data_1deb_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 1deb _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 ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.909 0 CA-C-O 120.729 0.299 . . . . 40.93 111.374 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -72.36 145.99 47.38 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 114.165 1.172 . . . . 39.93 114.165 -178.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.93 151.14 12.17 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 115.582 -0.736 . . . . 36.77 111.031 179.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' SER . . . . . 0.427 ' N ' ' OE1' ' A' ' 8' ' ' GLN . 89.1 p -75.18 177.26 6.6 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 106.216 -1.772 . . . . 35.01 106.216 178.135 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -65.69 -35.34 80.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.931 -0.766 . . . . 31.36 108.931 178.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -74.28 -32.94 63.1 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 113.546 0.943 . . . . 39.13 113.546 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . 0.427 ' OE1' ' N ' ' A' ' 5' ' ' SER . 84.2 mt-30 -68.99 -37.16 78.56 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.797 -0.816 . . . . 32.97 108.797 178.957 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 13.8 mt -65.92 -43.52 87.85 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 108.969 -0.752 . . . . 27.65 108.969 178.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 55.8 tp -56.23 -39.82 73.14 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 119.602 -0.839 . . . . 34.38 109.026 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -66.66 -37.18 84.26 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 119.666 -0.814 . . . . 37.57 111.64 179.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -63.53 -45.06 92.33 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.855 -0.795 . . . . 21.21 108.855 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 55.1 t -60.11 -43.48 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.306 0 CA-C-N 115.832 -0.622 . . . . 21.08 110.669 -178.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 66.0 mt-10 -59.36 -44.44 92.69 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.641 -0.423 . . . . 34.39 111.983 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.79 -35.69 67.43 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.989 0.423 . . . . 16.2 110.398 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.5 mt -65.6 -43.01 90.97 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.764 -0.374 . . . . 18.68 111.237 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -62.71 -39.04 92.8 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.399 0.619 . . . . 32.94 110.988 178.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 14.6 tmm? -71.11 -42.75 68.85 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 117.907 -1.517 . . . . 30.92 108.258 -178.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -58.25 -48.49 80.25 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 108.039 -1.097 . . . . 15.93 108.039 178.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -57.37 -40.19 77.61 Favored 'General case' 0 C--O 1.214 -0.768 0 C-N-CA 120.958 -0.297 . . . . 21.51 110.715 178.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.9 m -66.34 -36.97 84.26 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 119.765 -0.774 . . . . 19.61 110.647 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -71.36 -41.22 70.03 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 119.915 -0.714 . . . . 17.29 111.646 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 78.6 mt -59.17 -44.24 92.16 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.574 -0.528 . . . . 19.23 109.574 178.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 74.1 mtt-85 -60.51 -41.01 93.46 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.077 0.465 . . . . 34.61 111.119 178.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -60.4 -43.09 97.01 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.881 0.848 . . . . 25.82 109.114 178.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -63.6 -47.77 80.05 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.682 -0.69 . . . . 25.3 112.564 -179.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.5 tp -61.47 -40.28 93.96 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.659 0.742 . . . . 20.21 109.048 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -62.72 -45.14 94.1 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.277 -0.874 . . . . 37.21 109.001 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -60.52 -55.53 32.32 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 122.296 1.046 . . . . 21.96 108.656 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -65.07 -33.38 75.91 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.513 -1.221 . . . . 30.36 113.841 -177.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 74.6 m -66.96 -44.9 79.33 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 106.414 -1.699 . . . . 24.07 106.414 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -62.58 -37.2 85.26 Favored 'General case' 0 C--O 1.256 1.44 0 CA-C-O 122.014 0.911 . . . . 25.08 110.8 178.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -63.68 -38.83 92.59 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.458 -0.792 . . . . 19.95 111.547 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.8 tp -63.0 -48.22 79.76 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 107.442 -1.318 . . . . 25.03 107.442 179.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.8 m -57.86 -42.93 85.5 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 113.228 0.825 . . . . 24.43 113.228 179.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -69.23 -29.8 67.82 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 119.949 -0.7 . . . . 36.84 110.188 179.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 65.4 mt -69.86 -40.42 75.76 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 119.421 -0.911 . . . . 19.58 110.677 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -66.58 -41.75 88.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.711 -0.677 . . . . 23.38 109.815 -179.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 53.8 m -59.02 -46.86 87.14 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.03 -1.1 . . . . 25.76 108.03 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -60.78 -41.86 96.41 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 119.907 -0.717 . . . . 24.64 111.827 179.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.7 -43.54 96.29 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 120.181 -0.608 . . . . 22.69 109.709 -179.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.3 m -66.8 -39.27 87.7 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 114.968 1.47 . . . . 