data_4dzn_residue 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 4dzn _Structure_validation_residue.Date_analyzed 2016-10-12 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 ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.261 . . . . . . . . 32.420000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 75.21 -153.46 44.94 Favored Glycine 0 C--N 1.341 0.85 0 C-N-CA 120.904 -0.665 . . . . 23.32 113.414 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -66.53 -34.54 78.13 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.805 1.039 . . . . 25.52 113.805 -177.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 28.9 mm -63.56 -43.84 98.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 O-C-N 121.626 -0.672 . . . . 25.300000000000001 109.442 177.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.55 -38.67 88.33 Favored 'General case' 0 C--O 1.248 1.004 0 O-C-N 123.474 0.484 . . . . 18.010000000000002 111.273 176.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.49 -41.78 98.54 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.679 0.622 . . . . 15.19 112.679 177.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 69.9 mt -63.2 -41.47 99.18 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 123.082 0.553 . . . . 21.579999999999998 111.368 175.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -60.12 -42.16 94.17 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 111.717 0.265 . . . . 24.129999999999999 111.717 174.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -61.53 -38.22 86.61 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 120.68 0.276 . . . . 49.0 111.577 174.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -61.7 -44.81 96.22 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 122.313 -0.242 . . . . 28.780000000000001 111.241 176.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.5 mm -62.64 -42.95 98.0 Favored 'Isoleucine or valine' 0 C--O 1.252 1.2 0 N-CA-C 109.434 -0.58 . . . . 27.289999999999999 109.434 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.02 -43.07 99.43 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 109.86 -0.422 . . . . 13.640000000000001 109.86 -179.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.67 97.88 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 116.11 -0.495 . . . . 11.619999999999999 112.04 177.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 94.3 mt -65.24 -39.63 92.95 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 120.416 -0.514 . . . . 25.170000000000002 110.643 177.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -59.39 -44.05 92.84 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-O 121.25 0.548 . . . . 26.010000000000002 110.726 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -64.39 -38.92 92.74 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.594 -0.73 . . . . 16.879999999999999 111.896 178.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -61.79 -40.87 96.72 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 120.324 -0.55 . . . . 20.0 111.229 174.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 34.0 mt -68.26 -44.12 84.13 Favored 'Isoleucine or valine' 0 C--O 1.258 1.522 0 N-CA-C 109.229 -0.656 . . . . 18.32 109.229 -176.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.86 -44.59 82.35 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 115.648 -0.706 . . . . 12.6 110.656 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.46 86.75 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 123.73 0.644 . . . . 10.99 110.704 178.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.8 mt -68.65 -37.02 79.35 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.345 -0.613 . . . . 23.440000000000001 109.345 -179.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -60.32 -42.5 95.72 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 120.291 -0.564 . . . . 27.620000000000001 112.313 175.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -60.01 -43.47 95.23 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 112.287 0.477 . . . . 27.48 112.287 178.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.3 mt -62.84 -43.0 98.54 Favored 'Isoleucine or valine' 0 C--O 1.246 0.914 0 C-N-CA 123.049 0.539 . . . . 24.82 111.117 177.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.47 -46.55 76.83 Favored 'General case' 0 C--O 1.247 0.965 0 O-C-N 123.418 0.449 . . . . 10.59 111.339 176.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.26 -42.43 98.61 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 124.367 1.042 . . . . 10.539999999999999 111.425 178.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.4 mt -63.72 -38.99 93.17 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 112.027 0.38 . . . . 12.77 112.027 177.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -66.14 -39.67 90.02 Favored 'General case' 0 C--O 1.243 0.731 0 O-C-N 123.602 0.564 . . . . 25.920000000000002 111.46 175.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.8 tp60 -60.44 -45.61 93.03 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.486 -0.486 . . . . 16.030000000000001 111.075 177.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.38 -33.93 86.42 Favored Glycine 0 C--O 1.212 -1.268 0 CA-C-N 115.619 -0.718 . . . . 12.76 114.623 175.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -73.63 -53.63 10.01 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 122.046 -0.679 . . . . 18.629999999999999 112.225 -178.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 . . . . . 0 C--O 1.254 1.322 0 N-CA-C 111.931 0.345 . . . . 21.690000000000001 111.931 -175.905 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.113 . . . . . . . . 35.380000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . -106.23 -154.96 21.07 Favored Glycine 0 CA--C 1.528 0.886 0 O-C-N 121.495 -0.753 . . . . 20.649999999999999 111.936 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -62.48 -37.9 87.76 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.587 0.588 . . . . 34.299999999999997 112.587 -174.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 30.2 mm -67.63 -44.05 86.43 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 120.491 -0.483 . . . . 25.469999999999999 110.436 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.33 -41.74 85.24 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.926 -0.31 . . . . 15.75 111.734 175.