data_6iwp_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6iwp _Structure_validation_residue.Date_analyzed 2019-12-06 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' ' ' VAL . . . . . . . . . . . . . 2.5 t . . . . . 0 N--CA 1.457 -0.09 0 N-CA-C 110.149 -0.315 . . . . 76.65 110.149 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 t -109.36 150.26 28.29 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.162 0.506 . . . . 85.47 109.713 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 99.4 m -71.98 -19.38 61.89 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.728 -0.669 . . . . 46.73 112.29 -177.971 -65.458 -29.712 -79.4 105.403 2.029 103.969 -62.163 -66.101 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -62.24 -42.49 99.72 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.049 -1.072 . . . . 50.68 112.32 175.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.65 -37.41 86.46 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 122.359 -0.494 . . . . 68.25 111.044 175.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 61.0 t -57.08 -52.14 60.03 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 CA-C-O 121.295 0.569 . . . . 51.89 110.297 175.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -63.47 -41.91 98.59 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.814 -0.354 . . . . 57.42 111.406 -179.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.35 -43.07 95.74 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.319 -0.552 . . . . 48.07 111.212 -177.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -71.72 -30.35 65.54 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.17 -0.612 . . . . 53.2 111.729 179.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.2 mt -85.78 -12.14 51.75 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.75 1.018 . . . . 63.29 113.75 -179.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -50.91 -46.75 87.56 Favored Pre-proline 0 C--O 1.241 0.632 0 N-CA-C 114.145 1.165 . . . . 51.71 114.145 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -68.5 -0.12 5.47 Favored 'Trans proline' 0 C--O 1.236 0.42 0 CA-C-N 121.54 1.586 . . . . 50.12 114.354 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' CYS . . . . . 0.428 ' O ' ' N ' ' A' ' 18' ' ' LEU . 77.3 m -96.02 -14.42 22.99 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.091 0.86 . . . . 42.66 113.202 176.997 -58.933 -67.924 97.15 103.061 2.029 102.749 63.237 166.154 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.9 t -55.4 -40.73 86.54 Favored Pre-proline 0 C--O 1.24 0.56 0 CA-C-O 118.636 -0.697 . . . . 58.35 111.622 178.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -56.71 -44.8 41.82 Favored 'Trans proline' 0 C--O 1.236 0.402 0 CA-C-N 121.366 1.524 . . . . 65.67 113.142 170.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -68.04 -39.39 83.07 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.957 -0.697 . . . . 56.84 111.265 176.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . 0.428 ' N ' ' O ' ' A' ' 14' ' ' CYS . 84.5 mt -74.69 -16.26 60.77 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 112.941 0.719 . . . . 48.21 112.941 -174.937 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 62.1 p -106.57 -25.61 11.74 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 113.71 1.004 . . . . 62.68 113.71 174.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -121.12 1.67 10.34 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 113.794 1.035 . . . . 65.7 113.794 -173.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 66.86 -147.04 49.14 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.535 -0.841 . . . . 62.63 112.605 175.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 77.66 -147.73 32.81 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-O 121.836 0.686 . . . . 69.94 111.936 -178.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -104.96 133.14 20.29 Favored Pre-proline 0 C--O 1.239 0.545 0 C-N-CA 119.075 -1.05 . . . . 72.27 109.623 175.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -68.88 135.45 32.63 Favored 'Trans proline' 0 C--N 1.333 -0.28 0 CA-C-N 119.021 0.686 . . . . 68.24 110.323 178.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.03 175.67 18.34 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.876 -0.678 . . . . 61.01 112.466 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.63 -28.71 70.1 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.288 -0.565 . . . . 51.78 111.584 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -68.01 -46.63 70.7 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.174 -0.611 . . . . 46.84 111.062 179.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.2 t -64.2 -42.94 96.43 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 119.658 -0.817 . . . . 40.36 111.321 -179.442 166.154 63.237 97.15 102.749 2.029 103.061 -67.924 -58.933 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 2.3 m -64.1 -41.64 97.19 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.423 -0.511 . . . . 52.2 111.098 178.183 -88.462 -27.969 -97.418 104.236 2.028 104.272 -46.999 -78.49 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.8 m -58.68 -40.47 83.63 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 120.824 -0.351 . . . . 52.49 111.05 175.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -67.76 -40.64 89.8 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.233 -0.984 . . . . 40.35 112.698 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 55.4 t -62.64 -44.41 99.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 C-N-CA 120.267 -0.573 . . . . 49.89 110.452 177.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.8 mtmt -67.84 -38.03 82.64 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 120.185 -0.606 . . . . 62.22 111.23 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 23.8 m -57.98 -49.02 78.24 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 121.067 -0.253 . . . . 60.49 111.309 174.