27.88 114.968 -179.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -61.99 -35.57 78.91 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 106.177 -1.786 . . . . 29.0 106.177 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 8.3 tpp -64.86 -49.48 70.39 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.885 -0.783 . . . . 39.25 108.885 179.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -56.43 -43.08 79.07 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.357 -0.609 . . . . 44.75 109.357 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.51 -42.33 87.5 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 114.668 1.359 . . . . 42.66 114.668 -179.212 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 7.7 p -74.19 -24.0 18.87 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 C-N-CA 118.966 -1.094 . . . . 28.44 109.237 -179.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 75.1 mt -66.73 -42.62 85.97 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 108.929 -0.767 . . . . 34.49 108.929 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -58.28 -61.66 2.41 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.871 0.367 . . . . 48.97 111.104 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -57.44 -14.04 4.35 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 115.72 1.748 . . . . 45.36 115.72 -178.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 45.1 mt -89.91 -39.54 12.96 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 108.535 -0.913 . . . . 45.61 108.535 178.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLN . . . . . 0.404 ' O ' ' C ' ' A' ' 53' ' ' GLY . 48.3 mm-40 -66.39 -26.24 67.15 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 106.012 -1.848 . . . . 59.47 106.012 179.441 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . 0.448 ' O ' ' CB ' ' A' ' 54' ' ' SER . . . -48.21 -68.58 1.2 Allowed Glycine 0 C--N 1.341 0.817 1 N-CA-C 100.349 -5.1 . . . . 69.6 100.349 177.038 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' SER . . . . . 0.448 ' CB ' ' O ' ' A' ' 53' ' ' GLY 0.272 23.3 t 103.85 -68.33 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 1 N-CA-C 134.129 8.566 . . . . 73.28 134.129 171.791 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.168 0 N-CA-C 117.052 2.241 . . . . 76.45 117.052 -175.347 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 120.832 0.348 . . . . 52.81 111.074 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -81.72 153.31 26.61 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 113.714 1.005 . . . . 49.06 113.714 -179.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 10.6 t -82.41 168.4 17.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.344 0.592 . . . . 49.61 112.388 179.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -69.14 -51.19 40.83 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.919 -0.582 . . . . 52.91 111.684 179.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -64.11 -19.69 65.44 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 118.198 -1.401 . . . . 57.45 108.674 -179.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -77.45 -38.6 49.05 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 112.575 0.583 . . . . 49.46 112.575 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 49.2 mt -65.97 -33.1 75.04 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 102.362 -3.199 . . . . 41.95 102.362 177.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 11.0 tp -63.41 -44.51 94.44 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 114.252 -1.34 . . . . 43.53 113.29 -179.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 66.6 tttp -70.1 -28.03 65.07 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 105.109 -2.182 . . . . 54.81 105.109 178.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -72.16 -36.68 69.37 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.755 0.65 . . . . 45.52 112.755 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 55.6 t -61.38 -55.56 23.68 Favored 'Isoleucine or valine' 0 C--O 1.243 0.718 0 N-CA-C 107.151 -1.425 . . . . 28.69 107.151 178.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -51.44 -45.7 62.74 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 115.295 -0.866 . . . . 34.39 112.241 -179.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.32 -50.49 69.83 Favored 'General case' 0 C--O 1.242 0.705 0 CA-C-O 121.586 0.707 . . . . 23.36 110.747 -177.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.1 mt -61.28 -40.01 92.53 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.238 -0.892 . . . . 22.48 111.256 178.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -64.21 -40.82 96.87 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 119.287 -0.965 . . . . 25.87 110.106 179.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' MET . . . . . . . . . . . . . 58.7 ttm -62.45 -49.12 76.68 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.125 -0.694 . . . . 36.59 109.125 179.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -61.3 -41.52 97.12 Favored 'General case' 0 C--O 1.211 -0.964 0 C-N-CA 119.731 -0.788 . . . . 37.12 112.739 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -62.24 -38.49 89.43 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.574 0.702 . . . . 19.31 109.708 -179.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -61.55 -42.01 98.21 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.802 -1.09 . . . . 22.16 111.195 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -70.42 -36.59 74.11 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.341 0.591 . . . . 20.71 110.789 -179.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 27.1 mt -64.63 -42.84 95.19 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 119.137 -1.025 . . . . 19.96 108.258 -179.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 60.8 mtt85 -59.31 -44.14 92.59 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 120.462 -0.495 . . . . 29.4 111.026 179.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -61.35 -38.27 86.33 Favored 'General case' 0 C--O 1.249 1.072 0 C-N-CA 120.205 -0.598 . . . . 35.33 109.567 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -68.34 -38.3 81.36 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.832 -0.622 . . . . 31.22 110.835 -179.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 49.5 mt -65.68 -37.19 85.79 Favored 'General case' 0 C--O 1.225 -0.199 0 N-CA-C 106.751 -1.574 . . . . 19.21 106.751 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -66.9 -52.87 37.97 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.416 -0.514 . . . . 46.06 110.75 178.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -54.71 -46.44 74.19 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 107.679 -1.23 . . . . 24.97 107.679 179.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -59.98 -38.31 82.