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -61.06 -44.26 97.64 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 122.337 0.255 . . . . 19.41 110.716 177.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 24.1 mt -65.51 -38.99 91.32 Favored 'General case' 0 C--O 1.24 0.581 0 O-C-N 123.464 0.477 . . . . 27.289999999999999 109.72 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -62.33 -36.15 81.31 Favored 'General case' 0 C--O 1.258 1.509 0 C-N-CA 120.533 -0.467 . . . . 28.16 110.79 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -69.7 -41.37 75.48 Favored 'General case' 0 C--N 1.343 0.307 0 O-C-N 123.568 0.543 . . . . 29.239999999999998 110.496 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -59.26 -46.03 89.61 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.226 0.536 . . . . 30.52 111.476 174.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 71.5 mt -61.42 -40.98 88.16 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.76 0 CA-C-N 116.352 -0.386 . . . . 30.84 111.235 178.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.57 -42.48 96.74 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 122.616 0.366 . . . . 15.140000000000001 111.448 177.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.25 -46.16 88.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.952 -0.567 . . . . 15.33 110.816 177.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 79.5 mt -59.27 -40.9 87.55 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 116.69 -0.232 . . . . 33.990000000000002 111.187 178.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -61.44 -40.38 94.25 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.499 0.926 . . . . 27.52 113.499 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -61.89 -44.2 97.29 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.436 0.295 . . . . 40.579999999999998 111.703 172.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -59.07 -44.67 91.88 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.096 0.475 . . . . 30.66 111.966 176.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ILE . . . . . . . . . . . . . 13.7 mm -62.08 -43.22 97.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.4 -0.364 . . . . 25.780000000000001 111.619 177.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.11 -42.88 86.7 Favored 'General case' 0 C--O 1.248 0.994 0 CA-C-O 121.144 0.497 . . . . 13.92 110.904 178.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.31 -44.87 90.23 Favored 'General case' 0 C--O 1.247 0.963 0 CA-C-N 115.745 -0.661 . . . . 12.970000000000001 109.934 -178.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 85.5 mt -61.07 -38.75 87.33 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.131 0.789 . . . . 28.399999999999999 113.131 177.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -65.46 -41.67 93.16 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.055 -0.721 . . . . 31.219999999999999 109.055 -178.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -62.6 -43.81 97.87 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.777 0.322 . . . . 44.280000000000001 111.847 179.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 34.7 mm -64.78 -41.23 91.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 CA-C-N 116.553 -0.294 . . . . 30.809999999999999 111.74 177.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.15 -42.61 91.13 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.919 0.39 . . . . 13.119999999999999 110.74 176.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.52 -42.61 82.52 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.053 -0.521 . . . . 13.67 111.65 -179.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 47.6 mt -64.07 -36.48 84.16 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 120.79 0.329 . . . . 17.57 111.055 178.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -61.88 -41.5 97.95 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.602 -0.839 . . . . 26.68 111.023 177.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -62.41 -42.66 99.6 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-O 121.095 0.474 . . . . 33.799999999999997 110.628 174.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.18 -46.21 94.95 Favored Glycine 0 N--CA 1.47 0.946 0 CA-C-N 115.776 -0.647 . . . . 12.94 112.358 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -83.3 -33.21 25.99 Favored 'General case' 0 C--O 1.245 0.826 0 N-CA-C 112.176 0.435 . . . . 17.140000000000001 112.176 -172.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 . . . . . 0 N--CA 1.486 1.348 0 N-CA-C 114.835 1.42 . . . . 27.0 114.835 -175.975 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.214 . . . . . . . . 19.41 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' GLY . . . . . . . . . . . . . . . -54.16 -47.31 68.0 Favored Glycine 0 C--O 1.243 0.674 0 O-C-N 121.392 -0.817 . . . . 18.41 113.92 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -64.31 -37.03 86.06 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.399 0.619 . . . . 48.049999999999997 111.162 -178.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 47.4 mt -64.29 -46.64 92.64 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 N-CA-C 112.988 0.736 . . . . 19.260000000000002 112.988 174.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.59 -43.91 80.56 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 122.116 -0.365 . . . . 15.41 111.874 173.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.69 -44.28 96.65 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 112.241 0.46 . . . . 19.390000000000001 112.241 179.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' LEU . . . . . . . . . . . . . 13.8 mt -57.68 -44.88 86.08 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.773 0.671 . . . . 28.27 110.552 175.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -64.05 -36.99 85.8 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.814 -0.554 . . . . 19.760000000000002 112.102 178.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -64.6 -40.09 94.9 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 122.014 -0.428 . . . . 41.030000000000001 110.321 176.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -64.64 -40.82 96.12 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 116.091 -0.504 . . . . 28.760000000000002 110.636 179.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' ILE . . . . . . . . . . . . . 85.9 mt -61.69 -43.07 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 116.387 -0.369 . . . . 