data_1f1f_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 1f1f _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' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.503 2.221 0 N-CA-C 111.798 0.295 . . . . 38.66 111.798 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 51.5 t -79.98 -31.96 13.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 C-N-CA 120.709 -0.396 . . . . 31.02 110.053 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.22 -36.25 74.42 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 108.255 -1.017 . . . . 26.46 108.255 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.03 -44.41 72.75 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.835 -1.172 . . . . 21.49 107.835 178.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -58.93 -31.92 69.36 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.522 -0.763 . . . . 20.05 112.445 179.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.05 -41.71 99.54 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.037 0.446 . . . . 19.53 110.061 179.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 62.9 m -68.2 -40.2 82.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.713 -0.676 . . . . 22.29 112.126 -179.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 98.8 t -65.26 -36.35 77.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 107.986 -1.116 . . . . 14.98 107.986 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -66.36 -49.18 67.76 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 113.989 1.107 . . . . 14.42 113.989 -179.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.4 p -74.6 -18.45 60.56 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 118.199 -1.4 . . . . 17.93 113.186 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.81 -20.5 24.6 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.882 0.327 . . . . 14.7 111.882 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -129.98 -11.36 4.27 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 115.589 1.7 . . . . 17.54 115.589 -178.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.8 m -124.74 -34.15 2.87 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 118.636 2.828 . . . . 15.92 118.636 -175.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.84 -29.87 8.8 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 114.073 1.138 . . . . 16.56 114.073 -178.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.18 -35.33 62.2 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.082 0.401 . . . . 22.25 112.082 179.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.7 m -116.0 -27.23 7.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 113.536 0.939 . . . . 21.89 113.536 -179.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -112.04 35.48 3.72 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.302 0.853 . . . . 26.17 113.302 -178.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 44.0 ttm -53.89 131.57 40.25 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 108.543 -0.91 . . . . 49.16 108.543 178.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.94 22.5 64.72 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.737 -0.744 . . . . 32.22 114.326 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.91 25.43 75.77 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.438 -0.887 . . . . 32.03 115.12 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -105.45 -158.74 0.67 Allowed 'General case' 0 C--O 1.24 0.598 0 CA-C-N 117.379 0.59 . . . . 47.87 109.607 179.244 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -149.39 87.48 1.52 Allowed 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.26 0.553 . . . . 30.85 109.689 179.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 76.3 t -50.86 -34.41 13.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.555 0.946 . . . . 35.63 113.555 -179.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ILE . . . . . 0.5 ' N ' ' CD1' ' A' ' 25' ' ' ILE . 1.1 mp -80.96 -57.64 4.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 112.904 0.705 . . . . 36.41 112.904 -178.706 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.7 t -112.18 91.62 1.8 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.486 0 N-CA-C 108.529 -0.915 . . . . 32.69 108.529 179.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -37.79 -47.33 1.0 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 118.805 2.891 . . . . 34.47 118.805 -177.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.2 p-10 -85.58 11.37 10.85 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 116.453 2.02 . . . . 42.08 116.453 -177.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -114.68 52.33 0.85 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.94 0.718 . . . . 37.27 112.94 179.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.7 p -72.37 175.7 5.95 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 114.038 1.125 . . . . 28.0 114.038 -179.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.3 mt -103.01 37.02 2.05 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 108.208 -1.034 . . . . 24.39 108.208 179.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 24.7 p -85.33 159.46 20.03 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 105.993 -1.854 . . . . 24.59 105.993 178.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -52.81 -50.82 62.9 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.468 0.652 . . . . 35.13 109.912 179.799 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.49 -52.78 63.99 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.405 -0.816 . . . . 34.61 113.107 -179.294 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -61.45 -45.78 92.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.08 -0.509 . . . . 