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 120.653 -0.419 . . . . 20.73 111.437 179.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 12.8 t -57.62 -46.47 84.06 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.023 0.44 . . . . 33.23 111.218 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -56.51 -42.38 78.28 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 112.912 0.708 . . . . 26.76 112.912 179.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' HIS . . . . . . . . . . . . . 30.7 m-70 -70.84 -36.78 73.04 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 120.189 -0.604 . . . . 25.75 110.175 -179.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.5 mt -61.49 -47.13 87.03 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-O 122.028 0.918 . . . . 23.64 109.919 179.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 39.0 m -57.35 -53.3 59.72 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 119.198 -1.001 . . . . 31.44 110.812 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -49.68 -42.88 46.71 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 119.961 -0.696 . . . . 46.98 111.302 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 17.2 mt -66.94 -37.79 84.94 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 116.028 -0.533 . . . . 24.94 111.312 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -71.56 -37.97 71.02 Favored 'General case' 0 CA--C 1.505 -0.767 0 C-N-CA 119.944 -0.702 . . . . 30.69 110.693 -179.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 87.7 m -64.41 -40.63 96.15 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 119.505 -0.878 . . . . 23.08 109.225 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -64.84 -41.34 95.8 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.472 -0.491 . . . . 31.74 111.152 179.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.61 -47.88 81.84 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 119.89 -0.724 . . . . 19.55 109.726 -179.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 67.0 m -57.13 -42.27 80.63 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.802 -0.635 . . . . 25.38 111.389 179.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -63.38 -41.69 98.81 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.267 0.556 . . . . 24.5 110.051 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.82 -45.22 95.29 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 107.78 -1.192 . . . . 45.33 107.78 179.783 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -63.17 -44.95 94.03 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.303 -0.862 . . . . 33.6 110.87 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 32.6 tp10 -63.48 -39.37 94.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.964 -0.562 . . . . 25.07 111.202 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' VAL . . . . . . . . . . . . . 39.7 t -69.2 -39.7 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 111.768 0.284 . . . . 21.51 111.768 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 92.4 mt -65.44 -30.72 71.55 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.278 0.561 . . . . 26.54 109.499 -179.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -67.74 -48.94 65.02 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.471 -0.786 . . . . 36.79 109.195 179.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -62.97 -38.47 91.25 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 119.496 -0.882 . . . . 22.95 110.535 -179.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 87.9 mt -64.72 -43.04 94.71 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.062 -0.718 . . . . 22.33 109.062 179.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -58.74 -41.71 87.12 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 112.566 0.58 . . . . 38.43 112.566 -178.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.55 21.48 4.47 Favored Glycine 0 C--O 1.213 -1.158 0 C-N-CA 119.895 -1.145 . . . . 28.76 113.157 -179.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' SER . . . . . . . . . . . . . 49.9 m -109.53 -47.12 3.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 117.255 0.528 . . . . 40.78 112.165 -179.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 3.6 tp . . . . . 0 C--O 1.243 0.716 0 CA-C-O 116.703 -1.618 . . . . 45.16 111.162 -178.006 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 423' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.909 0 CA-C-O 120.729 0.299 . . . . 40.93 111.374 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -72.36 145.99 47.38 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 114.165 1.172 . . . . 39.93 114.165 -178.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.93 151.14 12.17 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 115.582 -0.736 . . . . 36.77 111.031 179.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 89.1 p -75.18 177.26 6.6 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 106.216 -1.772 . . . . 35.01 106.216 178.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -65.69 -35.34 80.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.931 -0.766 . . . . 31.36 108.931 178.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -74.28 -32.94 63.1 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 113.546 0.943 . . . . 39.13 113.546 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -68.99 -37.16 78.56 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.797 -0.816 . . . . 32.97 108.797 178.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 13.8 mt -65.92 -43.52 87.85 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 108.969 -0.752 . . . . 27.65 108.969 178.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 55.8 tp -56.23 -39.82 73.14 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 119.602 -0.839 . . . . 34.38 109.026 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -66.66 -37.18 84.26 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 119.666 -0.814 . . . . 37.57 111.64 179.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -63.53 -45.06 92.33 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.855 -0.795 . . . . 21.21 108.855 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' VAL . . . . . 0.477 ' CG1' ' HE3' ' A' ' 17' ' ' LYS . 55.1 t -60.11 -43.48 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.306 0 CA-C-N 115.832 -0.622 . . . . 21.08 110.669 -178.853 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 66.0 mt-10 -59.36 -44.44 92.69 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.641 -0.423 . . . . 34.39 111.983 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.79 -35.69 67.43 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.989 0.423 . . . . 16.2 110.398 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.5 mt -65.6 -43.01 90.97 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.764 -0.374 . . . . 18.68 111.237 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LYS . . . . . 