13.82 111.995 174.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.29 -39.81 91.82 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-N 116.458 -0.337 . . . . 13.9 110.627 177.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.56 -38.34 83.98 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 116.461 -0.336 . . . . 13.82 111.363 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 80.9 mt -65.06 -39.04 92.68 Favored 'General case' 0 C--O 1.244 0.767 0 O-C-N 122.49 -0.131 . . . . 25.579999999999998 111.105 177.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.87 -39.97 93.76 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 120.789 -0.364 . . . . 31.870000000000001 111.671 176.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' LYS . . . . . . . . . . . . . 25.4 ttpp -64.63 -43.95 92.07 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 112.168 0.433 . . . . 44.649999999999999 112.168 175.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -61.62 -42.62 99.15 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 122.034 -0.417 . . . . 26.809999999999999 111.186 176.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' ILE . . . . . . . . . . . . . 44.7 mt -61.81 -43.34 97.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 110.226 -0.287 . . . . 18.190000000000001 110.226 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.76 -44.15 90.51 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 111.88 0.326 . . . . 12.65 111.88 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.05 -42.16 94.52 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 123.519 0.512 . . . . 10.970000000000001 110.288 -178.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 66.3 mt -62.53 -42.74 99.72 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.6 0.593 . . . . 28.0 112.6 176.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -58.8 -43.21 90.48 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 108.244 -1.021 . . . . 24.300000000000001 108.244 179.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' GLU . . . . . . . . . . . . . 65.2 mm-40 -60.58 -40.84 93.2 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 112.674 0.62 . . . . 27.07 112.674 179.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' ILE . . . . . . . . . . . . . 63.2 mt -66.03 -46.66 87.46 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.533 0 CA-C-N 116.05 -0.523 . . . . 21.109999999999999 111.997 177.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.18 -40.59 96.53 Favored 'General case' 0 C--O 1.25 1.124 0 N-CA-C 109.628 -0.508 . . . . 15.16 109.628 -179.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.17 -46.71 85.84 Favored 'General case' 0 C--O 1.254 1.301 0 N-CA-C 112.373 0.509 . . . . 16.309999999999999 112.373 177.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' LEU . . . . . . . . . . . . . 15.1 tp -63.01 -39.29 94.33 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-N 115.823 -0.626 . . . . 26.079999999999998 112.554 -179.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -60.7 -29.85 69.58 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 120.654 0.264 . . . . 17.899999999999999 110.887 -178.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 -102.08 -1.81 30.8 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 114.546 1.313 . . . . 29.079999999999998 114.546 -178.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 61.58 42.1 99.7 Favored Glycine 0 C--O 1.242 0.641 0 N-CA-C 110.341 -1.103 . . . . 14.35 110.341 -175.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -109.22 113.84 27.02 Favored 'General case' 0 C--O 1.245 0.841 0 CA-C-O 121.672 0.749 . . . . 23.149999999999999 109.536 177.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' TYR . . . . . . . . . . . . . 6.7 p90 . . . . . 0 C--N 1.321 -0.64 0 CA-C-O 117.065 -1.445 . . . . 31.699999999999999 110.157 176.836 . . . . . . . . 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 ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' 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 orig full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.261 . . . . . . . . 32.420000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 75.21 -153.46 44.94 Favored Glycine 0 C--N 1.341 0.85 0 C-N-CA 120.904 -0.665 . . . . 23.32 113.414 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -66.53 -34.54 78.13 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.805 1.039 . . . . 25.52 113.805 -177.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 28.9 mm -63.56 -43.84 98.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 O-C-N 121.626 -0.672 . . . . 25.34 109.442 177.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.55 -38.67 88.33 Favored 'General case' 0 C--O 1.248 1.004 0 O-C-N 123.474 0.484 . . . . 18.010000000000002 111.273 176.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.49 -41.78 98.54 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.679 0.622 . . . . 15.19 112.679 177.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 69.9 mt -63.2 -41.47 99.18 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 123.082 0.553 . . . . 21.579999999999998 111.368 175.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -60.12 -42.16 94.17 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 111.717 0.265 . . . . 24.129999999999999 111.717 174.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -61.53 -38.22 86.61 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 120.68 0.276 . . . . 49.0 111.577 174.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -61.7 -44.81 96.22 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 122.313 -0.242 . . . . 28.780000000000001 111.241 176.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.5 mm -62.64 -42.95 98.0 Favored 'Isoleucine or valine' 0 C--O 1.252 1.2 0 N-CA-C 109.434 -0.58 . . . . 27.289999999999999 109.434 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.02 -43.07 99.43 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 109.86 -0.422 . . . . 13.640000000000001 109.86 -179.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.67 97.88 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 116.11 -0.495 . . . . 11.619999999999999 112.04 177.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . 0.464 HD22 HD12 ' C' ' 17' ' ' ILE . 94.3 mt -65.24 -39.63 92.95 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 120.416 -0.514 . . . . 