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -60.96 -44.87 96.69 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.931 -0.307 . . . . 77.53 110.744 179.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -62.03 -40.1 94.58 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.244 -0.582 . . . . 81.45 111.381 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -68.72 -33.16 75.28 Favored Glycine 0 C--N 1.334 0.457 0 C-N-CA 120.381 -0.914 . . . . 54.91 113.888 -176.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -91.68 6.34 46.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 117.641 0.72 . . . . 84.81 112.871 -176.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -115.19 95.46 5.2 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.975 -1.491 . . . . 52.06 106.975 175.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -110.43 -54.75 2.55 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 113.397 0.888 . . . . 66.36 113.397 -170.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 86.0 p -72.5 158.68 87.01 Favored Pre-proline 0 N--CA 1.451 -0.382 0 O-C-N 122.021 -0.424 . . . . 68.93 110.331 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -55.68 -40.02 87.73 Favored 'Trans proline' 0 C--O 1.239 0.537 0 N-CA-C 113.093 0.382 . . . . 57.33 113.093 176.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -66.92 -36.13 81.55 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.31 -0.556 . . . . 51.43 111.099 176.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -59.71 -51.71 68.6 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.78 -0.368 . . . . 71.08 111.084 174.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 18.3 mtm180 -62.64 -34.58 77.34 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 120.706 -0.397 . . . . 76.26 111.479 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.8 mtmt -68.41 -46.27 70.4 Favored 'General case' 0 C--O 1.239 0.539 0 C-N-CA 120.425 -0.51 . . . . 66.84 111.207 177.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.5 m -56.35 -44.64 80.27 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.922 -0.311 . . . . 47.91 110.897 175.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.1 -41.3 90.81 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 120.617 -0.433 . . . . 34.56 111.27 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 45.7 t -58.37 -42.09 86.22 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 120.817 0.341 . . . . 42.34 110.984 177.36 178.828 -85.969 -80.01 104.369 2.035 105.64 -68.787 -66.357 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -75.6 -33.19 60.55 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 119.751 -0.78 . . . . 49.01 112.25 -178.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 95.2 m -58.35 -38.79 77.93 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 120.487 -0.485 . . . . 45.1 110.961 168.387 -66.101 -62.163 -79.4 103.969 2.029 105.403 -29.712 -65.458 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.0 mm -66.7 -42.33 89.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 120.877 0.37 . . . . 48.27 110.382 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -60.7 -40.19 91.32 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.434 -0.506 . . . . 49.2 111.253 175.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.55 -46.12 87.4 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 120.878 0.371 . . . . 44.96 110.91 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.62 -41.64 95.25 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.174 -0.61 . . . . 48.58 111.242 175.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.3 -35.77 78.24 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 122.143 -0.348 . . . . 43.11 111.595 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -72.2 -28.24 63.07 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.128 -0.629 . . . . 46.37 111.362 174.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.6 ttp180 -68.73 -30.53 69.19 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 120.147 -0.621 . . . . 62.53 111.591 171.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -113.96 60.12 0.92 Allowed Pre-proline 0 C--O 1.238 0.462 0 N-CA-C 109.693 -0.484 . . . . 62.8 109.693 175.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -75.55 2.22 7.14 Favored 'Trans proline' 0 C--O 1.236 0.417 0 N-CA-C 114.055 0.752 . . . . 58.51 114.055 -168.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -101.47 11.96 38.17 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.819 0.674 . . . . 68.54 112.819 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.3 mt -93.32 159.23 15.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.776 0.798 . . . . 65.64 110.69 177.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.1 mttp -86.87 135.6 33.26 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.236 -0.893 . . . . 72.5 109.752 174.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . 0.41 ' OD2' ' N ' ' A' ' 84' ' ' ARG . 0.6 OUTLIER -74.94 -32.36 61.74 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 120.242 -0.583 . . . . 81.55 111.606 179.914 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . . . -59.98 -25.75 65.49 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.566 -0.454 . . . . 74.77 111.277 175.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.57 -50.4 63.23 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.861 -0.336 . . . . 78.67 111.092 175.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.55 -19.22 62.19 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.59 0.589 . . . . 68.91 112.59 -178.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -73.77 -26.03 60.45 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 118.319 -1.352 . . . . 83.18 111.845 177.56 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.0 p -76.01 2.51 12.52 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 112.624 0.601 . . . . 79.43 112.624 175.