data_6t6i_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 6t6i _Structure_validation_residue.Date_analyzed 2020-07-17 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 ' 215' ' ' HIS . . . . . . . . . . . . . 51.7 t60 . . . . . 0 C--O 1.23 0.068 0 CA-C-O 120.685 0.279 . . . . 84.65 111.361 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -155.26 143.5 20.21 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.491 -0.559 . . . . 72.08 109.491 -177.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HIS . . . . . . . . . . . . . 41.7 m-70 -102.01 100.29 10.55 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.392 -0.966 . . . . 66.0 108.392 179.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HIS . . . . . . . . . . . . . 63.9 m80 -69.63 128.91 38.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.036 0.446 . . . . 64.81 110.278 179.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HIS . . . . . . . . . . . . . 23.6 p80 -78.04 155.5 30.62 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.897 0.856 . . . . 65.59 111.08 -175.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' ILE . . . . . . . . . . . . . 57.4 mt -65.78 123.08 17.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 108.269 -1.012 . . . . 69.61 108.269 175.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -65.96 142.18 57.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.215 0.531 . . . . 81.11 111.154 -175.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' ASN . . . . . . . . . . . . . 51.0 m-20 65.44 47.86 2.19 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.55 0.691 . . . . 77.72 110.967 175.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -154.66 120.23 5.11 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.441 -0.948 . . . . 74.74 108.441 -178.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -125.22 144.12 50.61 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.745 -0.835 . . . . 82.7 108.745 172.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' VAL . . . . . . . . . . . . . 26.5 t -125.88 138.89 53.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 N-CA-C 109.172 -0.677 . . . . 63.76 109.172 -173.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -110.99 132.39 54.25 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.915 -1.143 . . . . 74.66 107.915 166.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' TYR . . . . . . . . . . . . . 31.6 p90 -131.27 151.47 51.47 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.427 0.632 . . . . 65.77 110.701 -169.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -115.07 114.28 25.15 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.038 -1.097 . . . . 97.87 108.038 -177.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.06 149.28 49.86 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.435 0.636 . . . . 92.47 110.142 175.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' SER . . . . . . . . . . . . . 47.1 t -57.6 131.92 51.66 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.655 -0.702 . . . . 105.78 110.508 -177.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 5.3 mmp_? 72.92 33.07 1.28 Allowed 'General case' 0 C--O 1.234 0.26 0 C-N-CA 123.282 0.633 . . . . 115.63 112.193 175.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -154.69 115.56 2.44 Favored Pre-proline 0 C--O 1.237 0.44 0 N-CA-C 108.8 -0.815 . . . . 102.01 108.8 176.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.37 -10.66 19.07 Favored 'Trans proline' 0 C--O 1.239 0.534 0 N-CA-C 114.49 0.919 . . . . 89.53 114.49 -176.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 94.7 mt -76.98 132.47 32.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 118.939 0.791 . . . . 91.33 109.234 -176.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -83.07 140.6 32.57 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.054 0.454 . . . . 80.96 110.595 -179.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -114.6 153.65 29.74 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.762 -0.654 . . . . 91.48 109.581 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' GLY . . . . . . . . . . . . . . . 142.44 -167.26 26.21 Favored Glycine 0 N--CA 1.443 -0.853 0 CA-C-N 116.002 -0.544 . . . . 73.53 112.862 179.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -73.68 145.2 83.36 Favored 'Cis proline' 0 C--N 1.345 0.362 0 C-N-CA 124.923 -0.866 . . . . 71.57 112.925 0.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 239' ' ' ALA . . . . . . . . . . . . . . . -113.88 161.0 18.15 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.438 0.637 . . . . 65.04 110.02 178.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 32.1 mttt -91.42 140.74 29.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.44 -0.8 . . . . 83.37 109.928 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' LEU . . . . . . . . . . . . . 53.6 tp -87.92 124.8 34.05 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.896 -0.593 . . . . 55.1 109.44 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' LEU . . . . . . . . . . . . . 43.6 mt -107.21 -27.65 10.42 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 113.593 0.96 . . . . 68.29 113.593 177.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' TRP . . . . . . . . . . . . . 75.0 t-105 -160.51 151.67 19.11 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.452 -0.944 . . . . 59.35 108.452 -179.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -133.65 113.49 12.44 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.377 -0.972 . . . . 88.22 108.377 -178.