25.170000000000002 110.643 177.947 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -59.39 -44.05 92.84 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-O 121.25 0.548 . . . . 26.010000000000002 110.726 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -64.39 -38.92 92.74 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.594 -0.73 . . . . 16.879999999999999 111.896 178.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -61.79 -40.87 96.72 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 120.324 -0.55 . . . . 20.0 111.229 174.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ILE . . . . . 0.638 HD12 HD22 ' B' ' 13' ' ' LEU . 34.0 mt -68.26 -44.12 84.13 Favored 'Isoleucine or valine' 0 C--O 1.258 1.522 0 N-CA-C 109.229 -0.656 . . . . 18.32 109.229 -176.549 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.86 -44.59 82.35 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 115.648 -0.706 . . . . 12.6 110.656 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.46 86.75 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 123.73 0.644 . . . . 10.99 110.704 178.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . 0.642 HD22 HD12 ' C' ' 24' ' ' ILE . 93.8 mt -68.65 -37.02 79.35 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.345 -0.613 . . . . 23.440000000000001 109.345 -179.114 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -60.32 -42.5 95.72 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 120.291 -0.564 . . . . 27.620000000000001 112.313 175.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -60.01 -43.47 95.23 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 112.287 0.477 . . . . 27.48 112.287 178.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ILE . . . . . 0.669 HD12 HD22 ' B' ' 20' ' ' LEU . 45.3 mt -62.84 -43.0 98.54 Favored 'Isoleucine or valine' 0 C--O 1.246 0.914 0 C-N-CA 123.049 0.539 . . . . 24.82 111.117 177.619 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.47 -46.55 76.83 Favored 'General case' 0 C--O 1.247 0.965 0 O-C-N 123.418 0.449 . . . . 10.59 111.339 176.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.26 -42.43 98.61 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 124.367 1.042 . . . . 10.539999999999999 111.425 178.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.4 mt -63.72 -38.99 93.17 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 112.027 0.38 . . . . 12.77 112.027 177.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -66.14 -39.67 90.02 Favored 'General case' 0 C--O 1.243 0.731 0 O-C-N 123.602 0.564 . . . . 25.920000000000002 111.46 175.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.8 tp60 -60.44 -45.61 93.03 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.486 -0.486 . . . . 16.030000000000001 111.075 177.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.38 -33.93 86.42 Favored Glycine 0 C--O 1.212 -1.268 0 CA-C-N 115.619 -0.718 . . . . 12.76 114.623 175.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -73.63 -53.63 10.01 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 122.046 -0.679 . . . . 18.629999999999999 112.225 -178.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 . . . . . 0 C--O 1.254 1.322 0 N-CA-C 111.931 0.345 . . . . 21.690000000000001 111.931 -175.905 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.113 . . . . . . . . 35.380000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . -106.23 -154.96 21.07 Favored Glycine 0 CA--C 1.528 0.886 0 O-C-N 121.495 -0.753 . . . . 20.649999999999999 111.936 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -62.48 -37.9 87.76 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.587 0.588 . . . . 34.299999999999997 112.587 -174.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 30.2 mm -67.63 -44.05 86.43 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 120.491 -0.483 . . . . 25.469999999999999 110.436 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.33 -41.74 85.24 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.926 -0.31 . . . . 15.75 111.734 175.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -61.06 -44.26 97.64 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 122.337 0.255 . . . . 19.41 110.716 177.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 24.1 mt -65.51 -38.99 91.32 Favored 'General case' 0 C--O 1.24 0.581 0 O-C-N 123.464 0.477 . . . . 27.289999999999999 109.72 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -62.33 -36.15 81.31 Favored 'General case' 0 C--O 1.258 1.509 0 C-N-CA 120.533 -0.467 . . . . 28.16 110.79 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -69.7 -41.37 75.48 Favored 'General case' 0 C--N 1.343 0.307 0 O-C-N 123.568 0.543 . . . . 29.239999999999998 110.496 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -59.26 -46.03 89.61 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.226 0.536 . . . . 30.52 111.476 174.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 71.5 mt -61.42 -40.98 88.16 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.76 0 CA-C-N 116.352 -0.386 . . . . 30.84 111.235 178.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.57 -42.48 96.74 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 122.616 0.366 . . . . 15.140000000000001 111.448 177.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.25 -46.16 88.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.952 -0.567 . . . . 15.33 110.816 177.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' LEU . . . . . 0.638 HD22 HD12 ' A' ' 17' ' ' ILE . 79.5 mt -59.27 -40.9 87.55 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 116.69 -0.232 . . . . 33.990000000000002 111.187 178.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -61.44 -40.38 94.25 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.499 0.926 . . . . 27.52 113.499 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -61.89 -44.2 97.29 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.436 0.295 . . . . 40.579999999999998 111.703 172.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -59.07 -44.67 91.88 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.096 0.475 . . . . 30.66 111.966 176.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ILE . . . . . . . . . . . . . 13.7 mm -62.08 -43.22 97.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.4 -0.364 . . . . 25.780000000000001 111.619 177.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.11 -42.88 86.7 Favored 'General case' 0 C--O 1.248 0.994 0 CA-C-O 121.144 0.497 . . . . 