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.19 -50.29 5.13 Favored Pre-proline 0 C--O 1.245 0.834 0 CA-C-O 118.463 -0.779 . . . . 81.55 112.734 -175.723 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -63.5 -39.83 34.1 Favored 'Trans proline' 0 C--O 1.237 0.472 0 CA-C-N 121.367 1.524 . . . . 84.23 113.334 -178.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.3 m -63.78 -37.57 87.85 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.432 -0.507 . . . . 78.69 111.308 179.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -80.86 -12.77 59.36 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 112.933 0.716 . . . . 86.97 112.933 178.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 32.8 m -107.4 -10.68 15.7 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 113.296 0.85 . . . . 76.22 113.296 175.753 -78.49 -46.999 -97.418 104.272 2.028 104.236 -27.969 -88.462 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 114.83 -35.46 4.39 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 114.829 0.692 . . . . 77.83 114.829 175.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.1 mt -75.3 154.21 6.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 121.64 0.734 . . . . 80.93 110.577 -172.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 19.4 m -115.71 99.28 7.2 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 107.138 -1.431 . . . . 79.4 107.138 170.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.0 mt -73.67 164.54 26.51 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 122.027 0.917 . . . . 78.45 111.135 -174.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -94.94 2.8 55.43 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.12 -0.945 . . . . 67.9 112.92 -179.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 3.5 m -138.39 148.58 59.86 Favored Pre-proline 0 C--O 1.239 0.517 0 CA-C-O 121.816 0.817 . . . . 71.82 109.349 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -67.85 133.02 28.1 Favored 'Trans proline' 0 CA--C 1.515 -0.471 0 N-CA-C 108.863 -1.245 . . . . 77.13 108.863 165.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -84.48 96.6 4.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 N-CA-C 106.498 -1.668 . . . . 77.19 106.498 173.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.6 p -144.5 142.26 30.12 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.254 -1.387 . . . . 64.54 107.254 179.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ARG . . . . . 0.41 ' N ' ' OD2' ' A' ' 64' ' ' ASP . 5.2 ttm105 -60.67 -20.52 61.14 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.654 0.613 . . . . 63.49 112.654 -175.857 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.8 p -92.46 4.84 52.69 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.804 0.668 . . . . 56.99 112.804 -179.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 7.8 tp -56.39 127.76 15.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-O 121.55 0.69 . . . . 70.35 110.476 -170.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -82.76 94.26 7.59 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 107.182 -1.414 . . . . 64.95 107.182 171.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 93.1 m -62.26 -9.2 7.22 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 113.023 0.749 . . . . 49.25 113.023 -176.76 -66.357 -68.787 -80.01 105.64 2.035 104.369 -85.969 178.828 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -77.35 -14.27 59.76 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 113.219 0.822 . . . . 63.79 113.219 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 69.5 p -71.01 -4.2 23.61 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.829 0.677 . . . . 68.55 112.829 177.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 2.7 mt . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 118.562 0.619 . . . . 73.21 110.039 177.634 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' MYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 2.5 t . . . . . 0 N--CA 1.457 -0.09 0 N-CA-C 110.149 -0.315 . . . . 76.65 110.149 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 t -109.36 150.26 28.29 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.162 0.506 . . . . 85.47 109.713 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 99.4 m -71.98 -19.38 61.89 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.728 -0.669 . . . . 46.73 112.29 -177.971 -65.458 -29.712 -79.4 105.403 2.029 103.969 -62.163 -66.101 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -62.24 -42.49 99.72 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.049 -1.072 . . . . 50.68 112.32 175.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.65 -37.41 86.46 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 122.359 -0.494 . . . . 68.25 111.044 175.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' VAL . . . . . 0.635 HG22 HD21 ' A' ' 35' ' ' LEU . 61.0 t -57.08 -52.14 60.03 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 CA-C-O 121.295 0.569 . . . . 51.89 110.297 175.616 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -63.47 -41.91 98.59 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.814 -0.354 . . . . 57.42 111.406 -179.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.35 -43.07 95.74 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.319 -0.552 . . . . 48.07 111.212 -177.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -71.72 -30.35 65.54 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.17 -0.612 . . . . 53.2 111.729 179.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . 0.479 HD11 HD13 ' A' ' 52' ' ' ILE . 7.2 mt -85.78 -12.14 51.75 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.75 1.018 . . . . 63.29 113.75 -179.434 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -50.91 -46.75 87.56 Favored Pre-proline 0 C--O 1.241 0.632 0 N-CA-C 114.145 1.165 . . . . 51.71 114.145 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -68.5 -0.12 5.47 Favored 'Trans proline' 0 C--O 1.236 0.42 0 CA-C-N 121.54 1.586 . . . . 