160.97 160.65 31.01 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 118.761 -1.176 . . . . 40.390000000000001 108.49 178.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.5 t -163.29 174.39 12.11 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.047 -1.094 . . . . 17.890000000000001 108.047 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 82.5 p -136.76 164.12 29.02 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.589 0.709 . . . . 21.739999999999998 109.604 178.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 5.3 t -149.69 154.05 37.95 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.214 -1.032 . . . . 20.899999999999999 108.214 170.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -93.49 137.29 32.92 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.59 -0.732 . . . . 28.84 109.08 168.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -160.49 159.69 31.1 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.322 -0.621 . . . . 22.129999999999999 109.322 179.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 15.3 m -77.37 -31.23 17.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 115.231 -0.895 . . . . 28.359999999999999 111.881 -176.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -149.08 178.9 8.3 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.661 -0.866 . . . . 27.91 108.661 177.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.48 -37.95 59.89 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.687 -0.688 . . . . 23.73 111.579 -171.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.23 -39.63 83.32 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.971 -0.691 . . . . 21.84 111.335 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 90.9 m -69.2 -43.23 74.58 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 119.324 -0.95 . . . . 24.210000000000001 111.282 179.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.92 -38.41 75.85 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 120.278 -0.569 . . . . 16.32 111.473 176.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.3 tt0 -68.88 -36.87 78.6 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.7 -0.8 . . . . 28.359999999999999 111.64 -178.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.9 ttmp? -58.93 -43.37 91.15 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-O 121.214 0.531 . . . . 29.690000000000001 110.8 174.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.2 t -65.63 -42.55 93.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-O 121.229 0.538 . . . . 20.809999999999999 110.38 178.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -68.64 -36.36 78.48 Favored 'General case' 0 C--O 1.235 0.297 0 O-C-N 122.174 -0.329 . . . . 14.94 111.434 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -71.52 -31.21 66.8 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.027 -0.669 . . . . 24.890000000000001 111.21 -178.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -73.82 -42.73 60.49 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.36 -0.536 . . . . 41.100000000000001 111.006 176.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' TYR . . . . . 0.423 ' O ' ' ND2' ' A' ' 37' ' ' ASN . 74.3 t80 -61.13 -46.85 88.89 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 121.162 0.506 . . . . 24.129999999999999 111.61 176.041 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.61 -45.34 94.37 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.017 -0.427 . . . . 19.16 111.109 179.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -70.55 -44.42 67.52 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.892 -0.323 . . . . 35.270000000000003 111.361 -177.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -53.48 -28.01 28.37 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 111.748 0.277 . . . . 25.34 111.748 175.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASN . . . . . 0.423 ' ND2' ' O ' ' A' ' 33' ' ' TYR . 68.0 m-80 -108.18 16.08 23.59 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 112.202 0.445 . . . . 23.899999999999999 112.202 -171.566 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.58 19.58 65.79 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 116.15 1.22 . . . . 23.98 116.15 172.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 42.8 t -115.49 107.21 22.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 118.743 1.271 . . . . 21.91 108.105 -175.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -125.85 138.76 53.83 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.172 -0.677 . . . . 36.700000000000003 109.172 179.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 172.97 -153.07 17.54 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 119.77 -1.205 . . . . 22.649999999999999 111.648 177.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -88.06 131.84 34.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.546 -0.827 . . . . 39.380000000000003 110.608 -172.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 64.2 m95 -104.17 138.88 40.02 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.016 0.436 . . . . 20.329999999999998 111.169 -178.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.4 p -141.49 159.11 42.89 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.006 -0.739 . . . . 20.710000000000001 109.006 171.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -130.35 134.92 47.53 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 115.277 -0.874 . . . . 20.420000000000002 110.467 -177.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -106.48 96.72 6.66 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 106.313 -1.736 . . . . 25.469999999999999 106.313 170.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 42.6 p30 -68.43 -13.81 62.56 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.855 -0.738 . . . . 22.280000000000001 112.381 -179.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.51 -27.59 51.82 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 119.42 -0.912 . . . . 23.210000000000001 111.73 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 68.4 p -112.95 1.96 15.63 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 112.653 0.612 . . . . 22.43 112.653 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.1 mttp 51.23 48.59 22.73 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.527 0.68 . . . . 31.809999999999999 110.107 -177.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 74.2 m -127.07 124.62 39.69 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.202 -0.908 . . . . 17.760000000000002 109.151 -175.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -94.48 149.78 20.9 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.381 -0.6 . . . . 18.190000000000001 109.381 170.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.6 m -124.66 132.37 53.41 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 109.093 -0.706 . . . . 13.18 109.093 167.