0.477 ' HE3' ' CG1' ' A' ' 13' ' ' VAL . 95.5 mttt -62.71 -39.04 92.8 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.399 0.619 . . . . 32.94 110.988 178.39 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 14.6 tmm? -71.11 -42.75 68.85 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 117.907 -1.517 . . . . 30.92 108.258 -178.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -58.25 -48.49 80.25 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 108.039 -1.097 . . . . 15.93 108.039 178.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -57.37 -40.19 77.61 Favored 'General case' 0 C--O 1.214 -0.768 0 C-N-CA 120.958 -0.297 . . . . 21.51 110.715 178.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.9 m -66.34 -36.97 84.26 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 119.765 -0.774 . . . . 19.61 110.647 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -71.36 -41.22 70.03 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 119.915 -0.714 . . . . 17.29 111.646 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 78.6 mt -59.17 -44.24 92.16 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.574 -0.528 . . . . 19.23 109.574 178.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 74.1 mtt-85 -60.51 -41.01 93.46 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.077 0.465 . . . . 34.61 111.119 178.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -60.4 -43.09 97.01 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.881 0.848 . . . . 25.82 109.114 178.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -63.6 -47.77 80.05 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.682 -0.69 . . . . 25.3 112.564 -179.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.5 tp -61.47 -40.28 93.96 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.659 0.742 . . . . 20.21 109.048 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -62.72 -45.14 94.1 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.277 -0.874 . . . . 37.21 109.001 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -60.52 -55.53 32.32 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 122.296 1.046 . . . . 21.96 108.656 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -65.07 -33.38 75.91 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.513 -1.221 . . . . 30.36 113.841 -177.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 74.6 m -66.96 -44.9 79.33 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 106.414 -1.699 . . . . 24.07 106.414 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -62.58 -37.2 85.26 Favored 'General case' 0 C--O 1.256 1.44 0 CA-C-O 122.014 0.911 . . . . 25.08 110.8 178.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -63.68 -38.83 92.59 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.458 -0.792 . . . . 19.95 111.547 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . 0.43 HD12 HD12 ' B' ' 37' ' ' LEU . 4.8 tp -63.0 -48.22 79.76 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 107.442 -1.318 . . . . 25.03 107.442 179.27 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.8 m -57.86 -42.93 85.5 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 113.228 0.825 . . . . 24.43 113.228 179.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -69.23 -29.8 67.82 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 119.949 -0.7 . . . . 36.84 110.188 179.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 65.4 mt -69.86 -40.42 75.76 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 119.421 -0.911 . . . . 19.58 110.677 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -66.58 -41.75 88.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.711 -0.677 . . . . 23.38 109.815 -179.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 53.8 m -59.02 -46.86 87.14 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.03 -1.1 . . . . 25.76 108.03 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -60.78 -41.86 96.41 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 119.907 -0.717 . . . . 24.64 111.827 179.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.7 -43.54 96.29 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 120.181 -0.608 . . . . 22.69 109.709 -179.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.3 m -66.8 -39.27 87.7 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 114.968 1.47 . . . . 27.88 114.968 -179.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -61.99 -35.57 78.91 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 106.177 -1.786 . . . . 29.0 106.177 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' MET . . . . . 0.542 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 8.3 tpp -64.86 -49.48 70.39 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.885 -0.783 . . . . 39.25 108.885 179.009 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -56.43 -43.08 79.07 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.357 -0.609 . . . . 44.75 109.357 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.51 -42.33 87.5 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 114.668 1.359 . . . . 42.66 114.668 -179.212 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 7.7 p -74.19 -24.0 18.87 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 C-N-CA 118.966 -1.094 . . . . 28.44 109.237 -179.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . 0.83 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 75.1 mt -66.73 -42.62 85.97 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 108.929 -0.767 . . . . 34.49 108.929 178.443 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -58.28 -61.66 2.41 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.871 0.367 . . . . 48.97 111.104 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -57.44 -14.04 4.35 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 115.72 1.748 . . . . 45.36 115.72 -178.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 45.1 mt -89.91 -39.54 12.96 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 108.535 -0.913 . . . . 45.61 108.535 178.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLN . . . . . 0.83 ' HG2' ' O ' ' A' ' 48' ' ' LEU . 48.3 mm-40 -66.39 -26.24 67.15 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 106.012 -1.848 . . . . 59.47 106.012 179.441 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . 0.538 ' O ' ' HB3' ' A' ' 54' ' ' SER . . . -48.21 -68.58 1.2 Allowed Glycine 0 C--N 1.341 0.817 1 N-CA-C 100.349 -5.1 . . . . 69.6 100.349 177.038 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 54' ' ' SER . . . . . 0.538 ' HB3' ' O ' ' A' ' 53' ' ' GLY 0.272 23.3 t 103.85 -68.33 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 1 N-CA-C 134.129 8.566 . . . . 73.28 134.129 171.791 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.168 0 N-CA-C 117.052 2.241 . . . . 76.45 117.052 -175.347 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 120.832 0.348 . . . . 