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' GLY . . . . . . . . . . . . . . . -103.59 -162.03 25.11 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-O 121.894 0.719 . . . . 87.77 112.406 179.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -80.66 -41.78 23.2 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.279 -0.461 . . . . 99.96 111.663 -177.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 247' ' ' GLY . . . . . . . . . . . . . . . -119.74 -7.32 9.73 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 121.562 -0.351 . . . . 86.05 113.948 -176.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 248' ' ' ALA . . . . . . . . . . . . . . . -144.78 169.18 18.52 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.654 0.74 . . . . 72.22 109.616 -178.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 249' ' ' VAL . . . . . . . . . . . . . 29.9 m -136.09 149.52 27.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 115.168 -0.923 . . . . 65.68 108.527 175.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 47.2 t -100.06 127.49 52.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 108.192 -1.04 . . . . 57.92 108.192 175.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 251' ' ' ILE . . . . . . . . . . . . . 2.6 pp -126.85 159.12 37.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 N-CA-C 108.5 -0.926 . . . . 61.44 108.5 -179.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 252' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -124.52 108.55 12.22 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 107.909 -1.145 . . . . 63.99 107.909 173.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -98.89 93.69 6.17 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 106.942 -1.503 . . . . 76.21 106.942 176.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 254' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 65.03 -111.21 0.24 Allowed 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.448 -0.575 . . . . 90.37 109.448 -175.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 255' ' ' SER . . . . . . . . . . . . . 31.4 p -101.73 8.64 41.46 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.817 0.673 . . . . 83.26 112.817 -178.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 256' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -112.29 124.46 52.52 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 109.103 -0.703 . . . . 79.55 109.103 -178.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 257' ' ' ILE . . . . . . . . . . . . . 30.9 mt -107.32 123.74 62.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 107.581 -1.266 . . . . 66.6 107.581 176.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 258' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -132.8 156.57 46.87 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.496 0.665 . . . . 77.88 110.097 -173.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 259' ' ' VAL . . . . . . . . . . . . . 92.3 t -99.76 130.41 48.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 107.88 -1.156 . . . . 56.86 107.88 172.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 260' ' ' VAL . . . . . . . . . . . . . 77.7 t -129.11 123.75 21.91 Favored Pre-proline 0 C--O 1.234 0.251 0 N-CA-C 109.045 -0.724 . . . . 58.62 109.045 -175.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 261' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -57.7 144.59 92.72 Favored 'Trans proline' 0 C--O 1.233 0.227 0 CA-C-N 119.53 0.868 . . . . 69.46 110.867 173.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 262' ' ' ARG . . . . . . . . . . . . . 6.4 tpp85 -54.17 -34.72 61.16 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.688 -0.687 . . . . 98.04 111.584 -177.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 263' ' ' ARG . . . . . . . . . . . . . 12.1 mtp-105 -62.68 -26.51 68.69 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.755 -0.378 . . . . 95.67 111.648 179.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 37.0 mttm -102.74 25.88 8.69 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 112.286 0.476 . . . . 84.37 112.286 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 265' ' ' ALA . . . . . . . . . . . . . . . -134.78 146.06 48.99 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.173 0.511 . . . . 80.72 110.034 -177.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 266' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -126.84 90.96 3.25 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 107.101 -1.444 . . . . 101.65 107.101 177.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 267' ' ' ILE . . . . . . . . . . . . . 13.8 pt -79.69 134.4 27.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 108.776 -0.824 . . . . 87.23 108.776 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 268' ' ' ILE . . . . . . . . . . . . . 62.3 mt -132.14 116.78 30.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 N-CA-C 108.374 -0.973 . . . . 81.44 108.374 -172.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 269' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -80.37 162.24 24.6 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.784 0.802 . . . . 92.63 110.709 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 270' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 115.24 -0.891 . . . . 96.33 110.828 179.461 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HIS . . . . . . . . . . . . . 51.7 t60 . . . . . 0 C--O 1.23 0.068 0 CA-C-O 120.685 0.279 . . . . 