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 6.7 p -110.07 128.36 66.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 N-CA-C 107.298 -1.371 . . . . 15.029999999999999 107.298 166.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 97.1 m -121.2 119.06 31.24 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.25 -1.018 . . . . 18.18 108.25 -173.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 . . . . . 0 C--N 1.328 -0.328 0 O-C-N 123.333 0.396 . . . . 32.810000000000002 110.695 177.013 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 . . . . . 0 C--O 1.236 0.352 0 N-CA-C 109.737 -0.468 . . . . 46.490000000000002 109.737 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 68.9 m -91.4 120.07 31.94 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 123.959 0.787 . . . . 27.050000000000001 109.413 173.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -108.49 155.18 20.9 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.544 -0.91 . . . . 26.920000000000002 108.544 174.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -118.64 151.43 37.95 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.246 0.546 . . . . 33.439999999999998 110.631 -178.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 62.9 tp -124.56 122.79 38.54 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.191 -0.913 . . . . 13.23 108.826 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 20.2 mm -99.42 126.64 52.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 107.411 -1.329 . . . . 17.91 107.411 167.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 4.5 mp -112.58 112.5 24.07 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.843 -1.169 . . . . 17.48 107.843 177.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 60.0 t-20 -106.04 106.31 16.76 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.599 -1.63 . . . . 27.079999999999998 106.599 178.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . -96.35 0.41 61.74 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 114.834 0.694 . . . . 34.200000000000003 114.834 -176.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 17.5 m -85.13 -12.43 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 CA-C-N 115.452 -0.794 . . . . 26.190000000000001 109.21 172.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 58.4 mt -105.49 138.17 42.12 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 110.018 -0.364 . . . . 20.629999999999999 110.018 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' LYS . . . . . . . . . . . . . 10.8 mmtm -131.81 155.58 47.54 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.435 0.636 . . . . 30.050000000000001 110.563 -176.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -154.98 167.52 32.77 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 109.949 -1.26 . . . . 17.420000000000002 109.949 -179.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -155.89 161.26 40.59 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 118.465 -1.294 . . . . 43.530000000000001 109.63 172.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 13.1 t -162.36 173.33 14.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.883 -1.053 . . . . 17.079999999999998 108.35 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' THR . . . . . . . . . . . . . 65.2 p -137.11 162.62 32.89 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 115.417 -0.81 . . . . 22.949999999999999 109.441 -179.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 3.7 t -149.45 158.01 43.8 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 107.124 -1.435 . . . . 27.440000000000001 107.124 173.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -106.92 134.38 50.15 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.457 -1.312 . . . . 35.770000000000003 107.457 174.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -161.55 156.47 23.41 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.41 0.624 . . . . 28.559999999999999 109.66 -174.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 9.2 p -78.34 -25.24 13.83 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 CA-C-N 114.915 -1.039 . . . . 37.869999999999997 111.434 -173.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ASP . . . . . . . . . . . . . 28.6 p30 -155.23 173.89 15.99 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 121.535 0.683 . . . . 37.979999999999997 109.473 175.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.31 -33.77 73.66 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 114.937 -1.029 . . . . 27.719999999999999 111.699 -171.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.14 -40.59 96.48 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.866 -0.733 . . . . 29.190000000000001 111.058 -177.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 91.8 m -62.54 -53.77 49.76 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 120.684 -0.406 . . . . 33.340000000000003 110.584 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -50.69 -39.75 52.14 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 120.673 0.273 . . . . 22.420000000000002 111.414 178.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -70.76 -38.69 73.49 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.382 -0.927 . . . . 25.039999999999999 111.2 -177.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -58.67 -43.62 89.97 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.168 -0.613 . . . . 41.450000000000003 110.611 175.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 19.1 t -62.18 -50.81 78.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-O 121.283 0.564 . . . . 24.100000000000001 110.53 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' PHE . . . . . . . . . . . . . 11.7 m-30 -62.47 -33.6 75.16 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.847 -0.341 . . . . 19.300000000000001 111.546 -178.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 63.7 mttt -73.03 -30.49 63.78 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.81 -0.756 . . . . 22.140000000000001 111.848 -177.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -76.65 -45.11 31.2 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 119.455 -0.898 . . . . 38.039999999999999 111.403 174.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' TYR . . . . . 0.578 ' O ' ' ND2' ' B' ' 37' ' ' ASN . 66.1 t80 -52.1 -48.35 64.81 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.206 0.527 . . . . 24.460000000000001 111.175 174.175 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.74 -47.37 81.33 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.583 -0.447 . . . . 24.510000000000002 110.887 -177.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -68.5 -40.35 80.93 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 120.639 -0.424 . . . . 39.740000000000002 111.533 -178.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -55.12 -39.3 69.23 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.663 0.268 . . . . 