50.12 114.354 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.3 m -96.02 -14.42 22.99 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.091 0.86 . . . . 42.66 113.202 176.997 -58.933 -67.924 97.15 103.061 2.029 102.749 63.237 166.154 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.9 t -55.4 -40.73 86.54 Favored Pre-proline 0 C--O 1.24 0.56 0 CA-C-O 118.636 -0.697 . . . . 58.35 111.622 178.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -56.71 -44.8 41.82 Favored 'Trans proline' 0 C--O 1.236 0.402 0 CA-C-N 121.366 1.524 . . . . 65.67 113.142 170.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' PHE . . . . . 0.43 ' CE2' ' HG ' ' A' ' 70' ' ' LEU . 62.8 t80 -68.04 -39.39 83.07 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.957 -0.697 . . . . 56.84 111.265 176.845 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 84.5 mt -74.69 -16.26 60.77 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 112.941 0.719 . . . . 48.21 112.941 -174.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 62.1 p -106.57 -25.61 11.74 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 113.71 1.004 . . . . 62.68 113.71 174.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -121.12 1.67 10.34 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 113.794 1.035 . . . . 65.7 113.794 -173.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 66.86 -147.04 49.14 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.535 -0.841 . . . . 62.63 112.605 175.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 77.66 -147.73 32.81 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-O 121.836 0.686 . . . . 69.94 111.936 -178.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -104.96 133.14 20.29 Favored Pre-proline 0 C--O 1.239 0.545 0 C-N-CA 119.075 -1.05 . . . . 72.27 109.623 175.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -68.88 135.45 32.63 Favored 'Trans proline' 0 C--N 1.333 -0.28 0 CA-C-N 119.021 0.686 . . . . 68.24 110.323 178.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.03 175.67 18.34 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.876 -0.678 . . . . 61.01 112.466 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.63 -28.71 70.1 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.288 -0.565 . . . . 51.78 111.584 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -68.01 -46.63 70.7 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.174 -0.611 . . . . 46.84 111.062 179.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.2 t -64.2 -42.94 96.43 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 119.658 -0.817 . . . . 40.36 111.321 -179.442 166.154 63.237 97.15 102.749 2.029 103.061 -67.924 -58.933 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 2.3 m -64.1 -41.64 97.19 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.423 -0.511 . . . . 52.2 111.098 178.183 -88.462 -27.969 -97.418 104.236 2.028 104.272 -46.999 -78.49 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.8 m -58.68 -40.47 83.63 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 120.824 -0.351 . . . . 52.49 111.05 175.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -67.76 -40.64 89.8 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.233 -0.984 . . . . 40.35 112.698 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 55.4 t -62.64 -44.41 99.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 C-N-CA 120.267 -0.573 . . . . 49.89 110.452 177.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . 0.504 ' HG2' HD11 ' A' ' 76' ' ' ILE . 29.8 mtmt -67.84 -38.03 82.64 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 120.185 -0.606 . . . . 62.22 111.23 -179.938 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 23.8 m -57.98 -49.02 78.24 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 121.067 -0.253 . . . . 60.49 111.309 174.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LEU . . . . . 0.635 HD21 HG22 ' A' ' 7' ' ' VAL . 1.7 tm? -60.96 -44.87 96.69 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.931 -0.307 . . . . 77.53 110.744 179.607 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -62.03 -40.1 94.58 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.244 -0.582 . . . . 81.45 111.381 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -68.72 -33.16 75.28 Favored Glycine 0 C--N 1.334 0.457 0 C-N-CA 120.381 -0.914 . . . . 54.91 113.888 -176.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -91.68 6.34 46.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 117.641 0.72 . . . . 84.81 112.871 -176.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -115.19 95.46 5.2 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.975 -1.491 . . . . 52.06 106.975 175.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -110.43 -54.75 2.55 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 113.397 0.888 . . . . 66.36 113.397 -170.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 86.0 p -72.5 158.68 87.01 Favored Pre-proline 0 N--CA 1.451 -0.382 0 O-C-N 122.021 -0.424 . . . . 68.93 110.331 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -55.68 -40.02 87.73 Favored 'Trans proline' 0 C--O 1.239 0.537 0 N-CA-C 113.093 0.382 . . . . 57.33 113.093 176.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -66.92 -36.13 81.55 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.31 -0.556 . . . . 51.43 111.099 176.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -59.71 -51.71 68.6 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.78 -0.368 . . . . 71.08 111.084 174.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 18.3 mtm180 -62.64 -34.58 77.34 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 120.706 -0.397 . . . . 76.26 111.479 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.8 mtmt -68.41 -46.27 70.4 Favored 'General case' 0 C--O 1.239 0.539 0 C-N-CA 120.425 -0.51 . . . . 66.84 111.207 177.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.5 m -56.35 -44.64 80.27 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.922 -0.311 . . . . 