33.86 112.024 -179.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -34.66 72.37 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.837 -0.801 . . . . 27.71 108.837 178.382 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -74.03 -51.93 14.31 Favored 'General case' 0 C--O 1.241 0.621 0 C-N-CA 120.303 -0.559 . . . . 31.27 109.822 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.2 mtmt -57.62 -43.39 84.75 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 114.85 1.426 . . . . 42.68 114.85 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -106.23 -21.3 13.15 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 119.651 3.204 . . . . 35.83 119.651 -177.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mt -85.27 109.66 18.51 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 116.198 1.925 . . . . 37.35 116.198 -179.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -52.31 136.95 29.98 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.928 -0.578 . . . . 47.55 111.252 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 69.22 -5.02 5.47 Favored Glycine 0 CA--C 1.519 0.319 0 N-CA-C 115.466 0.946 . . . . 36.41 115.466 178.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -50.68 -45.52 58.23 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 120.301 -0.56 . . . . 35.65 109.493 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -75.97 15.82 0.49 Allowed 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.64 -0.709 . . . . 44.09 112.748 -178.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -119.96 -46.13 2.44 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 124.275 1.03 . . . . 44.03 109.299 178.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -159.42 93.24 1.1 Allowed 'General case' 0 C--O 1.235 0.33 0 N-CA-C 104.991 -2.226 . . . . 34.97 104.991 179.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.54 -56.18 7.63 Favored 'General case' 0 C--O 1.24 0.567 0 N-CA-C 115.233 1.568 . . . . 29.06 115.233 -177.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.7 t -60.54 -45.16 97.56 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 N-CA-C 112.196 0.443 . . . . 22.77 112.196 -179.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.4 -40.06 89.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.092 0.472 . . . . 20.28 111.124 -179.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.59 -43.13 90.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.291 -0.413 . . . . 18.19 111.242 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 55.6 t -68.33 -43.13 84.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.248 -0.433 . . . . 16.0 110.189 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.91 -30.41 67.79 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.508 -0.769 . . . . 17.55 109.477 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -70.75 -50.72 33.04 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.935 0.717 . . . . 24.44 112.935 -179.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLN . . . . . 0.416 ' O ' ' N ' ' A' ' 58' ' ' GLY . 0.0 OUTLIER -63.26 -30.6 71.71 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.291 -0.633 . . . . 37.41 109.291 179.956 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.5 t -70.66 -45.98 71.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.875 0.369 . . . . 22.36 110.928 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 98.6 m -63.38 -43.23 98.21 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.597 0.591 . . . . 26.5 112.597 179.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 56.7 m-20 -102.2 -42.52 6.01 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 115.222 1.564 . . . . 33.83 115.222 -178.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 54' ' ' GLN . . . 69.23 -172.2 38.28 Favored Glycine 0 C--O 1.24 0.504 0 C-N-CA 120.469 -0.872 . . . . 39.31 111.98 -179.462 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LYS . . . . . 0.568 ' NZ ' ' ND2' ' A' ' 60' ' ' ASN . 12.5 ptmm? -173.87 155.71 2.65 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.804 0.335 . . . . 46.93 111.58 179.045 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASN . . . . . 0.568 ' ND2' ' NZ ' ' A' ' 59' ' ' LYS . 27.6 m-20 46.3 -123.24 1.25 Allowed 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.197 0.443 . . . . 41.45 112.197 -179.905 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.86 -8.04 56.61 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.909 0.337 . . . . 32.77 111.909 -178.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 10.9 tpt -87.37 112.35 47.51 Favored Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 108.54 -0.911 . . . . 28.87 108.54 179.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.68 154.3 39.27 Favored 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 120.353 0.702 . . . . 24.83 112.906 179.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -88.99 154.13 24.26 Favored Glycine 0 C--O 1.224 -0.503 0 N-CA-C 107.124 -2.39 . . . . 22.44 107.124 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -119.65 8.69 11.27 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 117.973 0.886 . . . . 21.41 112.347 -178.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -41.38 -41.41 1.98 Allowed 'General case' 0 C--O 1.237 0.427 0 N-CA-C 115.273 1.582 . . . . 30.91 115.273 -179.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -90.93 -27.93 17.33 Favored Glycine 0 CA--C 1.524 0.594 0 C-N-CA 118.43 -1.843 . . . . 28.46 114.864 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 28.8 mtp180 -82.93 -39.74 21.05 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 115.569 1.692 . . . . 