13.92 110.904 178.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.31 -44.87 90.23 Favored 'General case' 0 C--O 1.247 0.963 0 CA-C-N 115.745 -0.661 . . . . 12.970000000000001 109.934 -178.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' LEU . . . . . 0.669 HD22 HD12 ' A' ' 24' ' ' ILE . 85.5 mt -61.07 -38.75 87.33 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.131 0.789 . . . . 28.399999999999999 113.131 177.643 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -65.46 -41.67 93.16 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.055 -0.721 . . . . 31.219999999999999 109.055 -178.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -62.6 -43.81 97.87 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.777 0.322 . . . . 44.280000000000001 111.847 179.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 34.7 mm -64.78 -41.23 91.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 CA-C-N 116.553 -0.294 . . . . 30.809999999999999 111.74 177.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.15 -42.61 91.13 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.919 0.39 . . . . 13.119999999999999 110.74 176.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.52 -42.61 82.52 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.053 -0.521 . . . . 13.67 111.65 -179.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 47.6 mt -64.07 -36.48 84.16 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 120.79 0.329 . . . . 17.57 111.055 178.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -61.88 -41.5 97.95 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.602 -0.839 . . . . 26.68 111.023 177.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -62.41 -42.66 99.6 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-O 121.095 0.474 . . . . 33.799999999999997 110.628 174.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.18 -46.21 94.95 Favored Glycine 0 N--CA 1.47 0.946 0 CA-C-N 115.776 -0.647 . . . . 12.94 112.358 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -83.3 -33.21 25.99 Favored 'General case' 0 C--O 1.245 0.826 0 N-CA-C 112.176 0.435 . . . . 17.140000000000001 112.176 -172.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 . . . . . 0 N--CA 1.486 1.348 0 N-CA-C 114.835 1.42 . . . . 27.0 114.835 -175.975 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.214 . . . . . . . . 19.41 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 1' ' ' GLY . . . . . . . . . . . . . . . -54.16 -47.31 68.0 Favored Glycine 0 C--O 1.243 0.674 0 O-C-N 121.392 -0.817 . . . . 18.41 113.92 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 2' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -64.31 -37.03 86.06 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.399 0.619 . . . . 48.049999999999997 111.162 -178.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 47.4 mt -64.29 -46.64 92.64 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 N-CA-C 112.988 0.736 . . . . 19.260000000000002 112.988 174.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.59 -43.91 80.56 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 122.116 -0.365 . . . . 15.41 111.874 173.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.69 -44.28 96.65 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 112.241 0.46 . . . . 19.390000000000001 112.241 179.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' LEU . . . . . . . . . . . . . 13.8 mt -57.68 -44.88 86.08 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.773 0.671 . . . . 28.27 110.552 175.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -64.05 -36.99 85.8 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.814 -0.554 . . . . 19.760000000000002 112.102 178.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 8' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -64.6 -40.09 94.9 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 122.014 -0.428 . . . . 41.030000000000001 110.321 176.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -64.64 -40.82 96.12 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 116.091 -0.504 . . . . 28.760000000000002 110.636 179.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' ILE . . . . . . . . . . . . . 85.9 mt -61.69 -43.07 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 116.387 -0.369 . . . . 13.82 111.995 174.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.29 -39.81 91.82 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-N 116.458 -0.337 . . . . 13.9 110.627 177.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.56 -38.34 83.98 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 116.461 -0.336 . . . . 13.82 111.363 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 80.9 mt -65.06 -39.04 92.68 Favored 'General case' 0 C--O 1.244 0.767 0 O-C-N 122.49 -0.131 . . . . 25.579999999999998 111.105 177.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.87 -39.97 93.76 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 120.789 -0.364 . . . . 31.870000000000001 111.671 176.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' LYS . . . . . . . . . . . . . 25.4 ttpp -64.63 -43.95 92.07 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 112.168 0.433 . . . . 44.649999999999999 112.168 175.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -61.62 -42.62 99.15 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 122.034 -0.417 . . . . 26.809999999999999 111.186 176.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' ILE . . . . . 0.464 HD12 HD22 ' A' ' 13' ' ' LEU . 44.7 mt -61.81 -43.34 97.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 110.226 -0.287 . . . . 18.190000000000001 110.226 178.833 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.76 -44.15 90.51 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 111.88 0.326 . . . . 12.65 111.88 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.05 -42.16 94.52 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 123.519 0.512 . . . . 10.970000000000001 110.288 -178.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 66.3 mt -62.53 -42.74 99.72 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.6 0.593 . . . . 28.0 112.6 176.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -58.8 -43.21 90.48 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 108.244 -1.021 . . . . 24.300000000000001 108.244 179.