71.07 111.361 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -155.26 143.5 20.21 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.491 -0.559 . . . . 60.48 109.491 -177.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HIS . . . . . . . . . . . . . 41.7 m-70 -102.01 100.29 10.55 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.392 -0.966 . . . . 54.9 108.392 179.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HIS . . . . . . . . . . . . . 63.9 m80 -69.63 128.91 38.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.036 0.446 . . . . 53.9 110.278 179.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HIS . . . . . . . . . . . . . 23.6 p80 -78.04 155.5 30.62 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.897 0.856 . . . . 56.89 111.08 -175.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 220' ' ' ILE . . . . . . . . . . . . . 57.4 mt -65.78 123.08 17.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 108.269 -1.012 . . . . 57.9 108.269 175.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 221' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -65.96 142.18 57.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.215 0.531 . . . . 68.63 111.154 -175.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 222' ' ' ASN . . . . . . . . . . . . . 51.0 m-20 65.44 47.86 2.19 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.55 0.691 . . . . 64.66 110.967 175.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 223' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -154.66 120.23 5.11 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.441 -0.948 . . . . 62.18 108.441 -178.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 224' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -125.22 144.12 50.61 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.745 -0.835 . . . . 68.81 108.745 172.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 225' ' ' VAL . . . . . . . . . . . . . 26.5 t -125.88 138.89 53.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 N-CA-C 109.172 -0.677 . . . . 53.02 109.172 -173.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 226' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -110.99 132.39 54.25 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.915 -1.143 . . . . 62.11 107.915 166.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 227' ' ' TYR . . . . . . . . . . . . . 31.6 p90 -131.27 151.47 51.47 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.427 0.632 . . . . 61.85 110.701 -169.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 228' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -115.07 114.28 25.15 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.038 -1.097 . . . . 81.45 108.038 -177.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.06 149.28 49.86 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.435 0.636 . . . . 79.64 110.142 175.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 230' ' ' SER . . . . . . . . . . . . . 47.1 t -57.6 131.92 51.66 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.655 -0.702 . . . . 88.04 110.508 -177.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 5.3 mmp_? 72.92 33.07 1.28 Allowed 'General case' 0 C--O 1.234 0.26 0 C-N-CA 123.282 0.633 . . . . 96.25 112.193 175.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 232' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -154.69 115.56 2.44 Favored Pre-proline 0 C--O 1.237 0.44 0 N-CA-C 108.8 -0.815 . . . . 84.9 108.8 176.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 233' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.37 -10.66 19.07 Favored 'Trans proline' 0 C--O 1.239 0.534 0 N-CA-C 114.49 0.919 . . . . 75.3 114.49 -176.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 94.7 mt -76.98 132.47 32.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 118.939 0.791 . . . . 76.0 109.234 -176.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 235' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -83.07 140.6 32.57 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.054 0.454 . . . . 67.93 110.595 -179.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -114.6 153.65 29.74 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.762 -0.654 . . . . 76.12 109.581 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 237' ' ' GLY . . . . . . . . . . . . . . . 142.44 -167.26 26.21 Favored Glycine 0 N--CA 1.443 -0.853 0 CA-C-N 116.002 -0.544 . . . . 63.71 112.862 179.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 238' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -73.68 145.2 83.36 Favored 'Cis proline' 0 C--N 1.345 0.362 0 C-N-CA 124.923 -0.866 . . . . 60.67 112.925 0.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 239' ' ' ALA . . . . . . . . . . . . . . . -113.88 161.0 18.15 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.438 0.637 . . . . 54.1 110.02 178.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 32.1 mttt -91.42 140.74 29.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.44 -0.8 . . . . 69.37 109.928 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 241' ' ' LEU . . . . . . . . . . . . . 53.6 tp -87.92 124.8 34.05 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.896 -0.593 . . . . 49.54 109.44 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 242' ' ' LEU . . . . . . . . . . . . . 43.6 mt -107.21 -27.65 10.42 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 113.593 0.96 . . . . 56.8 113.593 177.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 243' ' ' TRP . . . . . . . . . . . . . 