76.96 115.569 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.76 149.22 25.21 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.334 0.588 . . . . 24.59 111.823 179.957 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 86.5 p -81.35 158.29 69.34 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 107.936 -1.135 . . . . 17.89 107.936 178.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -55.4 -39.54 90.44 Favored 'Trans proline' 0 C--O 1.236 0.412 0 N-CA-C 110.096 -0.771 . . . . 16.36 110.096 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 13.7 tp -62.2 -48.25 80.86 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.881 -1.054 . . . . 33.5 111.946 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -62.22 -31.45 72.0 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 110.551 -0.166 . . . . 19.98 110.551 179.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.6 mt -71.89 -48.91 48.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.697 0 C-N-CA 123.299 0.639 . . . . 20.95 110.824 -179.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -62.22 -29.6 70.5 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 119.644 -0.823 . . . . 40.28 109.591 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -72.73 -41.7 64.89 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 113.243 0.831 . . . . 22.77 113.243 -179.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 8.8 p -73.2 -30.0 29.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 108.675 -0.861 . . . . 15.94 108.675 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.84 -48.24 72.29 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.465 -0.789 . . . . 15.19 110.572 178.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.64 -37.73 87.51 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.142 -0.688 . . . . 15.92 109.142 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -64.07 -45.34 89.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.941 -0.572 . . . . 19.51 110.584 -179.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 t -63.6 -46.67 94.24 Favored 'Isoleucine or valine' 0 C--O 1.24 0.571 0 CA-C-N 115.704 -0.68 . . . . 17.69 111.22 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 83.5 t -62.16 -41.21 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 107.479 -1.304 . . . . 20.45 107.479 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -59.94 -45.52 92.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.139 0.495 . . . . 30.0 112.18 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 27.0 mm100 -68.92 -36.86 78.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.65 -0.705 . . . . 23.18 112.649 -179.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.09 -51.02 66.01 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.242 -1.021 . . . . 29.48 108.242 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -60.92 -26.83 67.76 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 113.132 0.79 . . . . 35.41 113.132 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -92.11 -10.65 38.19 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 113.131 0.789 . . . . 63.43 113.131 179.187 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 93.34 4.47 64.3 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 117.96 1.944 . . . . 34.88 117.96 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' TRP . . . . . . . . . . . . . 97.5 m95 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 117.651 -1.166 . . . . 33.68 113.459 179.279 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.503 2.221 0 N-CA-C 111.798 0.295 . . . . 38.66 111.798 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 51.5 t -79.98 -31.96 13.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 C-N-CA 120.709 -0.396 . . . . 31.02 110.053 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.22 -36.25 74.42 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 108.255 -1.017 . . . . 26.46 108.255 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.03 -44.41 72.75 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.835 -1.172 . . . . 21.49 107.835 178.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -58.93 -31.92 69.36 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.522 -0.763 . . . . 20.05 112.445 179.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.05 -41.71 99.54 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.037 0.446 . . . . 19.53 110.061 179.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 62.9 m -68.2 -40.2 82.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.713 -0.676 . . . . 22.29 112.126 -179.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 98.8 t -65.26 -36.35 77.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 107.986 -1.116 . . . . 14.98 107.986 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PHE . . . . . 0.42 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 66.6 t80 -66.36 -49.18 67.76 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 113.989 1.107 . . . . 14.42 113.989 -179.306 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.4 p -74.6 -18.45 60.56 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 118.199 -1.4 . . . . 17.93 113.186 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.81 -20.5 24.6 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.882 0.327 . . . . 14.7 111.882 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -129.98 -11.36 4.27 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 115.589 1.7 . . . . 17.54 115.589 -178.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' CYS . . . . . 0.42 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 1.8 m -124.74 -34.15 2.87 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 118.636 2.828 . . . . 