NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
388824 | 1nau | 5673 | cing | 4-filtered-FRED | STAR | entry | full | 374 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1nau # This FRED archive file contains, for PDB entry <1nau>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1nau _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1nau _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 3212.48 loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 . 1 $Glucagon A . 1 1 stop_ save_ save_Glucagon _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name Glucagon _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code SQGTTSEYSKYLDSRRAQDFVQWLMNTX _Entity.Number_of_monomers 28 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 SER . 1 1 2 GLN . 1 1 3 GLY . 1 1 4 THR . 1 1 5 THR . 1 1 6 SER . 1 1 7 GLU . 1 1 8 TYR . 1 1 9 SER . 1 1 10 LYS . 1 1 11 TYR . 1 1 12 LEU . 1 1 13 ASP . 1 1 14 SER . 1 1 15 ARG . 1 1 16 ARG . 1 1 17 ALA . 1 1 18 GLN . 1 1 19 ASP . 1 1 20 PHE . 1 1 21 VAL . 1 1 22 GLN . 1 1 23 TRP . 1 1 24 LEU . 1 1 25 MET . 1 1 26 ASN . 1 1 27 THR . 1 1 28 NH2 $NH2 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID SER 1 1 1 1 GLN 2 2 1 1 GLY 3 3 1 1 THR 4 4 1 1 THR 5 5 1 1 SER 6 6 1 1 GLU 7 7 1 1 TYR 8 8 1 1 SER 9 9 1 1 LYS 10 10 1 1 TYR 11 11 1 1 LEU 12 12 1 1 ASP 13 13 1 1 SER 14 14 1 1 ARG 15 15 1 1 ARG 16 16 1 1 ALA 17 17 1 1 GLN 18 18 1 1 ASP 19 19 1 1 PHE 20 20 1 1 VAL 21 21 1 1 GLN 22 22 1 1 TRP 23 23 1 1 LEU 24 24 1 1 MET 25 25 1 1 ASN 26 26 1 1 THR 27 27 1 1 NH2 28 28 1 1 stop_ save_ save_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NH2 _Chem_comp.Type non-polymer save_ save_Discover_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 SER HA 1 1 SERN HA 1 1 1 1 2 1 1 2 GLN H 1 2 GLN HN 1 1 2 1 1 1 1 1 SER QB 1 1 SERN HB* 1 1 2 1 2 1 1 2 GLN H 1 2 GLN HN 1 1 3 1 1 1 1 2 GLN HA 1 2 GLN HA 1 1 3 1 2 1 1 3 GLY H 1 3 GLY HN 1 1 4 1 1 1 1 3 GLY H 1 3 GLY HN 1 