75.0 t-105 -160.51 151.67 19.11 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.452 -0.944 . . . . 53.7 108.452 -179.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 244' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -133.65 113.49 12.44 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.377 -0.972 . . . . 73.41 108.377 -178.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 245' ' ' GLY . . . . . . . . . . . . . . . -103.59 -162.03 25.11 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-O 121.894 0.719 . . . . 78.64 112.406 179.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -80.66 -41.78 23.2 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.279 -0.461 . . . . 87.25 111.663 -177.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 247' ' ' GLY . . . . . . . . . . . . . . . -119.74 -7.32 9.73 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 121.562 -0.351 . . . . 71.6 113.948 -176.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 248' ' ' ALA . . . . . . . . . . . . . . . -144.78 169.18 18.52 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.654 0.74 . . . . 60.08 109.616 -178.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 249' ' ' VAL . . . . . . . . . . . . . 29.9 m -136.09 149.52 27.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 115.168 -0.923 . . . . 54.62 108.527 175.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 47.2 t -100.06 127.49 52.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 108.192 -1.04 . . . . 48.16 108.192 175.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 251' ' ' ILE . . . . . 0.443 HD12 ' C ' ' A' ' 251' ' ' ILE . 2.6 pp -126.85 159.12 37.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 N-CA-C 108.5 -0.926 . . . . 51.1 108.5 -179.447 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 252' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -124.52 108.55 12.22 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 107.909 -1.145 . . . . 56.76 107.909 173.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -98.89 93.69 6.17 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 106.942 -1.503 . . . . 70.27 106.942 176.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 254' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 65.03 -111.21 0.24 Allowed 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.448 -0.575 . . . . 75.2 109.448 -175.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 255' ' ' SER . . . . . . . . . . . . . 31.4 p -101.73 8.64 41.46 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.817 0.673 . . . . 69.27 112.817 -178.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 256' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -112.29 124.46 52.52 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 109.103 -0.703 . . . . 66.18 109.103 -178.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 257' ' ' ILE . . . . . . . . . . . . . 30.9 mt -107.32 123.74 62.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 107.581 -1.266 . . . . 55.4 107.581 176.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 258' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -132.8 156.57 46.87 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.496 0.665 . . . . 64.79 110.097 -173.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 259' ' ' VAL . . . . . . . . . . . . . 92.3 t -99.76 130.41 48.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 107.88 -1.156 . . . . 47.28 107.88 172.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 260' ' ' VAL . . . . . . . . . . . . . 77.7 t -129.11 123.75 21.91 Favored Pre-proline 0 C--O 1.234 0.251 0 N-CA-C 109.045 -0.724 . . . . 50.22 109.045 -175.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 261' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -57.7 144.59 92.72 Favored 'Trans proline' 0 C--O 1.233 0.227 0 CA-C-N 119.53 0.868 . . . . 57.78 110.867 173.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 262' ' ' ARG . . . . . . . . . . . . . 6.4 tpp85 -54.17 -34.72 61.16 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.688 -0.687 . . . . 81.59 111.584 -177.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 263' ' ' ARG . . . . . . . . . . . . . 12.1 mtp-105 -62.68 -26.51 68.69 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.755 -0.378 . . . . 79.61 111.648 179.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 37.0 mttm -102.74 25.88 8.69 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 112.286 0.476 . . . . 70.2 112.286 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 265' ' ' ALA . . . . . . . . . . . . . . . -134.78 146.06 48.99 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.173 0.511 . . . . 70.8 110.034 -177.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 266' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -126.84 90.96 3.25 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 107.101 -1.444 . . . . 84.6 107.101 177.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 267' ' ' ILE . . . . . . . . . . . . . 13.8 pt -79.69 134.4 27.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 108.776 -0.824 . . . . 72.58 108.776 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 268' ' ' ILE . . . . . . . . . . . . . 62.3 mt -132.14 116.78 30.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 N-CA-C 108.374 -0.973 . . . . 67.86 108.374 -172.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 269' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -80.37 162.24 24.6 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.784 0.802 . . . . 