15.92 118.636 -175.309 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.84 -29.87 8.8 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 114.073 1.138 . . . . 16.56 114.073 -178.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.18 -35.33 62.2 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.082 0.401 . . . . 22.25 112.082 179.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.7 m -116.0 -27.23 7.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 113.536 0.939 . . . . 21.89 113.536 -179.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -112.04 35.48 3.72 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.302 0.853 . . . . 26.17 113.302 -178.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' MET . . . . . 0.721 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 44.0 ttm -53.89 131.57 40.25 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 108.543 -0.91 . . . . 49.16 108.543 178.929 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.94 22.5 64.72 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.737 -0.744 . . . . 32.22 114.326 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.91 25.43 75.77 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.438 -0.887 . . . . 32.03 115.12 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ARG . . . . . 0.721 ' HG3' ' O ' ' A' ' 19' ' ' MET . 0.9 OUTLIER -105.45 -158.74 0.67 Allowed 'General case' 0 C--O 1.24 0.598 0 CA-C-N 117.379 0.59 . . . . 47.87 109.607 179.244 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -149.39 87.48 1.52 Allowed 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.26 0.553 . . . . 30.85 109.689 179.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 76.3 t -50.86 -34.41 13.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.555 0.946 . . . . 35.63 113.555 -179.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ILE . . . . . 0.626 ' N ' HD12 ' A' ' 25' ' ' ILE . 1.1 mp -80.96 -57.64 4.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 112.904 0.705 . . . . 36.41 112.904 -178.706 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.7 t -112.18 91.62 1.8 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.486 0 N-CA-C 108.529 -0.915 . . . . 32.69 108.529 179.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -37.79 -47.33 1.0 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 118.805 2.891 . . . . 34.47 118.805 -177.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.2 p-10 -85.58 11.37 10.85 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 116.453 2.02 . . . . 42.08 116.453 -177.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -114.68 52.33 0.85 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.94 0.718 . . . . 37.27 112.94 179.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.7 p -72.37 175.7 5.95 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 114.038 1.125 . . . . 28.0 114.038 -179.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.3 mt -103.01 37.02 2.05 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 108.208 -1.034 . . . . 24.39 108.208 179.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 24.7 p -85.33 159.46 20.03 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 105.993 -1.854 . . . . 24.59 105.993 178.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -52.81 -50.82 62.9 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.468 0.652 . . . . 35.13 109.912 179.799 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.49 -52.78 63.99 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.405 -0.816 . . . . 34.61 113.107 -179.294 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -61.45 -45.78 92.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.08 -0.509 . . . . 33.86 112.024 -179.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . 0.558 ' O ' ' HB2' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.17 -34.66 72.37 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.837 -0.801 . . . . 27.71 108.837 178.382 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -74.03 -51.93 14.31 Favored 'General case' 0 C--O 1.241 0.621 0 C-N-CA 120.303 -0.559 . . . . 31.27 109.822 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.2 mtmt -57.62 -43.39 84.75 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 114.85 1.426 . . . . 42.68 114.85 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -106.23 -21.3 13.15 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 119.651 3.204 . . . . 35.83 119.651 -177.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . 0.558 ' HB2' ' O ' ' A' ' 36' ' ' LEU . 4.4 mt -85.27 109.66 18.51 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 116.198 1.925 . . . . 37.35 116.198 -179.768 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -52.31 136.95 29.98 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.928 -0.578 . . . . 47.55 111.252 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . 0.441 ' O ' ' HB2' ' A' ' 45' ' ' ASP . . . 69.22 -5.02 5.47 Favored Glycine 0 CA--C 1.519 0.319 0 N-CA-C 115.466 0.946 . . . . 36.41 115.466 178.476 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -50.68 -45.52 58.23 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 120.301 -0.56 . . . . 35.65 109.493 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -75.97 15.82 0.49 Allowed 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.64 -0.709 . . . . 44.09 112.748 -178.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 42' ' ' GLY . 41.6 m-20 -119.96 -46.13 2.44 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 124.275 1.03 . . . . 44.03 109.299 178.731 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -159.42 93.24 1.1 Allowed 'General case' 0 C--O 1.235 0.33 0 N-CA-C 104.991 -2.226 . . . . 34.97 104.991 179.