52.81 111.074 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -81.72 153.31 26.61 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 113.714 1.005 . . . . 49.06 113.714 -179.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 10.6 t -82.41 168.4 17.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.344 0.592 . . . . 49.61 112.388 179.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -69.14 -51.19 40.83 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.919 -0.582 . . . . 52.91 111.684 179.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ASP . . . . . 0.443 ' O ' ' HB3' ' B' ' 10' ' ' LEU . 4.7 t0 -64.11 -19.69 65.44 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 118.198 -1.401 . . . . 57.45 108.674 -179.688 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -77.45 -38.6 49.05 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 112.575 0.583 . . . . 49.46 112.575 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 49.2 mt -65.97 -33.1 75.04 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 102.362 -3.199 . . . . 41.95 102.362 177.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' LEU . . . . . 0.443 ' HB3' ' O ' ' B' ' 7' ' ' ASP . 11.0 tp -63.41 -44.51 94.44 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 114.252 -1.34 . . . . 43.53 113.29 -179.239 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 66.6 tttp -70.1 -28.03 65.07 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 105.109 -2.182 . . . . 54.81 105.109 178.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -72.16 -36.68 69.37 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.755 0.65 . . . . 45.52 112.755 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 55.6 t -61.38 -55.56 23.68 Favored 'Isoleucine or valine' 0 C--O 1.243 0.718 0 N-CA-C 107.151 -1.425 . . . . 28.69 107.151 178.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -51.44 -45.7 62.74 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 115.295 -0.866 . . . . 34.39 112.241 -179.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.32 -50.49 69.83 Favored 'General case' 0 C--O 1.242 0.705 0 CA-C-O 121.586 0.707 . . . . 23.36 110.747 -177.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.1 mt -61.28 -40.01 92.53 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.238 -0.892 . . . . 22.48 111.256 178.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -64.21 -40.82 96.87 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 119.287 -0.965 . . . . 25.87 110.106 179.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' MET . . . . . . . . . . . . . 58.7 ttm -62.45 -49.12 76.68 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.125 -0.694 . . . . 36.59 109.125 179.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -61.3 -41.52 97.12 Favored 'General case' 0 C--O 1.211 -0.964 0 C-N-CA 119.731 -0.788 . . . . 37.12 112.739 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -62.24 -38.49 89.43 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.574 0.702 . . . . 19.31 109.708 -179.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -61.55 -42.01 98.21 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.802 -1.09 . . . . 22.16 111.195 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -70.42 -36.59 74.11 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.341 0.591 . . . . 20.71 110.789 -179.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 27.1 mt -64.63 -42.84 95.19 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 119.137 -1.025 . . . . 19.96 108.258 -179.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 60.8 mtt85 -59.31 -44.14 92.59 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 120.462 -0.495 . . . . 29.4 111.026 179.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -61.35 -38.27 86.33 Favored 'General case' 0 C--O 1.249 1.072 0 C-N-CA 120.205 -0.598 . . . . 35.33 109.567 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -68.34 -38.3 81.36 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.832 -0.622 . . . . 31.22 110.835 -179.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 49.5 mt -65.68 -37.19 85.79 Favored 'General case' 0 C--O 1.225 -0.199 0 N-CA-C 106.751 -1.574 . . . . 19.21 106.751 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -66.9 -52.87 37.97 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.416 -0.514 . . . . 46.06 110.75 178.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -54.71 -46.44 74.19 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 107.679 -1.23 . . . . 24.97 107.679 179.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -59.98 -38.31 82.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 120.653 -0.419 . . . . 20.73 111.437 179.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 12.8 t -57.62 -46.47 84.06 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.023 0.44 . . . . 33.23 111.218 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -56.51 -42.38 78.28 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 112.912 0.708 . . . . 26.76 112.912 179.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' HIS . . . . . 0.433 ' HD2' ' O ' ' B' ' 209' ' ' HOH . 19.7 m80 -70.84 -36.78 73.04 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 120.189 -0.604 . . . . 25.75 110.175 -179.594 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.5 mt -61.49 -47.13 87.03 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-O 122.028 0.918 . . . . 23.64 109.919 179.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 39.0 m -57.35 -53.3 59.72 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 119.198 -1.001 . . . . 31.44 110.812 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -49.68 -42.88 46.71 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 119.961 -0.696 . . . . 46.98 111.302 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' LEU . . . . . 0.43 HD12 HD12 ' A' ' 34' ' ' LEU . 17.2 mt -66.94 -37.79 84.94 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 116.028 -0.533 . . . . 24.94 111.312 179.775 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -71.56 -37.97 71.02 Favored 'General case' 0 CA--C 1.505 -0.767 0 C-N-CA 119.944 -0.702 . . . . 30.69 110.693 -179.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 87.7 m -64.41 -40.63 96.15 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 119.505 -0.878 . . . . 23.08 109.225 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -64.84 -41.34 95.8 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.472 -0.491 . . . . 31.74 111.152 179.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.61 -47.88 81.84 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 119.89 -0.724 . . . . 19.55 109.726 -179.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 67.0 m -57.13 -42.27 80.63 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.802 -0.635 . . . . 25.38 111.389 179.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -63.38 -41.69 98.81 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.267 0.556 . . . . 