1 4 1 2 1 1 4 THR H 1 4 THR HN 1 1 5 1 1 1 1 3 GLY QA 1 3 GLY HA* 1 1 5 1 2 1 1 4 THR H 1 4 THR HN 1 1 6 1 1 1 1 4 THR H 1 4 THR HN 1 1 6 1 2 1 1 4 THR HB 1 4 THR HB 1 1 7 1 1 1 1 4 THR H 1 4 THR HN 1 1 7 1 2 1 1 5 THR H 1 5 THR HN 1 1 8 1 1 1 1 4 THR H 1 4 THR HN 1 1 8 1 2 1 1 7 GLU HA 1 7 GLU HA 1 1 9 1 1 1 1 4 THR H 1 4 THR HN 1 1 9 1 2 1 1 7 GLU QB 1 7 GLU HB* 1 1 10 1 1 1 1 4 THR HA 1 4 THR HA 1 1 10 1 2 1 1 5 THR H 1 5 THR HN 1 1 11 1 1 1 1 4 THR HA 1 4 THR HA 1 1 11 1 2 1 1 8 TYR QD 1 8 TYR HD* 1 1 12 1 1 1 1 4 THR HB 1 4 THR HB 1 1 12 1 2 1 1 8 TYR QE 1 8 TYR HE* 1 1 13 1 1 1 1 4 THR MG 1 4 THR HG2* 1 1 13 1 2 1 1 8 TYR QE 1 8 TYR HE* 1 1 14 1 1 1 1 5 THR H 1 5 THR HN 1 1 14 1 2 1 1 5 THR HB 1 5 THR HB 1 1 15 1 1 1 1 5 THR H 1 5 THR HN 1 1 15 1 2 1 1 6 SER QB 1 6 SER HB* 1 1 16 1 1 1 1 5 THR HA 1 5 THR HA 1 1 16 1 2 1 1 6 SER H 1 6 SER HN 1 1 17 1 1 1 1 5 THR HA 1 5 THR HA 1 1 17 1 2 1 1 7 GLU H 1 7 GLU HN 1 1 18 1 1 1 1 5 THR HA 1 5 THR HA 1 1 18 1 2 1 1 8 TYR QD 1 8 TYR HD* 1 1 19 1 1 1 1 5 THR HA 1 5 THR HA 1 1 19 1 2 1 1 11 TYR QE 1 11 TYR HE* 1 1 20 1 1 1 1 6 SER H 1 6 SER HN 1 1 20 1 2 1 1 7 GLU H 1 7 GLU HN 1 1 21 1 1 1 1 6 SER H 1 6 SER HN 1 1 21 1 2 1 1 8 TYR QD 1 8 TYR HD* 1 1 22 1 1 1 1 6 SER HA 1 6 SER HA 1 1 22 1 2 1 1 7 GLU H 1 7 GLU HN 1 1 23 1 1 1 1 6 SER HA 1 6 SER HA 1 1 23 1 2 1 1 8 TYR QD 1 8 TYR HD* 1 1 24 1 1 1 1 6 SER QB 1 6 SER HB* 1 1 24 1 2 1 1 7 GLU H 1 7 GLU HN 1 1 25 1 1 1 1 6 SER QB 1 6 SER HB* 1 1 25 1 2 1 1 8 TYR QD 1 8 TYR HD* 1 1 26 1 1 1 1 6 SER QB 1 6 SER HB* 1 1 26 1 2 1 1 9 SER H 1 9 SER HN 1 1 27 1 1 1 1 6 SER QB 1 6 SER HB* 1 1 27 1 2 1 1 10 LYS H 1 10 LYS HN 1 1 28 1 1 1 1 7 GLU H 1 7 GLU HN 1 1 28 1 2 1 1 7 GLU QB 1 7 GLU HB* 1 1 29 1 1 1 1 7 GLU H 1 7 GLU HN 1 1 29 1 2 1 1 8 TYR H 1 8 TYR HN 1 1 30 1 1 1 1 7 GLU H 1 7 GLU HN 1 1 30 1 2 1 1 8 TYR QB 1 8 TYR HB* 1 1 31 1 1 1 1 7 GLU H 1 7 GLU HN 1 1 31 1 2 1 1 8 TYR QD 1 8 TYR HD* 1 1 32 1 1 1 1 7 GLU H 1 7 GLU HN 1 