35.890000000000001 111.288 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ASN . . . . . 0.578 ' ND2' ' O ' ' B' ' 33' ' ' TYR . 59.7 m-80 -98.27 17.84 17.75 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 122.792 0.437 . . . . 31.699999999999999 111.803 -172.075 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.11 32.71 51.82 Favored Glycine 0 C--O 1.238 0.393 0 N-CA-C 115.791 1.076 . . . . 33.259999999999998 115.791 172.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 61.6 t -121.1 102.97 13.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 N-CA-C 107.745 -1.206 . . . . 28.579999999999998 107.745 178.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -119.45 135.79 54.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.941 -0.763 . . . . 38.979999999999997 108.941 175.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . 177.69 -159.73 25.83 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 119.98 -1.105 . . . . 24.600000000000001 111.346 -179.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -87.16 140.56 29.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 114.903 -0.649 . . . . 42.840000000000003 110.936 -176.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' TRP . . . . . . . . . . . . . 55.0 m95 -109.83 138.82 45.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.832 0.348 . . . . 19.420000000000002 111.586 -177.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 44.4 p -138.11 160.06 40.39 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.082 -0.71 . . . . 21.190000000000001 109.082 166.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -130.22 130.33 44.5 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.025 -0.989 . . . . 23.170000000000002 109.272 -176.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -101.71 94.92 6.09 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 106.209 -1.775 . . . . 26.739999999999998 106.209 169.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 30.3 p30 -67.73 -12.05 59.69 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 119.059 -1.056 . . . . 24.670000000000002 112.603 -178.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.68 -29.86 59.19 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 118.064 0.393 . . . . 24.25 111.977 176.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 64.2 p -115.04 6.06 15.12 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 112.001 0.371 . . . . 26.640000000000001 112.001 177.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 47.83 45.36 18.57 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.736 0.779 . . . . 37.390000000000001 110.227 -178.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' THR . . . . . . . . . . . . . 51.9 m -121.38 123.26 41.69 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.063 -0.971 . . . . 21.850000000000001 108.528 -177.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -92.67 149.98 20.98 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.578 -0.527 . . . . 18.699999999999999 109.578 168.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 85.6 m -125.51 127.41 46.41 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.533 -0.758 . . . . 14.81 109.177 169.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 7.5 p -107.84 131.61 57.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 107.629 -1.248 . . . . 15.25 107.629 165.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 52.1 m -122.68 120.78 34.7 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 108.206 -1.035 . . . . 18.57 108.206 -177.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 . . . . . 0 CA--C 1.516 -0.341 0 CA-C-O 121.257 0.551 . . . . 36.369999999999997 111.255 -179.063 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 110.693 -0.114 . . . . 36.95 110.693 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 38.5 m -90.1 120.64 31.45 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 109.226 -0.657 . . . . 25.44 109.226 169.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -109.42 153.14 24.43 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.826 -0.805 . . . . 22.98 108.826 174.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LYS . . . . . 0.508 ' HG2' HG22 ' A' ' 17' ' ' THR . 51.2 mttp -119.47 150.03 40.89 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.886 -0.597 . . . . 27.51 110.508 -177.254 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -124.64 123.4 39.96 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.403 -0.817 . . . . 11.68 109.017 177.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.0 mm -100.12 125.85 53.75 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 N-CA-C 106.918 -1.512 . . . . 18.78 106.918 169.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.9 mp -113.06 115.8 28.91 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 107.916 -1.142 . . . . 14.97 107.916 178.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -112.43 108.9 18.21 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 107.559 -1.274 . . . . 26.14 107.559 -177.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.87 58.65 0.4 Allowed Glycine 0 CA--C 1.52 0.402 0 CA-C-O 121.456 0.476 . . . . 29.44 112.087 177.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.5 m -86.89 -12.57 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 115.988 -0.551 . . . . 27.72 109.767 179.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.0 mt -106.91 142.6 36.28 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.031 0.532 . . . . 22.67 110.416 -178.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . . . -138.67 157.6 45.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.889 -0.596 . . . . 16.36 109.686 -176.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -158.33 173.46 35.45 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 108.956 -1.657 . . . . 16.87 108.956 179.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -160.97 160.65 31.01 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 118.761 -1.176 . . . . 40.39 108.49 178.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.5 t -163.29 174.39 12.11 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.047 -1.094 . . . . 17.89 108.047 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' THR . . . . . 0.508 HG22 ' HG2' ' A' ' 4' ' ' LYS . 82.5 p -136.76 164.12 29.02 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.589 0.709 . . . . 21.74 109.604 178.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 5.3 t -149.69 154.05 37.95 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.214 -1.032 . . . . 20.9 108.214 170.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -93.49 137.29 32.92 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.59 -0.732 . . . . 28.84 109.08 168.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -160.49 159.69 31.1 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.322 -0.621 . . . . 22.13 109.322 179.