47.91 110.897 175.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.1 -41.3 90.81 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 120.617 -0.433 . . . . 34.56 111.27 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 45.7 t -58.37 -42.09 86.22 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 120.817 0.341 . . . . 42.34 110.984 177.36 178.828 -85.969 -80.01 104.369 2.035 105.64 -68.787 -66.357 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -75.6 -33.19 60.55 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 119.751 -0.78 . . . . 49.01 112.25 -178.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 95.2 m -58.35 -38.79 77.93 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 120.487 -0.485 . . . . 45.1 110.961 168.387 -66.101 -62.163 -79.4 103.969 2.029 105.403 -29.712 -65.458 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ILE . . . . . 0.479 HD13 HD11 ' A' ' 11' ' ' LEU . 2.0 mm -66.7 -42.33 89.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 120.877 0.37 . . . . 48.27 110.382 178.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -60.7 -40.19 91.32 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.434 -0.506 . . . . 49.2 111.253 175.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.55 -46.12 87.4 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 120.878 0.371 . . . . 44.96 110.91 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.62 -41.64 95.25 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.174 -0.61 . . . . 48.58 111.242 175.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.3 -35.77 78.24 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 122.143 -0.348 . . . . 43.11 111.595 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -72.2 -28.24 63.07 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.128 -0.629 . . . . 46.37 111.362 174.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.6 ttp180 -68.73 -30.53 69.19 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 120.147 -0.621 . . . . 62.53 111.591 171.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -113.96 60.12 0.92 Allowed Pre-proline 0 C--O 1.238 0.462 0 N-CA-C 109.693 -0.484 . . . . 62.8 109.693 175.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -75.55 2.22 7.14 Favored 'Trans proline' 0 C--O 1.236 0.417 0 N-CA-C 114.055 0.752 . . . . 58.51 114.055 -168.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -101.47 11.96 38.17 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.819 0.674 . . . . 68.54 112.819 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.3 mt -93.32 159.23 15.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.776 0.798 . . . . 65.64 110.69 177.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.1 mttp -86.87 135.6 33.26 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.236 -0.893 . . . . 72.5 109.752 174.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.94 -32.36 61.74 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 120.242 -0.583 . . . . 81.55 111.606 179.914 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . . . -59.98 -25.75 65.49 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.566 -0.454 . . . . 74.77 111.277 175.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.57 -50.4 63.23 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.861 -0.336 . . . . 78.67 111.092 175.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.55 -19.22 62.19 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.59 0.589 . . . . 68.91 112.59 -178.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.77 -26.03 60.45 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 118.319 -1.352 . . . . 83.18 111.845 177.56 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.0 p -76.01 2.51 12.52 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 112.624 0.601 . . . . 79.43 112.624 175.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . 0.43 ' HG ' ' CE2' ' A' ' 17' ' ' PHE . 1.0 OUTLIER -74.19 -50.29 5.13 Favored Pre-proline 0 C--O 1.245 0.834 0 CA-C-O 118.463 -0.779 . . . . 81.55 112.734 -175.723 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -63.5 -39.83 34.1 Favored 'Trans proline' 0 C--O 1.237 0.472 0 CA-C-N 121.367 1.524 . . . . 84.23 113.334 -178.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.3 m -63.78 -37.57 87.85 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.432 -0.507 . . . . 78.69 111.308 179.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -80.86 -12.77 59.36 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 112.933 0.716 . . . . 86.97 112.933 178.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 32.8 m -107.4 -10.68 15.7 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 113.296 0.85 . . . . 76.22 113.296 175.753 -78.49 -46.999 -97.418 104.272 2.028 104.236 -27.969 -88.462 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 114.83 -35.46 4.39 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 114.829 0.692 . . . . 77.83 114.829 175.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ILE . . . . . 0.504 HD11 ' HG2' ' A' ' 33' ' ' LYS . 3.1 mt -75.3 154.21 6.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 121.64 0.734 . . . . 80.93 110.577 -172.517 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 19.4 m -115.71 99.28 7.2 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 107.138 -1.431 . . . . 79.4 107.138 170.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.0 mt -73.67 164.54 26.51 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 122.027 0.917 . . . . 78.45 111.135 -174.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -94.94 2.8 55.43 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.12 -0.945 . . . . 67.9 112.92 -179.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 3.5 m -138.39 148.58 59.86 Favored Pre-proline 0 C--O 1.239 0.517 0 CA-C-O 121.816 0.817 . . . . 