77.09 110.709 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 270' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 115.24 -0.891 . . . . 86.1 110.828 179.461 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HIS . . . . . . . . . . . . . 51.7 t60 . . . . . 0 C--O 1.23 0.068 0 CA-C-O 120.685 0.279 . . . . 71.07 111.361 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -155.26 143.5 20.21 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.491 -0.559 . . . . 60.48 109.491 -177.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HIS . . . . . . . . . . . . . 41.7 m-70 -102.01 100.29 10.55 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.392 -0.966 . . . . 54.9 108.392 179.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HIS . . . . . . . . . . . . . 63.9 m80 -69.63 128.91 38.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.036 0.446 . . . . 53.9 110.278 179.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HIS . . . . . . . . . . . . . 23.6 p80 -78.04 155.5 30.62 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.897 0.856 . . . . 56.89 111.08 -175.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' ILE . . . . . . . . . . . . . 57.4 mt -65.78 123.08 17.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 108.269 -1.012 . . . . 57.9 108.269 175.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -65.96 142.18 57.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.215 0.531 . . . . 68.63 111.154 -175.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' ASN . . . . . . . . . . . . . 51.0 m-20 65.44 47.86 2.19 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.55 0.691 . . . . 64.66 110.967 175.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -154.66 120.23 5.11 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.441 -0.948 . . . . 62.18 108.441 -178.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -125.22 144.12 50.61 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.745 -0.835 . . . . 68.81 108.745 172.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' VAL . . . . . . . . . . . . . 26.5 t -125.88 138.89 53.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 N-CA-C 109.172 -0.677 . . . . 53.02 109.172 -173.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -110.99 132.39 54.25 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.915 -1.143 . . . . 62.11 107.915 166.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' TYR . . . . . . . . . . . . . 31.6 p90 -131.27 151.47 51.47 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.427 0.632 . . . . 61.85 110.701 -169.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -115.07 114.28 25.15 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.038 -1.097 . . . . 81.45 108.038 -177.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.06 149.28 49.86 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.435 0.636 . . . . 79.64 110.142 175.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' SER . . . . . . . . . . . . . 47.1 t -57.6 131.92 51.66 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.655 -0.702 . . . . 88.04 110.508 -177.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' ARG . . . . . . . . . . . . . 5.3 mmp_? 72.92 33.07 1.28 Allowed 'General case' 0 C--O 1.234 0.26 0 C-N-CA 123.282 0.633 . . . . 96.25 112.193 175.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -154.69 115.56 2.44 Favored Pre-proline 0 C--O 1.237 0.44 0 N-CA-C 108.8 -0.815 . . . . 84.9 108.8 176.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.37 -10.66 19.07 Favored 'Trans proline' 0 C--O 1.239 0.534 0 N-CA-C 114.49 0.919 . . . . 75.3 114.49 -176.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' ILE . . . . . . . . . . . . . 94.7 mt -76.98 132.47 32.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 118.939 0.791 . . . . 76.0 109.234 -176.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -83.07 140.6 32.57 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.054 0.454 . . . . 67.93 110.595 -179.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -114.6 153.65 29.74 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.762 -0.654 . . . . 76.12 109.581 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' GLY . . . . . . . . . . . . . . . 142.44 -167.26 26.21 Favored Glycine 0 N--CA 1.443 -0.853 0 CA-C-N 116.002 -0.544 . . . . 63.71 112.862 179.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -73.68 145.2 83.36 Favored 'Cis proline' 0 C--N 1.345 0.362 0 C-N-CA 124.923 -0.866 . . . . 60.67 112.925 0.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 239' ' ' ALA . . . . . . . . . . . . . . . -113.88 161.0 18.15 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.438 0.637 . . . . 54.1 110.02 178.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' LYS . . . . . . . . . . . . . 32.1 mttt -91.42 140.74 29.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.44 -0.8 . . . . 69.37 109.928 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' LEU . . . . . . . . . . . . . 53.6 tp -87.92 124.8 34.05 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.896 -0.593 . . . . 49.54 109.44 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' LEU . . . . . . . . . . . . . 43.6 mt -107.21 -27.65 10.42 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 113.593 0.96 . . . . 56.8 113.593 177.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' TRP . . . . . . . . . . . . . 75.0 t-105 -160.51 151.67 19.11 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.452 -0.944 . . . . 53.7 108.452 -179.