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 15.3 m -77.37 -31.23 17.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 115.231 -0.895 . . . . 28.36 111.881 -176.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -149.08 178.9 8.3 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.661 -0.866 . . . . 27.91 108.661 177.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.48 -37.95 59.89 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.687 -0.688 . . . . 23.73 111.579 -171.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.23 -39.63 83.32 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.971 -0.691 . . . . 21.84 111.335 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 90.9 m -69.2 -43.23 74.58 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 119.324 -0.95 . . . . 24.21 111.282 179.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.92 -38.41 75.85 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 120.278 -0.569 . . . . 16.32 111.473 176.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.3 tt0 -68.88 -36.87 78.6 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.7 -0.8 . . . . 28.36 111.64 -178.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.9 ttmp? -58.93 -43.37 91.15 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-O 121.214 0.531 . . . . 29.69 110.8 174.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . 0.536 HG13 HG21 ' B' ' 10' ' ' DVA . 17.2 t -65.63 -42.55 93.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-O 121.229 0.538 . . . . 20.81 110.38 178.122 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -68.64 -36.36 78.48 Favored 'General case' 0 C--O 1.235 0.297 0 O-C-N 122.174 -0.329 . . . . 14.94 111.434 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -71.52 -31.21 66.8 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.027 -0.669 . . . . 24.89 111.21 -178.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -73.82 -42.73 60.49 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.36 -0.536 . . . . 41.1 111.006 176.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -61.13 -46.85 88.89 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 121.162 0.506 . . . . 24.13 111.61 176.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.61 -45.34 94.37 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.017 -0.427 . . . . 19.16 111.109 179.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -70.55 -44.42 67.52 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.892 -0.323 . . . . 35.27 111.361 -177.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -53.48 -28.01 28.37 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 111.748 0.277 . . . . 25.34 111.748 175.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -108.18 16.08 23.59 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 112.202 0.445 . . . . 23.9 112.202 -171.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.58 19.58 65.79 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 116.15 1.22 . . . . 23.98 116.15 172.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 42.8 t -115.49 107.21 22.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 118.743 1.271 . . . . 21.91 108.105 -175.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -125.85 138.76 53.83 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.172 -0.677 . . . . 36.7 109.172 179.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 172.97 -153.07 17.54 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 119.77 -1.205 . . . . 22.65 111.648 177.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -88.06 131.84 34.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.546 -0.827 . . . . 39.38 110.608 -172.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 64.2 m95 -104.17 138.88 40.02 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.016 0.436 . . . . 20.33 111.169 -178.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.4 p -141.49 159.11 42.89 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.006 -0.739 . . . . 20.71 109.006 171.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -130.35 134.92 47.53 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 115.277 -0.874 . . . . 20.42 110.467 -177.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -106.48 96.72 6.66 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 106.313 -1.736 . . . . 25.47 106.313 170.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 42.6 p30 -68.43 -13.81 62.56 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.855 -0.738 . . . . 22.28 112.381 -179.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.51 -27.59 51.82 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 119.42 -0.912 . . . . 23.21 111.73 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 68.4 p -112.95 1.96 15.63 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 112.653 0.612 . . . . 22.43 112.653 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.1 mttp 51.23 48.59 22.73 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.527 0.68 . . . . 31.81 110.107 -177.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 74.2 m -127.07 124.62 39.69 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.202 -0.908 . . . . 17.76 109.151 -175.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -94.48 149.78 20.9 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.381 -0.6 . . . . 18.19 109.381 170.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.6 m -124.66 132.37 53.41 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 109.093 -0.706 . . . . 13.18 109.093 167.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 6.7 p -110.07 128.36 66.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 N-CA-C 107.298 -1.371 . . . . 15.03 107.298 166.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 97.1 m -121.2 119.06 31.24 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.25 -1.018 . . . . 18.18 108.25 -173.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 . . . . . 0 C--N 1.328 -0.328 0 O-C-N 123.333 0.396 . . . . 32.81 110.695 177.013 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 . . . . . 0 C--O 1.236 0.352 0 N-CA-C 109.737 -0.468 . . . . 46.49 109.737 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 68.9 m -91.4 120.07 31.94 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 123.959 0.787 . . . . 27.05 109.413 173.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -108.49 155.18 20.9 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.544 -0.91 . . . . 26.92 108.544 174.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' LYS . . . . . 0.616 ' HG2' HG22 ' B' ' 17' ' ' THR . 45.6 mttp -118.64 151.43 37.95 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.246 0.546 . . . . 33.44 110.631 -178.034 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 62.9 tp -124.56 122.79 38.54 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.191 -0.913 . . . . 13.23 108.826 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 20.2 mm -99.42 126.64 52.