1 32 1 2 1 1 8 TYR QE 1 8 TYR HE* 1 1 33 1 1 1 1 7 GLU HA 1 7 GLU HA 1 1 33 1 2 1 1 8 TYR H 1 8 TYR HN 1 1 34 1 1 1 1 7 GLU HA 1 7 GLU HA 1 1 34 1 2 1 1 8 TYR QD 1 8 TYR HD* 1 1 35 1 1 1 1 7 GLU HA 1 7 GLU HA 1 1 35 1 2 1 1 10 LYS H 1 10 LYS HN 1 1 36 1 1 1 1 7 GLU HA 1 7 GLU HA 1 1 36 1 2 1 1 11 TYR QD 1 11 TYR HD* 1 1 37 1 1 1 1 7 GLU QB 1 7 GLU HB* 1 1 37 1 2 1 1 8 TYR H 1 8 TYR HN 1 1 38 1 1 1 1 7 GLU QB 1 7 GLU HB* 1 1 38 1 2 1 1 8 TYR QD 1 8 TYR HD* 1 1 39 1 1 1 1 7 GLU QB 1 7 GLU HB* 1 1 39 1 2 1 1 8 TYR QE 1 8 TYR HE* 1 1 40 1 1 1 1 7 GLU QB 1 7 GLU HB* 1 1 40 1 2 1 1 10 LYS H 1 10 LYS HN 1 1 41 1 1 1 1 7 GLU QB 1 7 GLU HB* 1 1 41 1 2 1 1 11 TYR QE 1 11 TYR HE* 1 1 42 1 1 1 1 7 GLU QG 1 7 GLU HG* 1 1 42 1 2 1 1 8 TYR QD 1 8 TYR HD* 1 1 43 1 1 1 1 7 GLU QG 1 7 GLU HG* 1 1 43 1 2 1 1 8 TYR QE 1 8 TYR HE* 1 1 44 1 1 1 1 7 GLU QG 1 7 GLU HG* 1 1 44 1 2 1 1 11 TYR QD 1 11 TYR HD* 1 1 45 1 1 1 1 8 TYR H 1 8 TYR HN 1 1 45 1 2 1 1 8 TYR QB 1 8 TYR HB* 1 1 46 1 1 1 1 8 TYR H 1 8 TYR HN 1 1 46 1 2 1 1 8 TYR QD 1 8 TYR HD* 1 1 47 1 1 1 1 8 TYR H 1 8 TYR HN 1 1 47 1 2 1 1 8 TYR QE 1 8 TYR HE* 1 1 48 1 1 1 1 8 TYR HA 1 8 TYR HA 1 1 48 1 2 1 1 10 LYS H 1 10 LYS HN 1 1 49 1 1 1 1 8 TYR HA 1 8 TYR HA 1 1 49 1 2 1 1 11 TYR QD 1 11 TYR HD* 1 1 50 1 1 1 1 8 TYR HA 1 8 TYR HA 1 1 50 1 2 1 1 11 TYR QE 1 11 TYR HE* 1 1 51 1 1 1 1 8 TYR QD 1 8 TYR HD* 1 1 51 1 2 1 1 9 SER QB 1 9 SER HB* 1 1 52 1 1 1 1 8 TYR QD 1 8 TYR HD* 1 1 52 1 2 1 1 11 TYR H 1 11 TYR HN 1 1 53 1 1 1 1 8 TYR QD 1 8 TYR HD* 1 1 53 1 2 1 1 12 LEU H 1 12 LEU HN 1 1 54 1 1 1 1 8 TYR QD 1 8 TYR HD* 1 1 54 1 2 1 1 12 LEU QB 1 12 LEU HB* 1 1 55 1 1 1 1 8 TYR QD 1 8 TYR HD* 1 1 55 1 2 1 1 12 LEU QD 1 12 LEU HD* 1 1 56 1 1 1 1 8 TYR QD 1 8 TYR HD* 1 1 56 1 2 1 1 13 ASP QB 1 13 ASP HB* 1 1 57 1 1 1 1 8 TYR QE 1 8 TYR HE* 1 1 57 1 2 1 1 9 SER QB 1 9 SER HB* 1 1 58 1 1 1 1 8 TYR QE 1 8 TYR HE* 1 1 58 1 2 1 1 12 LEU QD 1 12 LEU HD* 1 1 59 1 1 1 1 9 SER H 1 9 SER HN 1 1 59 