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -133.65 113.49 12.44 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.377 -0.972 . . . . 73.41 108.377 -178.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' GLY . . . . . . . . . . . . . . . -103.59 -162.03 25.11 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-O 121.894 0.719 . . . . 78.64 112.406 179.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -80.66 -41.78 23.2 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.279 -0.461 . . . . 87.25 111.663 -177.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 247' ' ' GLY . . . . . . . . . . . . . . . -119.74 -7.32 9.73 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 121.562 -0.351 . . . . 71.6 113.948 -176.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 248' ' ' ALA . . . . . . . . . . . . . . . -144.78 169.18 18.52 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.654 0.74 . . . . 60.08 109.616 -178.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 249' ' ' VAL . . . . . . . . . . . . . 29.9 m -136.09 149.52 27.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 115.168 -0.923 . . . . 54.62 108.527 175.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 47.2 t -100.06 127.49 52.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 108.192 -1.04 . . . . 48.16 108.192 175.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 251' ' ' ILE . . . . . 0.443 HD12 ' C ' ' A' ' 251' ' ' ILE . 2.6 pp -126.85 159.12 37.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 N-CA-C 108.5 -0.926 . . . . 51.1 108.5 -179.447 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 252' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -124.52 108.55 12.22 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 107.909 -1.145 . . . . 56.76 107.909 173.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -98.89 93.69 6.17 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 106.942 -1.503 . . . . 70.27 106.942 176.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 254' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 65.03 -111.21 0.24 Allowed 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.448 -0.575 . . . . 75.2 109.448 -175.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 255' ' ' SER . . . . . . . . . . . . . 31.4 p -101.73 8.64 41.46 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.817 0.673 . . . . 69.27 112.817 -178.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 256' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -112.29 124.46 52.52 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 109.103 -0.703 . . . . 66.18 109.103 -178.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 257' ' ' ILE . . . . . . . . . . . . . 30.9 mt -107.32 123.74 62.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 107.581 -1.266 . . . . 55.4 107.581 176.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 258' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -132.8 156.57 46.87 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.496 0.665 . . . . 64.79 110.097 -173.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 259' ' ' VAL . . . . . . . . . . . . . 92.3 t -99.76 130.41 48.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 107.88 -1.156 . . . . 47.28 107.88 172.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 260' ' ' VAL . . . . . . . . . . . . . 77.7 t -129.11 123.75 21.91 Favored Pre-proline 0 C--O 1.234 0.251 0 N-CA-C 109.045 -0.724 . . . . 50.22 109.045 -175.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 261' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -57.7 144.59 92.72 Favored 'Trans proline' 0 C--O 1.233 0.227 0 CA-C-N 119.53 0.868 . . . . 57.78 110.867 173.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 262' ' ' ARG . . . . . . . . . . . . . 6.4 tpp85 -54.17 -34.72 61.16 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.688 -0.687 . . . . 81.59 111.584 -177.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 263' ' ' ARG . . . . . . . . . . . . . 12.1 mtp-105 -62.68 -26.51 68.69 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.755 -0.378 . . . . 79.61 111.648 179.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 37.0 mttm -102.74 25.88 8.69 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 112.286 0.476 . . . . 70.2 112.286 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 265' ' ' ALA . . . . . . . . . . . . . . . -134.78 146.06 48.99 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.173 0.511 . . . . 70.8 110.034 -177.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 266' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -126.84 90.96 3.25 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 107.101 -1.444 . . . . 84.6 107.101 177.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 267' ' ' ILE . . . . . . . . . . . . . 13.8 pt -79.69 134.4 27.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 108.776 -0.824 . . . . 72.58 108.776 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 268' ' ' ILE . . . . . . . . . . . . . 62.3 mt -132.14 116.78 30.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 N-CA-C 108.374 -0.973 . . . . 67.86 108.374 -172.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 269' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -80.37 162.24 24.6 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.784 0.802 . . . . 77.09 110.709 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 270' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 115.24 -0.891 . . . . 86.1 110.828 179.461 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_