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 107.411 -1.329 . . . . 17.91 107.411 167.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 4.5 mp -112.58 112.5 24.07 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.843 -1.169 . . . . 17.48 107.843 177.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 60.0 t-20 -106.04 106.31 16.76 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.599 -1.63 . . . . 27.08 106.599 178.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . -96.35 0.41 61.74 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 114.834 0.694 . . . . 34.2 114.834 -176.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' DVA . . . . . 0.536 HG21 HG13 ' A' ' 29' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 17.5 m -85.13 -12.43 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 CA-C-N 115.452 -0.794 . . . . 26.19 109.21 172.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 58.4 mt -105.49 138.17 42.12 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 110.018 -0.364 . . . . 20.63 110.018 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' LYS . . . . . . . . . . . . . 10.8 mmtm -131.81 155.58 47.54 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.435 0.636 . . . . 30.05 110.563 -176.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -154.98 167.52 32.77 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 109.949 -1.26 . . . . 17.42 109.949 -179.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -155.89 161.26 40.59 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 118.465 -1.294 . . . . 43.53 109.63 172.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 13.1 t -162.36 173.33 14.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.883 -1.053 . . . . 17.08 108.35 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' THR . . . . . 0.616 HG22 ' HG2' ' B' ' 4' ' ' LYS . 65.2 p -137.11 162.62 32.89 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 115.417 -0.81 . . . . 22.95 109.441 -179.67 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 3.7 t -149.45 158.01 43.8 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 107.124 -1.435 . . . . 27.44 107.124 173.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -106.92 134.38 50.15 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.457 -1.312 . . . . 35.77 107.457 174.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -161.55 156.47 23.41 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.41 0.624 . . . . 28.56 109.66 -174.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 9.2 p -78.34 -25.24 13.83 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 CA-C-N 114.915 -1.039 . . . . 37.87 111.434 -173.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ASP . . . . . . . . . . . . . 28.6 p30 -155.23 173.89 15.99 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 121.535 0.683 . . . . 37.98 109.473 175.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.31 -33.77 73.66 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 114.937 -1.029 . . . . 27.72 111.699 -171.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.14 -40.59 96.48 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.866 -0.733 . . . . 29.19 111.058 -177.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 91.8 m -62.54 -53.77 49.76 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 120.684 -0.406 . . . . 33.34 110.584 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -50.69 -39.75 52.14 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 120.673 0.273 . . . . 22.42 111.414 178.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -70.76 -38.69 73.49 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.382 -0.927 . . . . 25.04 111.2 -177.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -58.67 -43.62 89.97 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.168 -0.613 . . . . 41.45 110.611 175.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 19.1 t -62.18 -50.81 78.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-O 121.283 0.564 . . . . 24.1 110.53 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' PHE . . . . . . . . . . . . . 11.7 m-30 -62.47 -33.6 75.16 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.847 -0.341 . . . . 19.3 111.546 -178.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 63.7 mttt -73.03 -30.49 63.78 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.81 -0.756 . . . . 22.14 111.848 -177.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -76.65 -45.11 31.2 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 119.455 -0.898 . . . . 38.04 111.403 174.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' TYR . . . . . 0.503 ' O ' ' ND2' ' B' ' 37' ' ' ASN . 66.1 t80 -52.1 -48.35 64.81 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.206 0.527 . . . . 24.46 111.175 174.175 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.74 -47.37 81.33 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.583 -0.447 . . . . 24.51 110.887 -177.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -68.5 -40.35 80.93 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 120.639 -0.424 . . . . 39.74 111.533 -178.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -55.12 -39.3 69.23 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.663 0.268 . . . . 35.89 111.288 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ASN . . . . . 0.503 ' ND2' ' O ' ' B' ' 33' ' ' TYR . 59.7 m-80 -98.27 17.84 17.75 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 122.792 0.437 . . . . 31.7 111.803 -172.075 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.11 32.71 51.82 Favored Glycine 0 C--O 1.238 0.393 0 N-CA-C 115.791 1.076 . . . . 33.26 115.791 172.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 61.6 t -121.1 102.97 13.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 N-CA-C 107.745 -1.206 . . . . 28.58 107.745 178.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -119.45 135.79 54.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.941 -0.763 . . . . 38.98 108.941 175.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . 177.69 -159.73 25.83 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 119.98 -1.105 . . . . 24.6 111.346 -179.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -87.16 140.56 29.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 114.903 -0.649 . . . . 42.84 110.936 -176.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' TRP . . . . . . . . . . . . . 55.0 m95 -109.83 138.82 45.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.832 0.348 . . . . 19.42 111.586 -177.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 44.4 p -138.11 160.06 40.39 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.082 -0.71 . . . . 21.19 109.082 166.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -130.22 130.33 44.5 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.025 -0.989 . . . . 23.17 109.272 -176.