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 23' ' ' GLU . . . . . . . . . . . . . 65.2 mm-40 -60.58 -40.84 93.2 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 112.674 0.62 . . . . 27.07 112.674 179.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' ILE . . . . . 0.642 HD12 HD22 ' A' ' 20' ' ' LEU . 63.2 mt -66.03 -46.66 87.46 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.533 0 CA-C-N 116.05 -0.523 . . . . 21.109999999999999 111.997 177.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.18 -40.59 96.53 Favored 'General case' 0 C--O 1.25 1.124 0 N-CA-C 109.628 -0.508 . . . . 15.16 109.628 -179.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.17 -46.71 85.84 Favored 'General case' 0 C--O 1.254 1.301 0 N-CA-C 112.373 0.509 . . . . 16.309999999999999 112.373 177.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 27' ' ' LEU . . . . . . . . . . . . . 15.1 tp -63.01 -39.29 94.33 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-N 115.823 -0.626 . . . . 26.079999999999998 112.554 -179.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -60.7 -29.85 69.58 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 120.654 0.264 . . . . 17.899999999999999 110.887 -178.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 -102.08 -1.81 30.8 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 114.546 1.313 . . . . 29.079999999999998 114.546 -178.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 61.58 42.1 99.7 Favored Glycine 0 C--O 1.242 0.641 0 N-CA-C 110.341 -1.103 . . . . 14.35 110.341 -175.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 31' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -109.22 113.84 27.02 Favored 'General case' 0 C--O 1.245 0.841 0 CA-C-O 121.672 0.749 . . . . 23.149999999999999 109.536 177.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 32' ' ' TYR . . . . . . . . . . . . . 6.7 p90 . . . . . 0 C--N 1.321 -0.64 0 CA-C-O 117.065 -1.445 . . . . 31.699999999999999 110.157 176.836 . . . . . . . . 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 ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' 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 build full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.261 . . . . . . . . 32.420000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . 75.21 -153.46 44.94 Favored Glycine 0 C--N 1.341 0.85 0 C-N-CA 120.904 -0.665 . . . . 23.32 113.414 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -66.53 -34.54 78.13 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.805 1.039 . . . . 25.52 113.805 -177.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 28.9 mm -63.56 -43.84 98.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 O-C-N 121.626 -0.672 . . . . 25.34 109.442 177.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.55 -38.67 88.33 Favored 'General case' 0 C--O 1.248 1.004 0 O-C-N 123.474 0.484 . . . . 18.010000000000002 111.273 176.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.49 -41.78 98.54 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.679 0.622 . . . . 15.19 112.679 177.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 69.9 mt -63.2 -41.47 99.18 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 123.082 0.553 . . . . 21.579999999999998 111.368 175.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -60.12 -42.16 94.17 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 111.717 0.265 . . . . 24.129999999999999 111.717 174.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -61.53 -38.22 86.61 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 120.68 0.276 . . . . 49.0 111.577 174.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -61.7 -44.81 96.22 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 122.313 -0.242 . . . . 28.780000000000001 111.241 176.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.5 mm -62.64 -42.95 98.0 Favored 'Isoleucine or valine' 0 C--O 1.252 1.2 0 N-CA-C 109.434 -0.58 . . . . 27.289999999999999 109.434 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.02 -43.07 99.43 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 109.86 -0.422 . . . . 13.640000000000001 109.86 -179.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.67 97.88 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 116.11 -0.495 . . . . 11.619999999999999 112.04 177.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.464 HD22 HD12 ' C' ' 17' ' ' ILE . 94.3 mt -65.24 -39.63 92.95 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 120.416 -0.514 . . . . 25.170000000000002 110.643 177.947 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -59.39 -44.05 92.84 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-O 121.25 0.548 . . . . 26.010000000000002 110.726 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -64.39 -38.92 92.74 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 115.594 -0.73 . . . . 16.879999999999999 111.896 178.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -61.79 -40.87 96.72 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 120.324 -0.55 . . . . 20.0 111.229 174.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.638 HD12 HD22 ' B' ' 13' ' ' LEU . 34.0 mt -68.26 -44.12 84.13 Favored 'Isoleucine or valine' 0 C--O 1.258 1.522 0 N-CA-C 109.229 -0.656 . . . . 18.32 109.229 -176.549 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.86 -44.59 82.35 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 115.648 -0.706 . . . . 12.6 110.656 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.46 86.75 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 123.73 0.644 . . . . 10.99 110.704 178.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.642 HD22 HD12 ' C' ' 24' ' ' ILE . 93.8 mt -68.65 -37.02 79.35 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.345 -0.613 . . . . 23.440000000000001 109.345 -179.114 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -60.32 -42.5 95.72 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 120.291 -0.564 . . . . 27.620000000000001 112.313 175.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -60.01 -43.47 95.23 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 112.287 0.477 . . . . 27.48 112.287 178.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.669 HD12 HD22 ' B' ' 20' ' ' LEU . 45.3 mt -62.84 -43.0 98.54 Favored 'Isoleucine or valine' 0 C--O 1.246 0.914 0 C-N-CA 123.049 0.539 . . . . 24.82 111.117 177.619 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.47 -46.55 76.83 Favored 'General case' 0 C--O 1.247 0.965 0 O-C-N 123.418 0.449 . . . . 