24.5 110.051 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.82 -45.22 95.29 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 107.78 -1.192 . . . . 45.33 107.78 179.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -63.17 -44.95 94.03 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.303 -0.862 . . . . 33.6 110.87 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 32.6 tp10 -63.48 -39.37 94.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.964 -0.562 . . . . 25.07 111.202 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' VAL . . . . . . . . . . . . . 39.7 t -69.2 -39.7 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 111.768 0.284 . . . . 21.51 111.768 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 92.4 mt -65.44 -30.72 71.55 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.278 0.561 . . . . 26.54 109.499 -179.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -67.74 -48.94 65.02 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.471 -0.786 . . . . 36.79 109.195 179.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -62.97 -38.47 91.25 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 119.496 -0.882 . . . . 22.95 110.535 -179.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 87.9 mt -64.72 -43.04 94.71 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.062 -0.718 . . . . 22.33 109.062 179.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -58.74 -41.71 87.12 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 112.566 0.58 . . . . 38.43 112.566 -178.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.55 21.48 4.47 Favored Glycine 0 C--O 1.213 -1.158 0 C-N-CA 119.895 -1.145 . . . . 28.76 113.157 -179.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' SER . . . . . . . . . . . . . 49.9 m -109.53 -47.12 3.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 117.255 0.528 . . . . 40.78 112.165 -179.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ILE . . . . . 0.6 ' OXT' HG23 ' B' ' 55' ' ' ILE . 3.6 tp . . . . . 0 C--O 1.243 0.716 0 CA-C-O 116.703 -1.618 . . . . 45.16 111.162 -178.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 423' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 209' ' ' HOH . . . . . 0.433 ' O ' ' HD2' ' B' ' 33' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.909 0 CA-C-O 120.729 0.299 . . . . 40.93 111.374 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -72.36 145.99 47.38 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 114.165 1.172 . . . . 39.93 114.165 -178.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.93 151.14 12.17 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 115.582 -0.736 . . . . 36.77 111.031 179.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 89.1 p -75.18 177.26 6.6 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 106.216 -1.772 . . . . 35.01 106.216 178.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -65.69 -35.34 80.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.931 -0.766 . . . . 31.36 108.931 178.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -74.28 -32.94 63.1 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 113.546 0.943 . . . . 39.13 113.546 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -68.99 -37.16 78.56 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.797 -0.816 . . . . 32.97 108.797 178.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 13.8 mt -65.92 -43.52 87.85 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 108.969 -0.752 . . . . 27.65 108.969 178.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 55.8 tp -56.23 -39.82 73.14 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 119.602 -0.839 . . . . 34.38 109.026 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -66.66 -37.18 84.26 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 119.666 -0.814 . . . . 37.57 111.64 179.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -63.53 -45.06 92.33 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.855 -0.795 . . . . 21.21 108.855 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.477 ' CG1' ' HE3' ' A' ' 17' ' ' LYS . 55.1 t -60.11 -43.48 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.306 0 CA-C-N 115.832 -0.622 . . . . 21.08 110.669 -178.853 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 66.0 mt-10 -59.36 -44.44 92.69 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.641 -0.423 . . . . 34.39 111.983 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.79 -35.69 67.43 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.989 0.423 . . . . 16.2 110.398 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.5 mt -65.6 -43.01 90.97 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.764 -0.374 . . . . 18.68 111.237 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.477 ' HE3' ' CG1' ' A' ' 13' ' ' VAL . 95.5 mttt -62.71 -39.04 92.8 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.399 0.619 . . . . 32.94 110.988 178.39 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 14.6 tmm? -71.11 -42.75 68.85 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 117.907 -1.517 . . . . 30.92 108.258 -178.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -58.25 -48.49 80.25 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 108.039 -1.097 . . . . 15.93 108.039 178.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -57.37 -40.19 77.61 Favored 'General case' 0 C--O 1.214 -0.768 0 C-N-CA 120.958 -0.297 . . . . 21.51 110.715 178.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.9 m -66.34 -36.97 84.26 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 119.765 -0.774 . . . . 19.61 110.647 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -71.36 -41.22 70.03 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 119.915 -0.714 . . . . 17.29 111.646 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 78.6 mt -59.17 -44.24 92.16 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.574 -0.528 . . . . 19.23 109.574 178.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 74.1 mtt-85 -60.51 -41.01 93.46 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.077 0.465 . . . . 34.61 111.119 178.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -60.4 -43.09 97.01 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.881 0.848 . . . . 25.82 109.114 178.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -63.6 -47.77 80.05 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.682 -0.69 . . . . 25.3 112.564 -179.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.5 tp -61.47 -40.28 93.96 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.659 0.742 . . . . 20.21 109.048 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -62.72 -45.14 94.1 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.277 -0.874 . . . . 37.21 109.001 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -60.52 -55.53 32.32 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 122.296 1.046 . . . . 