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -101.71 94.92 6.09 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 106.209 -1.775 . . . . 26.74 106.209 169.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 30.3 p30 -67.73 -12.05 59.69 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 119.059 -1.056 . . . . 24.67 112.603 -178.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.68 -29.86 59.19 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 118.064 0.393 . . . . 24.25 111.977 176.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 64.2 p -115.04 6.06 15.12 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 112.001 0.371 . . . . 26.64 112.001 177.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 47.83 45.36 18.57 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.736 0.779 . . . . 37.39 110.227 -178.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' THR . . . . . . . . . . . . . 51.9 m -121.38 123.26 41.69 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.063 -0.971 . . . . 21.85 108.528 -177.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -92.67 149.98 20.98 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.578 -0.527 . . . . 18.7 109.578 168.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 85.6 m -125.51 127.41 46.41 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.533 -0.758 . . . . 14.81 109.177 169.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 7.5 p -107.84 131.61 57.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 107.629 -1.248 . . . . 15.25 107.629 165.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 52.1 m -122.68 120.78 34.7 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 108.206 -1.035 . . . . 18.57 108.206 -177.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 . . . . . 0 CA--C 1.516 -0.341 0 CA-C-O 121.257 0.551 . . . . 36.37 111.255 -179.063 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 110.693 -0.114 . . . . 36.95 110.693 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 38.5 m -90.1 120.64 31.45 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 109.226 -0.657 . . . . 25.44 109.226 169.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -109.42 153.14 24.43 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.826 -0.805 . . . . 22.98 108.826 174.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.508 ' HG2' HG22 ' A' ' 17' ' ' THR . 51.2 mttp -119.47 150.03 40.89 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.886 -0.597 . . . . 27.51 110.508 -177.254 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -124.64 123.4 39.96 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.403 -0.817 . . . . 11.68 109.017 177.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.0 mm -100.12 125.85 53.75 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 N-CA-C 106.918 -1.512 . . . . 18.78 106.918 169.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.9 mp -113.06 115.8 28.91 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 107.916 -1.142 . . . . 14.97 107.916 178.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -112.43 108.9 18.21 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 107.559 -1.274 . . . . 26.14 107.559 -177.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.87 58.65 0.4 Allowed Glycine 0 CA--C 1.52 0.402 0 CA-C-O 121.456 0.476 . . . . 29.44 112.087 177.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.5 m -86.89 -12.57 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 115.988 -0.551 . . . . 27.72 109.767 179.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 16.0 mt -106.91 142.6 36.28 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.031 0.532 . . . . 22.67 110.416 -178.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . . . -138.67 157.6 45.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.889 -0.596 . . . . 16.36 109.686 -176.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -158.33 173.46 35.45 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 108.956 -1.657 . . . . 16.87 108.956 179.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -160.97 160.65 31.01 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 118.761 -1.176 . . . . 40.39 108.49 178.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.5 t -163.29 174.39 12.11 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.047 -1.094 . . . . 17.89 108.047 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' THR . . . . . 0.508 HG22 ' HG2' ' A' ' 4' ' ' LYS . 82.5 p -136.76 164.12 29.02 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.589 0.709 . . . . 21.74 109.604 178.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 5.3 t -149.69 154.05 37.95 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.214 -1.032 . . . . 20.9 108.214 170.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -93.49 137.29 32.92 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.59 -0.732 . . . . 28.84 109.08 168.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -160.49 159.69 31.1 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.322 -0.621 . . . . 22.13 109.322 179.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 15.3 m -77.37 -31.23 17.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 115.231 -0.895 . . . . 28.36 111.881 -176.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -149.08 178.9 8.3 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.661 -0.866 . . . . 27.91 108.661 177.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.48 -37.95 59.89 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 115.687 -0.688 . . . . 23.73 111.579 -171.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.23 -39.63 83.32 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.971 -0.691 . . . . 21.84 111.335 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 90.9 m -69.2 -43.23 74.58 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 119.324 -0.95 . . . . 24.21 111.282 179.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.92 -38.41 75.85 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 120.278 -0.569 . . . . 16.32 111.473 176.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.3 tt0 -68.88 -36.87 78.6 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.7 -0.8 . . . . 28.36 111.64 -178.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.9 ttmp? -58.93 -43.37 91.15 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-O 121.214 0.531 . . . . 29.69 110.8 174.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.536 HG13 HG21 ' B' ' 10' ' ' DVA . 17.2 t -65.63 -42.55 93.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-O 121.229 0.538 . . . . 20.81 110.38 178.122 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -68.64 -36.36 78.48 Favored 'General case' 0 C--O 1.235 0.297 0 O-C-N 122.174 -0.329 . . . . 14.94 111.434 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -71.52 -31.21 66.8 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 120.027 -0.669 . . . . 24.89 111.21 -178.