10.59 111.339 176.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.26 -42.43 98.61 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 124.367 1.042 . . . . 10.539999999999999 111.425 178.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.4 mt -63.72 -38.99 93.17 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 112.027 0.38 . . . . 12.77 112.027 177.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -66.14 -39.67 90.02 Favored 'General case' 0 C--O 1.243 0.731 0 O-C-N 123.602 0.564 . . . . 25.920000000000002 111.46 175.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.8 tp60 -60.44 -45.61 93.03 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.486 -0.486 . . . . 16.030000000000001 111.075 177.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.38 -33.93 86.42 Favored Glycine 0 C--O 1.212 -1.268 0 CA-C-N 115.619 -0.718 . . . . 12.76 114.623 175.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -73.63 -53.63 10.01 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 122.046 -0.679 . . . . 18.629999999999999 112.225 -178.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 . . . . . 0 C--O 1.254 1.322 0 N-CA-C 111.931 0.345 . . . . 21.690000000000001 111.931 -175.905 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.113 . . . . . . . . 35.380000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . -106.23 -154.96 21.07 Favored Glycine 0 CA--C 1.528 0.886 0 O-C-N 121.495 -0.753 . . . . 20.649999999999999 111.936 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -62.48 -37.9 87.76 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.587 0.588 . . . . 34.299999999999997 112.587 -174.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 30.2 mm -67.63 -44.05 86.43 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 120.491 -0.483 . . . . 25.469999999999999 110.436 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.33 -41.74 85.24 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.926 -0.31 . . . . 15.75 111.734 175.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -61.06 -44.26 97.64 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 122.337 0.255 . . . . 19.41 110.716 177.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 24.1 mt -65.51 -38.99 91.32 Favored 'General case' 0 C--O 1.24 0.581 0 O-C-N 123.464 0.477 . . . . 27.289999999999999 109.72 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -62.33 -36.15 81.31 Favored 'General case' 0 C--O 1.258 1.509 0 C-N-CA 120.533 -0.467 . . . . 28.16 110.79 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -69.7 -41.37 75.48 Favored 'General case' 0 C--N 1.343 0.307 0 O-C-N 123.568 0.543 . . . . 29.239999999999998 110.496 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -59.26 -46.03 89.61 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.226 0.536 . . . . 30.52 111.476 174.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ILE . . . . . . . . . . . . . 71.5 mt -61.42 -40.98 88.16 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.76 0 CA-C-N 116.352 -0.386 . . . . 30.84 111.235 178.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.57 -42.48 96.74 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 122.616 0.366 . . . . 15.140000000000001 111.448 177.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.25 -46.16 88.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.952 -0.567 . . . . 15.33 110.816 177.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.638 HD22 HD12 ' A' ' 17' ' ' ILE . 79.5 mt -59.27 -40.9 87.55 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 116.69 -0.232 . . . . 33.990000000000002 111.187 178.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -61.44 -40.38 94.25 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.499 0.926 . . . . 27.52 113.499 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -61.89 -44.2 97.29 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.436 0.295 . . . . 40.579999999999998 111.703 172.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -59.07 -44.67 91.88 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.096 0.475 . . . . 30.66 111.966 176.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ILE . . . . . . . . . . . . . 13.7 mm -62.08 -43.22 97.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.4 -0.364 . . . . 25.780000000000001 111.619 177.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.11 -42.88 86.7 Favored 'General case' 0 C--O 1.248 0.994 0 CA-C-O 121.144 0.497 . . . . 13.92 110.904 178.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.31 -44.87 90.23 Favored 'General case' 0 C--O 1.247 0.963 0 CA-C-N 115.745 -0.661 . . . . 12.970000000000001 109.934 -178.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' LEU . . . . . 0.669 HD22 HD12 ' A' ' 24' ' ' ILE . 85.5 mt -61.07 -38.75 87.33 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.131 0.789 . . . . 28.399999999999999 113.131 177.643 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -65.46 -41.67 93.16 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.055 -0.721 . . . . 31.219999999999999 109.055 -178.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -62.6 -43.81 97.87 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.777 0.322 . . . . 44.280000000000001 111.847 179.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 34.7 mm -64.78 -41.23 91.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 CA-C-N 116.553 -0.294 . . . . 30.809999999999999 111.74 177.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.15 -42.61 91.13 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.919 0.39 . . . . 13.119999999999999 110.74 176.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.52 -42.61 82.52 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.053 -0.521 . . . . 13.67 111.65 -179.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 47.6 mt -64.07 -36.48 84.16 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 120.79 0.329 . . . . 17.57 111.055 178.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -61.88 -41.5 97.95 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.602 -0.839 . . . . 26.68 111.023 177.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -62.41 -42.66 99.6 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-O 121.095 0.474 . . . . 33.799999999999997 110.628 174.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.18 -46.21 94.95 Favored Glycine 0 N--CA 1.47 0.946 0 CA-C-N 115.776 -0.647 . . . . 