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.54 -56.18 7.63 Favored 'General case' 0 C--O 1.24 0.567 0 N-CA-C 115.233 1.568 . . . . 29.06 115.233 -177.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.7 t -60.54 -45.16 97.56 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 N-CA-C 112.196 0.443 . . . . 22.77 112.196 -179.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.4 -40.06 89.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.092 0.472 . . . . 20.28 111.124 -179.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.59 -43.13 90.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.291 -0.413 . . . . 18.19 111.242 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 55.6 t -68.33 -43.13 84.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.248 -0.433 . . . . 16.0 110.189 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.91 -30.41 67.79 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.508 -0.769 . . . . 17.55 109.477 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -70.75 -50.72 33.04 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.935 0.717 . . . . 24.44 112.935 -179.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLN . . . . . 0.42 HE21 ' HG2' ' A' ' 62' ' ' MET . 2.7 tp60 -63.26 -30.6 71.71 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.291 -0.633 . . . . 37.41 109.291 179.956 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.5 t -70.66 -45.98 71.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.875 0.369 . . . . 22.36 110.928 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 98.6 m -63.38 -43.23 98.21 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.597 0.591 . . . . 26.5 112.597 179.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 56.7 m-20 -102.2 -42.52 6.01 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 115.222 1.564 . . . . 33.83 115.222 -178.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 54' ' ' GLN . . . 69.23 -172.2 38.28 Favored Glycine 0 C--O 1.24 0.504 0 C-N-CA 120.469 -0.872 . . . . 39.31 111.98 -179.462 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LYS . . . . . 0.404 ' O ' ' HB3' ' A' ' 62' ' ' MET . 12.5 ptmm? -173.87 155.71 2.65 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.804 0.335 . . . . 46.93 111.58 179.045 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.4 m120 46.3 -123.24 1.25 Allowed 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.197 0.443 . . . . 41.45 112.197 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.86 -8.04 56.61 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.909 0.337 . . . . 32.77 111.909 -178.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' MET . . . . . 0.42 ' HG2' HE21 ' A' ' 54' ' ' GLN . 10.9 tpt -87.37 112.35 47.51 Favored Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 108.54 -0.911 . . . . 28.87 108.54 179.091 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.68 154.3 39.27 Favored 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 120.353 0.702 . . . . 24.83 112.906 179.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -88.99 154.13 24.26 Favored Glycine 0 C--O 1.224 -0.503 0 N-CA-C 107.124 -2.39 . . . . 22.44 107.124 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -119.65 8.69 11.27 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 117.973 0.886 . . . . 21.41 112.347 -178.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -41.38 -41.41 1.98 Allowed 'General case' 0 C--O 1.237 0.427 0 N-CA-C 115.273 1.582 . . . . 30.91 115.273 -179.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -90.93 -27.93 17.33 Favored Glycine 0 CA--C 1.524 0.594 0 C-N-CA 118.43 -1.843 . . . . 28.46 114.864 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 28.8 mtp180 -82.93 -39.74 21.05 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 115.569 1.692 . . . . 76.96 115.569 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.76 149.22 25.21 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.334 0.588 . . . . 24.59 111.823 179.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' SER . . . . . 0.437 ' OG ' ' HG3' ' A' ' 73' ' ' GLN . 86.5 p -81.35 158.29 69.34 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 107.936 -1.135 . . . . 17.89 107.936 178.851 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -55.4 -39.54 90.44 Favored 'Trans proline' 0 C--O 1.236 0.412 0 N-CA-C 110.096 -0.771 . . . . 16.36 110.096 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 13.7 tp -62.2 -48.25 80.86 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.881 -1.054 . . . . 33.5 111.946 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLN . . . . . 0.437 ' HG3' ' OG ' ' A' ' 70' ' ' SER . 81.7 mt-30 -62.22 -31.45 72.0 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 110.551 -0.166 . . . . 19.98 110.551 179.548 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.6 mt -71.89 -48.91 48.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.697 0 C-N-CA 123.299 0.639 . . . . 20.95 110.824 -179.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -62.22 -29.6 70.5 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 119.644 -0.823 . . . . 40.28 109.591 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -72.73 -41.7 64.89 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 113.243 0.831 . . . . 22.77 113.243 -179.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 8.8 p -73.2 -30.0 29.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 108.675 -0.861 . . . . 15.94 108.675 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.84 -48.24 72.29 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.465 -0.789 . . . . 15.19 110.572 178.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.64 -37.73 87.51 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.142 -0.688 . . . . 