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -73.82 -42.73 60.49 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.36 -0.536 . . . . 41.1 111.006 176.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -61.13 -46.85 88.89 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 121.162 0.506 . . . . 24.13 111.61 176.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.61 -45.34 94.37 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.017 -0.427 . . . . 19.16 111.109 179.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -70.55 -44.42 67.52 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.892 -0.323 . . . . 35.27 111.361 -177.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -53.48 -28.01 28.37 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 111.748 0.277 . . . . 25.34 111.748 175.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -108.18 16.08 23.59 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 112.202 0.445 . . . . 23.9 112.202 -171.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.58 19.58 65.79 Favored Glycine 0 N--CA 1.45 -0.43 0 N-CA-C 116.15 1.22 . . . . 23.98 116.15 172.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 42.8 t -115.49 107.21 22.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 118.743 1.271 . . . . 21.91 108.105 -175.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -125.85 138.76 53.83 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.172 -0.677 . . . . 36.7 109.172 179.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 172.97 -153.07 17.54 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 119.77 -1.205 . . . . 22.65 111.648 177.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -88.06 131.84 34.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.546 -0.827 . . . . 39.38 110.608 -172.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 64.2 m95 -104.17 138.88 40.02 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.016 0.436 . . . . 20.33 111.169 -178.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.4 p -141.49 159.11 42.89 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.006 -0.739 . . . . 20.71 109.006 171.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -130.35 134.92 47.53 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 115.277 -0.874 . . . . 20.42 110.467 -177.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -106.48 96.72 6.66 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 106.313 -1.736 . . . . 25.47 106.313 170.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 42.6 p30 -68.43 -13.81 62.56 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.855 -0.738 . . . . 22.28 112.381 -179.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.51 -27.59 51.82 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 119.42 -0.912 . . . . 23.21 111.73 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 68.4 p -112.95 1.96 15.63 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 112.653 0.612 . . . . 22.43 112.653 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.1 mttp 51.23 48.59 22.73 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.527 0.68 . . . . 31.81 110.107 -177.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 74.2 m -127.07 124.62 39.69 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.202 -0.908 . . . . 17.76 109.151 -175.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -94.48 149.78 20.9 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.381 -0.6 . . . . 18.19 109.381 170.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.6 m -124.66 132.37 53.41 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 109.093 -0.706 . . . . 13.18 109.093 167.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 6.7 p -110.07 128.36 66.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 N-CA-C 107.298 -1.371 . . . . 15.03 107.298 166.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 97.1 m -121.2 119.06 31.24 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.25 -1.018 . . . . 18.18 108.25 -173.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 . . . . . 0 C--N 1.328 -0.328 0 O-C-N 123.333 0.396 . . . . 32.81 110.695 177.013 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 . . . . . 0 C--O 1.236 0.352 0 N-CA-C 109.737 -0.468 . . . . 46.49 109.737 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 68.9 m -91.4 120.07 31.94 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 123.959 0.787 . . . . 27.05 109.413 173.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -108.49 155.18 20.9 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.544 -0.91 . . . . 26.92 108.544 174.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.616 ' HG2' HG22 ' B' ' 17' ' ' THR . 45.6 mttp -118.64 151.43 37.95 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.246 0.546 . . . . 33.44 110.631 -178.034 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 62.9 tp -124.56 122.79 38.54 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.191 -0.913 . . . . 13.23 108.826 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 20.2 mm -99.42 126.64 52.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 107.411 -1.329 . . . . 17.91 107.411 167.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 4.5 mp -112.58 112.5 24.07 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.843 -1.169 . . . . 17.48 107.843 177.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 60.0 t-20 -106.04 106.31 16.76 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.599 -1.63 . . . . 27.08 106.599 178.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . -96.35 0.41 61.74 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 114.834 0.694 . . . . 34.2 114.834 -176.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' DVA . . . . . 0.536 HG21 HG13 ' A' ' 29' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 17.5 m -85.13 -12.43 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 CA-C-N 115.452 -0.794 . . . . 26.19 109.21 172.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 58.4 mt -105.49 138.17 42.12 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 110.018 -0.364 . . . . 20.63 110.018 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' LYS . . . . . . . . . . . . . 10.8 mmtm -131.81 155.58 47.54 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.435 0.636 . . . . 30.05 110.563 -176.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -154.98 167.52 32.77 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 109.949 -1.26 . . . . 17.42 109.949 -179.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 -155.89 161.26 40.59 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 118.465 -1.294 . . . . 43.53 109.63 172.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' THR . . . . . . . . . . . . . 13.1 t -162.36 173.33 14.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.883 -1.053 . . . . 17.08 108.35 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' THR . . . . . 0.616 HG22 ' HG2' ' B' ' 4' ' ' LYS . 