21.96 108.656 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -65.07 -33.38 75.91 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.513 -1.221 . . . . 30.36 113.841 -177.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 74.6 m -66.96 -44.9 79.33 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 106.414 -1.699 . . . . 24.07 106.414 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -62.58 -37.2 85.26 Favored 'General case' 0 C--O 1.256 1.44 0 CA-C-O 122.014 0.911 . . . . 25.08 110.8 178.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -63.68 -38.83 92.59 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.458 -0.792 . . . . 19.95 111.547 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.43 HD12 HD12 ' B' ' 37' ' ' LEU . 4.8 tp -63.0 -48.22 79.76 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 107.442 -1.318 . . . . 25.03 107.442 179.27 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.8 m -57.86 -42.93 85.5 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 113.228 0.825 . . . . 24.43 113.228 179.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -69.23 -29.8 67.82 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 119.949 -0.7 . . . . 36.84 110.188 179.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 65.4 mt -69.86 -40.42 75.76 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 119.421 -0.911 . . . . 19.58 110.677 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -66.58 -41.75 88.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.711 -0.677 . . . . 23.38 109.815 -179.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 53.8 m -59.02 -46.86 87.14 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.03 -1.1 . . . . 25.76 108.03 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -60.78 -41.86 96.41 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 119.907 -0.717 . . . . 24.64 111.827 179.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.7 -43.54 96.29 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 120.181 -0.608 . . . . 22.69 109.709 -179.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 23.3 m -66.8 -39.27 87.7 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 114.968 1.47 . . . . 27.88 114.968 -179.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -61.99 -35.57 78.91 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 106.177 -1.786 . . . . 29.0 106.177 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' MET . . . . . 0.542 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 8.3 tpp -64.86 -49.48 70.39 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.885 -0.783 . . . . 39.25 108.885 179.009 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -56.43 -43.08 79.07 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.357 -0.609 . . . . 44.75 109.357 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.51 -42.33 87.5 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 114.668 1.359 . . . . 42.66 114.668 -179.212 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 7.7 p -74.19 -24.0 18.87 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 C-N-CA 118.966 -1.094 . . . . 28.44 109.237 -179.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.83 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 75.1 mt -66.73 -42.62 85.97 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 108.929 -0.767 . . . . 34.49 108.929 178.443 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -58.28 -61.66 2.41 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.871 0.367 . . . . 48.97 111.104 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -57.44 -14.04 4.35 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 115.72 1.748 . . . . 45.36 115.72 -178.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 45.1 mt -89.91 -39.54 12.96 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 108.535 -0.913 . . . . 45.61 108.535 178.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.83 ' HG2' ' O ' ' A' ' 48' ' ' LEU . 48.3 mm-40 -66.39 -26.24 67.15 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 106.012 -1.848 . . . . 59.47 106.012 179.441 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.538 ' O ' ' HB3' ' A' ' 54' ' ' SER . . . -48.21 -68.58 1.2 Allowed Glycine 0 C--N 1.341 0.817 1 N-CA-C 100.349 -5.1 . . . . 69.6 100.349 177.038 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' SER . . . . . 0.538 ' HB3' ' O ' ' A' ' 53' ' ' GLY 0.272 23.3 t 103.85 -68.33 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 1 N-CA-C 134.129 8.566 . . . . 73.28 134.129 171.791 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.168 0 N-CA-C 117.052 2.241 . . . . 76.45 117.052 -175.347 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 120.832 0.348 . . . . 52.81 111.074 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -81.72 153.31 26.61 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 113.714 1.005 . . . . 49.06 113.714 -179.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 10.6 t -82.41 168.4 17.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.344 0.592 . . . . 49.61 112.388 179.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -69.14 -51.19 40.83 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.919 -0.582 . . . . 52.91 111.684 179.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ASP . . . . . 0.443 ' O ' ' HB3' ' B' ' 10' ' ' LEU . 4.7 t0 -64.11 -19.69 65.44 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 118.198 -1.401 . . . . 57.45 108.674 -179.688 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -77.45 -38.6 49.05 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 112.575 0.583 . . . . 49.46 112.575 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 49.2 mt -65.97 -33.1 75.04 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 102.362 -3.199 . . . . 41.95 102.362 177.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.443 ' HB3' ' O ' ' B' ' 7' ' ' ASP . 11.0 tp -63.41 -44.51 94.44 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 114.252 -1.34 . . . . 43.53 113.29 -179.239 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 66.6 tttp -70.1 -28.03 65.07 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 105.109 -2.182 . . . . 54.81 105.109 178.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -72.16 -36.68 69.37 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.755 0.65 . . . . 45.52 112.755 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 55.6 t -61.38 -55.56 23.68 Favored 'Isoleucine or valine' 0 C--O 1.243 0.718 0 N-CA-C 107.151 -1.425 . . . . 28.69 107.151 178.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -51.44 -45.7 62.74 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 115.295 -0.866 . . . . 34.39 112.241 -179.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.32 -50.49 69.83 Favored 'General case' 0 C--O 1.242 0.705 0 CA-C-O 121.586 0.707 . . . . 23.36 110.747 -177.