71.82 109.349 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -67.85 133.02 28.1 Favored 'Trans proline' 0 CA--C 1.515 -0.471 0 N-CA-C 108.863 -1.245 . . . . 77.13 108.863 165.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -84.48 96.6 4.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 N-CA-C 106.498 -1.668 . . . . 77.19 106.498 173.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.6 p -144.5 142.26 30.12 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.254 -1.387 . . . . 64.54 107.254 179.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 5.2 ttm105 -60.67 -20.52 61.14 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.654 0.613 . . . . 63.49 112.654 -175.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.8 p -92.46 4.84 52.69 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.804 0.668 . . . . 56.99 112.804 -179.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 7.8 tp -56.39 127.76 15.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-O 121.55 0.69 . . . . 70.35 110.476 -170.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -82.76 94.26 7.59 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 107.182 -1.414 . . . . 64.95 107.182 171.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 93.1 m -62.26 -9.2 7.22 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 113.023 0.749 . . . . 49.25 113.023 -176.76 -66.357 -68.787 -80.01 105.64 2.035 104.369 -85.969 178.828 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -77.35 -14.27 59.76 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 113.219 0.822 . . . . 63.79 113.219 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 69.5 p -71.01 -4.2 23.61 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.829 0.677 . . . . 68.55 112.829 177.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 2.7 mt . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 118.562 0.619 . . . . 73.21 110.039 177.634 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' MYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 2.5 t . . . . . 0 N--CA 1.457 -0.09 0 N-CA-C 110.149 -0.315 . . . . 76.65 110.149 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 t -109.36 150.26 28.29 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.162 0.506 . . . . 85.47 109.713 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 99.4 m -71.98 -19.38 61.89 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.728 -0.669 . . . . 46.73 112.29 -177.971 -65.458 -29.712 -79.4 105.403 2.029 103.969 -62.163 -66.101 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -62.24 -42.49 99.72 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.049 -1.072 . . . . 50.68 112.32 175.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.65 -37.41 86.46 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 122.359 -0.494 . . . . 68.25 111.044 175.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.635 HG22 HD21 ' A' ' 35' ' ' LEU . 61.0 t -57.08 -52.14 60.03 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 CA-C-O 121.295 0.569 . . . . 51.89 110.297 175.616 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -63.47 -41.91 98.59 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.814 -0.354 . . . . 57.42 111.406 -179.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.35 -43.07 95.74 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.319 -0.552 . . . . 48.07 111.212 -177.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -71.72 -30.35 65.54 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.17 -0.612 . . . . 53.2 111.729 179.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.479 HD11 HD13 ' A' ' 52' ' ' ILE . 7.2 mt -85.78 -12.14 51.75 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.75 1.018 . . . . 63.29 113.75 -179.434 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -50.91 -46.75 87.56 Favored Pre-proline 0 C--O 1.241 0.632 0 N-CA-C 114.145 1.165 . . . . 51.71 114.145 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -68.5 -0.12 5.47 Favored 'Trans proline' 0 C--O 1.236 0.42 0 CA-C-N 121.54 1.586 . . . . 50.12 114.354 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.3 m -96.02 -14.42 22.99 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.091 0.86 . . . . 42.66 113.202 176.997 -58.933 -67.924 97.15 103.061 2.029 102.749 63.237 166.154 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.9 t -55.4 -40.73 86.54 Favored Pre-proline 0 C--O 1.24 0.56 0 CA-C-O 118.636 -0.697 . . . . 58.35 111.622 178.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -56.71 -44.8 41.82 Favored 'Trans proline' 0 C--O 1.236 0.402 0 CA-C-N 121.366 1.524 . . . . 65.67 113.142 170.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.43 ' CE2' ' HG ' ' A' ' 70' ' ' LEU . 62.8 t80 -68.04 -39.39 83.07 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.957 -0.697 . . . . 56.84 111.265 176.845 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 84.5 mt -74.69 -16.26 60.77 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 112.941 0.719 . . . . 48.21 112.941 -174.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 62.1 p -106.57 -25.61 11.74 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 113.71 1.004 . . . . 62.68 113.71 174.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -121.12 1.67 10.34 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 113.794 1.035 . . . . 65.7 113.794 -173.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 66.86 -147.04 49.14 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.535 -0.841 . . . . 62.63 112.605 175.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 77.66 -147.73 32.81 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-O 121.836 0.686 . . . . 69.94 111.936 -178.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -104.96 133.14 20.29 Favored Pre-proline 0 C--O 1.239 0.545 0 C-N-CA 119.075 -1.05 . . . . 72.27 109.623 175.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -68.88 135.45 32.63 Favored 'Trans proline' 0 C--N 1.333 -0.28 0 CA-C-N 119.021 0.686 . . . . 68.24 110.323 178.