65.2 p -137.11 162.62 32.89 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 115.417 -0.81 . . . . 22.95 109.441 -179.67 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 3.7 t -149.45 158.01 43.8 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 107.124 -1.435 . . . . 27.44 107.124 173.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -106.92 134.38 50.15 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.457 -1.312 . . . . 35.77 107.457 174.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -161.55 156.47 23.41 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.41 0.624 . . . . 28.56 109.66 -174.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 9.2 p -78.34 -25.24 13.83 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 CA-C-N 114.915 -1.039 . . . . 37.87 111.434 -173.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ASP . . . . . . . . . . . . . 28.6 p30 -155.23 173.89 15.99 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 121.535 0.683 . . . . 37.98 109.473 175.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.31 -33.77 73.66 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 114.937 -1.029 . . . . 27.72 111.699 -171.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.14 -40.59 96.48 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.866 -0.733 . . . . 29.19 111.058 -177.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 91.8 m -62.54 -53.77 49.76 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 120.684 -0.406 . . . . 33.34 110.584 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -50.69 -39.75 52.14 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 120.673 0.273 . . . . 22.42 111.414 178.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -70.76 -38.69 73.49 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.382 -0.927 . . . . 25.04 111.2 -177.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -58.67 -43.62 89.97 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.168 -0.613 . . . . 41.45 110.611 175.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 19.1 t -62.18 -50.81 78.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-O 121.283 0.564 . . . . 24.1 110.53 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' PHE . . . . . . . . . . . . . 11.7 m-30 -62.47 -33.6 75.16 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.847 -0.341 . . . . 19.3 111.546 -178.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 63.7 mttt -73.03 -30.49 63.78 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.81 -0.756 . . . . 22.14 111.848 -177.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -76.65 -45.11 31.2 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 119.455 -0.898 . . . . 38.04 111.403 174.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.503 ' O ' ' ND2' ' B' ' 37' ' ' ASN . 66.1 t80 -52.1 -48.35 64.81 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.206 0.527 . . . . 24.46 111.175 174.175 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.74 -47.37 81.33 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.583 -0.447 . . . . 24.51 110.887 -177.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -68.5 -40.35 80.93 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 120.639 -0.424 . . . . 39.74 111.533 -178.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -55.12 -39.3 69.23 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.663 0.268 . . . . 35.89 111.288 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.503 ' ND2' ' O ' ' B' ' 33' ' ' TYR . 59.7 m-80 -98.27 17.84 17.75 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 122.792 0.437 . . . . 31.7 111.803 -172.075 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.11 32.71 51.82 Favored Glycine 0 C--O 1.238 0.393 0 N-CA-C 115.791 1.076 . . . . 33.26 115.791 172.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 61.6 t -121.1 102.97 13.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 N-CA-C 107.745 -1.206 . . . . 28.58 107.745 178.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -119.45 135.79 54.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.941 -0.763 . . . . 38.98 108.941 175.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . 177.69 -159.73 25.83 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 119.98 -1.105 . . . . 24.6 111.346 -179.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -87.16 140.56 29.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 114.903 -0.649 . . . . 42.84 110.936 -176.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' TRP . . . . . . . . . . . . . 55.0 m95 -109.83 138.82 45.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.832 0.348 . . . . 19.42 111.586 -177.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 44.4 p -138.11 160.06 40.39 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.082 -0.71 . . . . 21.19 109.082 166.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -130.22 130.33 44.5 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.025 -0.989 . . . . 23.17 109.272 -176.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -101.71 94.92 6.09 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 106.209 -1.775 . . . . 26.74 106.209 169.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 30.3 p30 -67.73 -12.05 59.69 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 119.059 -1.056 . . . . 24.67 112.603 -178.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.68 -29.86 59.19 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 118.064 0.393 . . . . 24.25 111.977 176.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 64.2 p -115.04 6.06 15.12 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 112.001 0.371 . . . . 26.64 112.001 177.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 47.83 45.36 18.57 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.736 0.779 . . . . 37.39 110.227 -178.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' THR . . . . . . . . . . . . . 51.9 m -121.38 123.26 41.69 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.063 -0.971 . . . . 21.85 108.528 -177.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -92.67 149.98 20.98 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.578 -0.527 . . . . 18.7 109.578 168.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 85.6 m -125.51 127.41 46.41 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.533 -0.758 . . . . 14.81 109.177 169.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 7.5 p -107.84 131.61 57.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 107.629 -1.248 . . . . 15.25 107.629 165.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 52.1 m -122.68 120.78 34.7 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 108.206 -1.035 . . . . 18.57 108.206 -177.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 . . . . . 0 CA--C 1.516 -0.341 0 CA-C-O 121.257 0.551 . . . . 36.37 111.255 -179.063 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_