15.92 109.142 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -64.07 -45.34 89.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.941 -0.572 . . . . 19.51 110.584 -179.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 t -63.6 -46.67 94.24 Favored 'Isoleucine or valine' 0 C--O 1.24 0.571 0 CA-C-N 115.704 -0.68 . . . . 17.69 111.22 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 83.5 t -62.16 -41.21 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 107.479 -1.304 . . . . 20.45 107.479 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -59.94 -45.52 92.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.139 0.495 . . . . 30.0 112.18 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 27.0 mm100 -68.92 -36.86 78.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.65 -0.705 . . . . 23.18 112.649 -179.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.09 -51.02 66.01 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.242 -1.021 . . . . 29.48 108.242 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -60.92 -26.83 67.76 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 113.132 0.79 . . . . 35.41 113.132 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -92.11 -10.65 38.19 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 113.131 0.789 . . . . 63.43 113.131 179.187 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 93.34 4.47 64.3 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 117.96 1.944 . . . . 34.88 117.96 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' TRP . . . . . . . . . . . . . 97.5 m95 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 117.651 -1.166 . . . . 33.68 113.459 179.279 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 200' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.503 2.221 0 N-CA-C 111.798 0.295 . . . . 38.66 111.798 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 51.5 t -79.98 -31.96 13.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 C-N-CA 120.709 -0.396 . . . . 31.02 110.053 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.22 -36.25 74.42 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 108.255 -1.017 . . . . 26.46 108.255 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.03 -44.41 72.75 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.835 -1.172 . . . . 21.49 107.835 178.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -58.93 -31.92 69.36 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.522 -0.763 . . . . 20.05 112.445 179.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.05 -41.71 99.54 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.037 0.446 . . . . 19.53 110.061 179.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 62.9 m -68.2 -40.2 82.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.713 -0.676 . . . . 22.29 112.126 -179.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 98.8 t -65.26 -36.35 77.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 107.986 -1.116 . . . . 14.98 107.986 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.42 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 66.6 t80 -66.36 -49.18 67.76 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 113.989 1.107 . . . . 14.42 113.989 -179.306 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.4 p -74.6 -18.45 60.56 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 118.199 -1.4 . . . . 17.93 113.186 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.81 -20.5 24.6 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.882 0.327 . . . . 14.7 111.882 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -129.98 -11.36 4.27 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 115.589 1.7 . . . . 17.54 115.589 -178.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.42 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 1.8 m -124.74 -34.15 2.87 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 118.636 2.828 . . . . 15.92 118.636 -175.309 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.84 -29.87 8.8 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 114.073 1.138 . . . . 16.56 114.073 -178.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.18 -35.33 62.2 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.082 0.401 . . . . 22.25 112.082 179.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.7 m -116.0 -27.23 7.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 113.536 0.939 . . . . 21.89 113.536 -179.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -112.04 35.48 3.72 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.302 0.853 . . . . 26.17 113.302 -178.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . 0.721 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 44.0 ttm -53.89 131.57 40.25 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 108.543 -0.91 . . . . 49.16 108.543 178.929 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.94 22.5 64.72 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.737 -0.744 . . . . 32.22 114.326 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.91 25.43 75.77 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.438 -0.887 . . . . 32.03 115.12 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.721 ' HG3' ' O ' ' A' ' 19' ' ' MET . 0.9 OUTLIER -105.45 -158.74 0.67 Allowed 'General case' 0 C--O 1.24 0.598 0 CA-C-N 117.379 0.59 . . . . 47.87 109.607 179.244 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -149.39 87.48 1.52 Allowed 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.26 0.553 . . . . 30.85 109.689 179.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 76.3 t -50.86 -34.41 13.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.555 0.946 . . . . 