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.03 175.67 18.34 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.876 -0.678 . . . . 61.01 112.466 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.63 -28.71 70.1 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.288 -0.565 . . . . 51.78 111.584 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -68.01 -46.63 70.7 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.174 -0.611 . . . . 46.84 111.062 179.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.2 t -64.2 -42.94 96.43 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 119.658 -0.817 . . . . 40.36 111.321 -179.442 166.154 63.237 97.15 102.749 2.029 103.061 -67.924 -58.933 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 2.3 m -64.1 -41.64 97.19 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.423 -0.511 . . . . 52.2 111.098 178.183 -88.462 -27.969 -97.418 104.236 2.028 104.272 -46.999 -78.49 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.8 m -58.68 -40.47 83.63 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 120.824 -0.351 . . . . 52.49 111.05 175.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -67.76 -40.64 89.8 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.233 -0.984 . . . . 40.35 112.698 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 55.4 t -62.64 -44.41 99.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 C-N-CA 120.267 -0.573 . . . . 49.89 110.452 177.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.504 ' HG2' HD11 ' A' ' 76' ' ' ILE . 29.8 mtmt -67.84 -38.03 82.64 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 120.185 -0.606 . . . . 62.22 111.23 -179.938 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 23.8 m -57.98 -49.02 78.24 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 121.067 -0.253 . . . . 60.49 111.309 174.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.635 HD21 HG22 ' A' ' 7' ' ' VAL . 1.7 tm? -60.96 -44.87 96.69 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.931 -0.307 . . . . 77.53 110.744 179.607 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -62.03 -40.1 94.58 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.244 -0.582 . . . . 81.45 111.381 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -68.72 -33.16 75.28 Favored Glycine 0 C--N 1.334 0.457 0 C-N-CA 120.381 -0.914 . . . . 54.91 113.888 -176.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -91.68 6.34 46.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 117.641 0.72 . . . . 84.81 112.871 -176.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -115.19 95.46 5.2 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.975 -1.491 . . . . 52.06 106.975 175.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -110.43 -54.75 2.55 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 113.397 0.888 . . . . 66.36 113.397 -170.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 86.0 p -72.5 158.68 87.01 Favored Pre-proline 0 N--CA 1.451 -0.382 0 O-C-N 122.021 -0.424 . . . . 68.93 110.331 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -55.68 -40.02 87.73 Favored 'Trans proline' 0 C--O 1.239 0.537 0 N-CA-C 113.093 0.382 . . . . 57.33 113.093 176.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -66.92 -36.13 81.55 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.31 -0.556 . . . . 51.43 111.099 176.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -59.71 -51.71 68.6 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.78 -0.368 . . . . 71.08 111.084 174.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 18.3 mtm180 -62.64 -34.58 77.34 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 120.706 -0.397 . . . . 76.26 111.479 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.8 mtmt -68.41 -46.27 70.4 Favored 'General case' 0 C--O 1.239 0.539 0 C-N-CA 120.425 -0.51 . . . . 66.84 111.207 177.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.5 m -56.35 -44.64 80.27 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.922 -0.311 . . . . 47.91 110.897 175.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.1 -41.3 90.81 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 120.617 -0.433 . . . . 34.56 111.27 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 45.7 t -58.37 -42.09 86.22 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 120.817 0.341 . . . . 42.34 110.984 177.36 178.828 -85.969 -80.01 104.369 2.035 105.64 -68.787 -66.357 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -75.6 -33.19 60.55 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 119.751 -0.78 . . . . 49.01 112.25 -178.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 95.2 m -58.35 -38.79 77.93 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 120.487 -0.485 . . . . 45.1 110.961 168.387 -66.101 -62.163 -79.4 103.969 2.029 105.403 -29.712 -65.458 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.479 HD13 HD11 ' A' ' 11' ' ' LEU . 2.0 mm -66.7 -42.33 89.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 120.877 0.37 . . . . 48.27 110.382 178.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -60.7 -40.19 91.32 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.434 -0.506 . . . . 49.2 111.253 175.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.55 -46.12 87.4 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 120.878 0.371 . . . . 44.96 110.91 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.62 -41.64 95.25 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.174 -0.61 . . . . 48.58 111.242 175.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.3 -35.77 78.24 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 122.143 -0.348 . . . . 43.11 111.595 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -72.2 -28.24 63.07 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.128 -0.629 . . . . 46.37 111.362 174.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.6 ttp180 -68.73 -30.53 69.19 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 120.147 -0.621 . . . . 