12.94 112.358 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -83.3 -33.21 25.99 Favored 'General case' 0 C--O 1.245 0.826 0 N-CA-C 112.176 0.435 . . . . 17.140000000000001 112.176 -172.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 . . . . . 0 N--CA 1.486 1.348 0 N-CA-C 114.835 1.42 . . . . 27.0 114.835 -175.975 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.214 . . . . . . . . 19.41 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' GLY . . . . . . . . . . . . . . . -54.16 -47.31 68.0 Favored Glycine 0 C--O 1.243 0.674 0 O-C-N 121.392 -0.817 . . . . 18.41 113.92 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -64.31 -37.03 86.06 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.399 0.619 . . . . 48.049999999999997 111.162 -178.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 47.4 mt -64.29 -46.64 92.64 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 N-CA-C 112.988 0.736 . . . . 19.260000000000002 112.988 174.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.59 -43.91 80.56 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 122.116 -0.365 . . . . 15.41 111.874 173.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.69 -44.28 96.65 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 112.241 0.46 . . . . 19.390000000000001 112.241 179.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' LEU . . . . . . . . . . . . . 13.8 mt -57.68 -44.88 86.08 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.773 0.671 . . . . 28.27 110.552 175.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -64.05 -36.99 85.8 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.814 -0.554 . . . . 19.760000000000002 112.102 178.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -64.6 -40.09 94.9 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 122.014 -0.428 . . . . 41.030000000000001 110.321 176.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -64.64 -40.82 96.12 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 116.091 -0.504 . . . . 28.760000000000002 110.636 179.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' ILE . . . . . . . . . . . . . 85.9 mt -61.69 -43.07 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 116.387 -0.369 . . . . 13.82 111.995 174.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.29 -39.81 91.82 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-N 116.458 -0.337 . . . . 13.9 110.627 177.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.56 -38.34 83.98 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 116.461 -0.336 . . . . 13.82 111.363 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 80.9 mt -65.06 -39.04 92.68 Favored 'General case' 0 C--O 1.244 0.767 0 O-C-N 122.49 -0.131 . . . . 25.579999999999998 111.105 177.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.87 -39.97 93.76 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 120.789 -0.364 . . . . 31.870000000000001 111.671 176.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' LYS . . . . . . . . . . . . . 25.4 ttpp -64.63 -43.95 92.07 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 112.168 0.433 . . . . 44.649999999999999 112.168 175.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -61.62 -42.62 99.15 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 122.034 -0.417 . . . . 26.809999999999999 111.186 176.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' ILE . . . . . 0.464 HD12 HD22 ' A' ' 13' ' ' LEU . 44.7 mt -61.81 -43.34 97.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 110.226 -0.287 . . . . 18.190000000000001 110.226 178.833 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.76 -44.15 90.51 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 111.88 0.326 . . . . 12.65 111.88 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.05 -42.16 94.52 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 123.519 0.512 . . . . 10.970000000000001 110.288 -178.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 66.3 mt -62.53 -42.74 99.72 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.6 0.593 . . . . 28.0 112.6 176.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -58.8 -43.21 90.48 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 108.244 -1.021 . . . . 24.300000000000001 108.244 179.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' GLU . . . . . . . . . . . . . 65.2 mm-40 -60.58 -40.84 93.2 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 112.674 0.62 . . . . 27.07 112.674 179.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' ILE . . . . . 0.642 HD12 HD22 ' A' ' 20' ' ' LEU . 63.2 mt -66.03 -46.66 87.46 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.533 0 CA-C-N 116.05 -0.523 . . . . 21.109999999999999 111.997 177.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.18 -40.59 96.53 Favored 'General case' 0 C--O 1.25 1.124 0 N-CA-C 109.628 -0.508 . . . . 15.16 109.628 -179.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.17 -46.71 85.84 Favored 'General case' 0 C--O 1.254 1.301 0 N-CA-C 112.373 0.509 . . . . 16.309999999999999 112.373 177.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' LEU . . . . . . . . . . . . . 15.1 tp -63.01 -39.29 94.33 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-N 115.823 -0.626 . . . . 26.079999999999998 112.554 -179.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -60.7 -29.85 69.58 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 120.654 0.264 . . . . 17.899999999999999 110.887 -178.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 -102.08 -1.81 30.8 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 114.546 1.313 . . . . 29.079999999999998 114.546 -178.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 61.58 42.1 99.7 Favored Glycine 0 C--O 1.242 0.641 0 N-CA-C 110.341 -1.103 . . . . 14.35 110.341 -175.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -109.22 113.84 27.02 Favored 'General case' 0 C--O 1.245 0.841 0 CA-C-O 121.672 0.749 . . . . 23.149999999999999 109.536 177.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' TYR . . . . . . . . . . . . . 6.7 p90 . . . . . 0 C--N 1.321 -0.64 0 CA-C-O 117.065 -1.445 . . . . 31.699999999999999 110.157 176.836 . . . . . . . . 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 ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' 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 . 001 ecloud nobuild full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_