35.63 113.555 -179.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.626 ' N ' HD12 ' A' ' 25' ' ' ILE . 1.1 mp -80.96 -57.64 4.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 112.904 0.705 . . . . 36.41 112.904 -178.706 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.7 t -112.18 91.62 1.8 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.486 0 N-CA-C 108.529 -0.915 . . . . 32.69 108.529 179.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -37.79 -47.33 1.0 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 118.805 2.891 . . . . 34.47 118.805 -177.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.2 p-10 -85.58 11.37 10.85 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 116.453 2.02 . . . . 42.08 116.453 -177.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -114.68 52.33 0.85 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.94 0.718 . . . . 37.27 112.94 179.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.7 p -72.37 175.7 5.95 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 114.038 1.125 . . . . 28.0 114.038 -179.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.3 mt -103.01 37.02 2.05 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 108.208 -1.034 . . . . 24.39 108.208 179.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 24.7 p -85.33 159.46 20.03 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 105.993 -1.854 . . . . 24.59 105.993 178.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -52.81 -50.82 62.9 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.468 0.652 . . . . 35.13 109.912 179.799 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.49 -52.78 63.99 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.405 -0.816 . . . . 34.61 113.107 -179.294 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -61.45 -45.78 92.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.08 -0.509 . . . . 33.86 112.024 -179.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.558 ' O ' ' HB2' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.17 -34.66 72.37 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.837 -0.801 . . . . 27.71 108.837 178.382 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -74.03 -51.93 14.31 Favored 'General case' 0 C--O 1.241 0.621 0 C-N-CA 120.303 -0.559 . . . . 31.27 109.822 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.2 mtmt -57.62 -43.39 84.75 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 114.85 1.426 . . . . 42.68 114.85 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -106.23 -21.3 13.15 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 119.651 3.204 . . . . 35.83 119.651 -177.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.558 ' HB2' ' O ' ' A' ' 36' ' ' LEU . 4.4 mt -85.27 109.66 18.51 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 116.198 1.925 . . . . 37.35 116.198 -179.768 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -52.31 136.95 29.98 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.928 -0.578 . . . . 47.55 111.252 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.441 ' O ' ' HB2' ' A' ' 45' ' ' ASP . . . 69.22 -5.02 5.47 Favored Glycine 0 CA--C 1.519 0.319 0 N-CA-C 115.466 0.946 . . . . 36.41 115.466 178.476 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -50.68 -45.52 58.23 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 120.301 -0.56 . . . . 35.65 109.493 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -75.97 15.82 0.49 Allowed 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.64 -0.709 . . . . 44.09 112.748 -178.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 42' ' ' GLY . 41.6 m-20 -119.96 -46.13 2.44 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 124.275 1.03 . . . . 44.03 109.299 178.731 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -159.42 93.24 1.1 Allowed 'General case' 0 C--O 1.235 0.33 0 N-CA-C 104.991 -2.226 . . . . 34.97 104.991 179.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.54 -56.18 7.63 Favored 'General case' 0 C--O 1.24 0.567 0 N-CA-C 115.233 1.568 . . . . 29.06 115.233 -177.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.7 t -60.54 -45.16 97.56 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 N-CA-C 112.196 0.443 . . . . 22.77 112.196 -179.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.4 -40.06 89.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.092 0.472 . . . . 20.28 111.124 -179.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.59 -43.13 90.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.291 -0.413 . . . . 18.19 111.242 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 55.6 t -68.33 -43.13 84.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.248 -0.433 . . . . 16.0 110.189 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.91 -30.41 67.79 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.508 -0.769 . . . . 17.55 109.477 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -70.75 -50.72 33.04 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.935 0.717 . . . . 24.44 112.935 -179.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.416 ' O ' ' N ' ' A' ' 58' ' ' GLY . 0.0 OUTLIER -63.26 -30.6 71.71 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.291 -0.633 . . . . 37.41 109.291 179.956 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.5 t -70.66 -45.98 71.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.875 0.369 . . . . 22.36 110.928 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 98.6 m -63.38 -43.23 98.21 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.597 0.591 . . . . 26.5 112.597 179.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 56.7 m-20 -102.2 -42.52 6.01 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 115.222 1.564 . . . . 