62.53 111.591 171.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -113.96 60.12 0.92 Allowed Pre-proline 0 C--O 1.238 0.462 0 N-CA-C 109.693 -0.484 . . . . 62.8 109.693 175.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -75.55 2.22 7.14 Favored 'Trans proline' 0 C--O 1.236 0.417 0 N-CA-C 114.055 0.752 . . . . 58.51 114.055 -168.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -101.47 11.96 38.17 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.819 0.674 . . . . 68.54 112.819 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.3 mt -93.32 159.23 15.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.776 0.798 . . . . 65.64 110.69 177.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.1 mttp -86.87 135.6 33.26 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.236 -0.893 . . . . 72.5 109.752 174.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.94 -32.36 61.74 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 120.242 -0.583 . . . . 81.55 111.606 179.914 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . . . -59.98 -25.75 65.49 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.566 -0.454 . . . . 74.77 111.277 175.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.57 -50.4 63.23 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.861 -0.336 . . . . 78.67 111.092 175.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.55 -19.22 62.19 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.59 0.589 . . . . 68.91 112.59 -178.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.683 HE21 HD12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -73.77 -26.03 60.45 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 118.319 -1.352 . . . . 83.18 111.845 177.56 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.0 p -76.01 2.51 12.52 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 112.624 0.601 . . . . 79.43 112.624 175.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.43 ' HG ' ' CE2' ' A' ' 17' ' ' PHE . 1.0 OUTLIER -74.19 -50.29 5.13 Favored Pre-proline 0 C--O 1.245 0.834 0 CA-C-O 118.463 -0.779 . . . . 81.55 112.734 -175.723 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -63.5 -39.83 34.1 Favored 'Trans proline' 0 C--O 1.237 0.472 0 CA-C-N 121.367 1.524 . . . . 84.23 113.334 -178.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.3 m -63.78 -37.57 87.85 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.432 -0.507 . . . . 78.69 111.308 179.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -80.86 -12.77 59.36 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 112.933 0.716 . . . . 86.97 112.933 178.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 32.8 m -107.4 -10.68 15.7 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 113.296 0.85 . . . . 76.22 113.296 175.753 -78.49 -46.999 -97.418 104.272 2.028 104.236 -27.969 -88.462 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 114.83 -35.46 4.39 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 114.829 0.692 . . . . 77.83 114.829 175.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.504 HD11 ' HG2' ' A' ' 33' ' ' LYS . 3.1 mt -75.3 154.21 6.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 121.64 0.734 . . . . 80.93 110.577 -172.517 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 19.4 m -115.71 99.28 7.2 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 107.138 -1.431 . . . . 79.4 107.138 170.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.0 mt -73.67 164.54 26.51 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 122.027 0.917 . . . . 78.45 111.135 -174.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -94.94 2.8 55.43 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.12 -0.945 . . . . 67.9 112.92 -179.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 3.5 m -138.39 148.58 59.86 Favored Pre-proline 0 C--O 1.239 0.517 0 CA-C-O 121.816 0.817 . . . . 71.82 109.349 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -67.85 133.02 28.1 Favored 'Trans proline' 0 CA--C 1.515 -0.471 0 N-CA-C 108.863 -1.245 . . . . 77.13 108.863 165.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.683 HD12 HE21 ' A' ' 68' ' ' GLN . 1.6 mp -84.48 96.6 4.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 N-CA-C 106.498 -1.668 . . . . 77.19 106.498 173.584 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.6 p -144.5 142.26 30.12 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.254 -1.387 . . . . 64.54 107.254 179.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 5.2 ttm105 -60.67 -20.52 61.14 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.654 0.613 . . . . 63.49 112.654 -175.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.8 p -92.46 4.84 52.69 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.804 0.668 . . . . 56.99 112.804 -179.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 7.8 tp -56.39 127.76 15.81 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-O 121.55 0.69 . . . . 70.35 110.476 -170.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -82.76 94.26 7.59 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 107.182 -1.414 . . . . 64.95 107.182 171.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 93.1 m -62.26 -9.2 7.22 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 113.023 0.749 . . . . 49.25 113.023 -176.76 -66.357 -68.787 -80.01 105.64 2.035 104.369 -85.969 178.828 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -77.35 -14.27 59.76 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 113.219 0.822 . . . . 63.79 113.219 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 69.5 p -71.01 -4.2 23.61 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.829 0.677 . . . . 68.55 112.829 177.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 2.7 mt . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 118.562 0.619 . . . . 73.21 110.039 177.634 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' MYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_