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 36.1 mt -61.28 -40.01 92.53 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.238 -0.892 . . . . 22.48 111.256 178.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -64.21 -40.82 96.87 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 119.287 -0.965 . . . . 25.87 110.106 179.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' MET . . . . . . . . . . . . . 58.7 ttm -62.45 -49.12 76.68 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.125 -0.694 . . . . 36.59 109.125 179.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -61.3 -41.52 97.12 Favored 'General case' 0 C--O 1.211 -0.964 0 C-N-CA 119.731 -0.788 . . . . 37.12 112.739 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -62.24 -38.49 89.43 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.574 0.702 . . . . 19.31 109.708 -179.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -61.55 -42.01 98.21 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.802 -1.09 . . . . 22.16 111.195 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -70.42 -36.59 74.11 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.341 0.591 . . . . 20.71 110.789 -179.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 27.1 mt -64.63 -42.84 95.19 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 119.137 -1.025 . . . . 19.96 108.258 -179.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 60.8 mtt85 -59.31 -44.14 92.59 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 120.462 -0.495 . . . . 29.4 111.026 179.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -61.35 -38.27 86.33 Favored 'General case' 0 C--O 1.249 1.072 0 C-N-CA 120.205 -0.598 . . . . 35.33 109.567 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -68.34 -38.3 81.36 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.832 -0.622 . . . . 31.22 110.835 -179.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 49.5 mt -65.68 -37.19 85.79 Favored 'General case' 0 C--O 1.225 -0.199 0 N-CA-C 106.751 -1.574 . . . . 19.21 106.751 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -66.9 -52.87 37.97 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.416 -0.514 . . . . 46.06 110.75 178.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -54.71 -46.44 74.19 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 107.679 -1.23 . . . . 24.97 107.679 179.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -59.98 -38.31 82.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 120.653 -0.419 . . . . 20.73 111.437 179.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 12.8 t -57.62 -46.47 84.06 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.023 0.44 . . . . 33.23 111.218 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -56.51 -42.38 78.28 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 112.912 0.708 . . . . 26.76 112.912 179.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' HIS . . . . . . . . . . . . . 30.7 m-70 -70.84 -36.78 73.04 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 120.189 -0.604 . . . . 25.75 110.175 -179.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.5 mt -61.49 -47.13 87.03 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-O 122.028 0.918 . . . . 23.64 109.919 179.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 39.0 m -57.35 -53.3 59.72 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 119.198 -1.001 . . . . 31.44 110.812 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -49.68 -42.88 46.71 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 119.961 -0.696 . . . . 46.98 111.302 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' LEU . . . . . 0.43 HD12 HD12 ' A' ' 34' ' ' LEU . 17.2 mt -66.94 -37.79 84.94 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 116.028 -0.533 . . . . 24.94 111.312 179.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -71.56 -37.97 71.02 Favored 'General case' 0 CA--C 1.505 -0.767 0 C-N-CA 119.944 -0.702 . . . . 30.69 110.693 -179.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 87.7 m -64.41 -40.63 96.15 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 119.505 -0.878 . . . . 23.08 109.225 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -64.84 -41.34 95.8 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.472 -0.491 . . . . 31.74 111.152 179.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.61 -47.88 81.84 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 119.89 -0.724 . . . . 19.55 109.726 -179.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 67.0 m -57.13 -42.27 80.63 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.802 -0.635 . . . . 25.38 111.389 179.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -63.38 -41.69 98.81 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.267 0.556 . . . . 24.5 110.051 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.82 -45.22 95.29 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 107.78 -1.192 . . . . 45.33 107.78 179.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -63.17 -44.95 94.03 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.303 -0.862 . . . . 33.6 110.87 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 32.6 tp10 -63.48 -39.37 94.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.964 -0.562 . . . . 25.07 111.202 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' VAL . . . . . . . . . . . . . 39.7 t -69.2 -39.7 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 111.768 0.284 . . . . 21.51 111.768 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 92.4 mt -65.44 -30.72 71.55 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.278 0.561 . . . . 26.54 109.499 -179.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -67.74 -48.94 65.02 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.471 -0.786 . . . . 36.79 109.195 179.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -62.97 -38.47 91.25 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 119.496 -0.882 . . . . 22.95 110.535 -179.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 87.9 mt -64.72 -43.04 94.71 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.062 -0.718 . . . . 22.33 109.062 179.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . 45.0 tt0 -58.74 -41.71 87.12 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 112.566 0.58 . . . . 38.43 112.566 -178.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.55 21.48 4.47 Favored Glycine 0 C--O 1.213 -1.158 0 C-N-CA 119.895 -1.145 . . . . 28.76 113.157 -179.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' SER . . . . . . . . . . . . . 49.9 m -109.53 -47.12 3.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 117.255 0.528 . . . . 40.78 112.165 -179.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.6 ' OXT' HG23 ' B' ' 55' ' ' ILE . 3.6 tp . . . . . 0 C--O 1.243 0.716 0 CA-C-O 116.703 -1.618 . . . . 45.16 111.162 -178.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 423' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_