33.83 115.222 -178.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 54' ' ' GLN . . . 69.23 -172.2 38.28 Favored Glycine 0 C--O 1.24 0.504 0 C-N-CA 120.469 -0.872 . . . . 39.31 111.98 -179.462 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.679 ' HZ3' ' ND2' ' A' ' 60' ' ' ASN . 12.5 ptmm? -173.87 155.71 2.65 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.804 0.335 . . . . 46.93 111.58 179.045 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.679 ' ND2' ' HZ3' ' A' ' 59' ' ' LYS . 27.6 m-20 46.3 -123.24 1.25 Allowed 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.197 0.443 . . . . 41.45 112.197 -179.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.86 -8.04 56.61 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.909 0.337 . . . . 32.77 111.909 -178.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' MET . . . . . 0.404 ' HB3' ' O ' ' A' ' 59' ' ' LYS . 10.9 tpt -87.37 112.35 47.51 Favored Pre-proline 0 C--N 1.33 -0.27 0 N-CA-C 108.54 -0.911 . . . . 28.87 108.54 179.091 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.68 154.3 39.27 Favored 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 120.353 0.702 . . . . 24.83 112.906 179.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -88.99 154.13 24.26 Favored Glycine 0 C--O 1.224 -0.503 0 N-CA-C 107.124 -2.39 . . . . 22.44 107.124 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -119.65 8.69 11.27 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 117.973 0.886 . . . . 21.41 112.347 -178.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -41.38 -41.41 1.98 Allowed 'General case' 0 C--O 1.237 0.427 0 N-CA-C 115.273 1.582 . . . . 30.91 115.273 -179.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -90.93 -27.93 17.33 Favored Glycine 0 CA--C 1.524 0.594 0 C-N-CA 118.43 -1.843 . . . . 28.46 114.864 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 28.8 mtp180 -82.93 -39.74 21.05 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 115.569 1.692 . . . . 76.96 115.569 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.76 149.22 25.21 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.334 0.588 . . . . 24.59 111.823 179.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' SER . . . . . 0.872 ' H ' HE21 ' A' ' 73' ' ' GLN . 86.5 p -81.35 158.29 69.34 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 107.936 -1.135 . . . . 17.89 107.936 178.851 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -55.4 -39.54 90.44 Favored 'Trans proline' 0 C--O 1.236 0.412 0 N-CA-C 110.096 -0.771 . . . . 16.36 110.096 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 13.7 tp -62.2 -48.25 80.86 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 114.881 -1.054 . . . . 33.5 111.946 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.872 HE21 ' H ' ' A' ' 70' ' ' SER . 34.9 mt-30 -62.22 -31.45 72.0 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 110.551 -0.166 . . . . 19.98 110.551 179.548 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.6 mt -71.89 -48.91 48.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.697 0 C-N-CA 123.299 0.639 . . . . 20.95 110.824 -179.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -62.22 -29.6 70.5 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 119.644 -0.823 . . . . 40.28 109.591 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -72.73 -41.7 64.89 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 113.243 0.831 . . . . 22.77 113.243 -179.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 8.8 p -73.2 -30.0 29.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 108.675 -0.861 . . . . 15.94 108.675 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.84 -48.24 72.29 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.465 -0.789 . . . . 15.19 110.572 178.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.64 -37.73 87.51 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.142 -0.688 . . . . 15.92 109.142 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -64.07 -45.34 89.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.941 -0.572 . . . . 19.51 110.584 -179.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 t -63.6 -46.67 94.24 Favored 'Isoleucine or valine' 0 C--O 1.24 0.571 0 CA-C-N 115.704 -0.68 . . . . 17.69 111.22 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 83.5 t -62.16 -41.21 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 107.479 -1.304 . . . . 20.45 107.479 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -59.94 -45.52 92.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.139 0.495 . . . . 30.0 112.18 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 27.0 mm100 -68.92 -36.86 78.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.65 -0.705 . . . . 23.18 112.649 -179.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.09 -51.02 66.01 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.242 -1.021 . . . . 29.48 108.242 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -60.92 -26.83 67.76 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 113.132 0.79 . . . . 35.41 113.132 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -92.11 -10.65 38.19 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 113.131 0.789 . . . . 63.43 113.131 179.187 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 93.34 4.47 64.3 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 117.96 1.944 . . . . 34.88 117.96 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' TRP . . . . . . . . . . . . . 97.5 m95 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 117.651 -1.166 . . . . 33.68 113.459 179.279 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_