1 2 1 1 10 LYS H 1 10 LYS HN 1 1 60 1 1 1 1 9 SER H 1 9 SER HN 1 1 60 1 2 1 1 10 LYS QB 1 10 LYS HB* 1 1 61 1 1 1 1 9 SER H 1 9 SER HN 1 1 61 1 2 1 1 10 LYS QG 1 10 LYS HG* 1 1 62 1 1 1 1 9 SER H 1 9 SER HN 1 1 62 1 2 1 1 11 TYR H 1 11 TYR HN 1 1 63 1 1 1 1 9 SER H 1 9 SER HN 1 1 63 1 2 1 1 12 LEU QB 1 12 LEU HB* 1 1 64 1 1 1 1 9 SER H 1 9 SER HN 1 1 64 1 2 1 1 12 LEU QD 1 12 LEU HD* 1 1 65 1 1 1 1 9 SER QB 1 9 SER HB* 1 1 65 1 2 1 1 10 LYS H 1 10 LYS HN 1 1 66 1 1 1 1 9 SER QB 1 9 SER HB* 1 1 66 1 2 1 1 11 TYR H 1 11 TYR HN 1 1 67 1 1 1 1 10 LYS H 1 10 LYS HN 1 1 67 1 2 1 1 10 LYS QB 1 10 LYS HB* 1 1 68 1 1 1 1 10 LYS H 1 10 LYS HN 1 1 68 1 2 1 1 10 LYS QE 1 10 LYS HE* 1 1 69 1 1 1 1 10 LYS H 1 10 LYS HN 1 1 69 1 2 1 1 10 LYS QG 1 10 LYS HG* 1 1 70 1 1 1 1 10 LYS H 1 10 LYS HN 1 1 70 1 2 1 1 11 TYR H 1 11 TYR HN 1 1 71 1 1 1 1 10 LYS H 1 10 LYS HN 1 1 71 1 2 1 1 11 TYR HA 1 11 TYR HA 1 1 72 1 1 1 1 10 LYS H 1 10 LYS HN 1 1 72 1 2 1 1 12 LEU QB 1 12 LEU HB* 1 1 73 1 1 1 1 10 LYS H 1 10 LYS HN 1 1 73 1 2 1 1 12 LEU QD 1 12 LEU HD* 1 1 74 1 1 1 1 10 LYS H 1 10 LYS HN 1 1 74 1 2 1 1 16 ARG QD 1 16 ARG HD* 1 1 75 1 1 1 1 10 LYS HA 1 10 LYS HA 1 1 75 1 2 1 1 11 TYR H 1 11 TYR HN 1 1 76 1 1 1 1 10 LYS HA 1 10 LYS HA 1 1 76 1 2 1 1 12 LEU QB 1 12 LEU HB* 1 1 77 1 1 1 1 10 LYS QB 1 10 LYS HB* 1 1 77 1 2 1 1 11 TYR H 1 11 TYR HN 1 1 78 1 1 1 1 10 LYS QB 1 10 LYS HB* 1 1 78 1 2 1 1 11 TYR QB 1 11 TYR HB* 1 1 79 1 1 1 1 10 LYS QB 1 10 LYS HB* 1 1 79 1 2 1 1 11 TYR QD 1 11 TYR HD* 1 1 80 1 1 1 1 10 LYS QB 1 10 LYS HB* 1 1 80 1 2 1 1 11 TYR QE 1 11 TYR HE* 1 1 81 1 1 1 1 10 LYS QB 1 10 LYS HB* 1 1 81 1 2 1 1 16 ARG QH 1 16 ARG HH* 1 1 82 1 1 1 1 10 LYS QD 1 10 LYS HD* 1 1 82 1 2 1 1 11 TYR H 1 11 TYR HN 1 1 83 1 1 1 1 10 LYS QD 1 10 LYS HD* 1 1 83 1 2 1 1 11 TYR QD 1 11 TYR HD* 1 1 84 1 1 1 1 10 LYS QD 1 10 LYS HD* 1 1 84 1 2 1 1 11 TYR QE 1 11 TYR HE* 1 1 85 1 1 1 1 10 LYS QE 1 10 LYS HE* 1 1 85 1 2 1 1 12 LEU HG 1 12 LEU HG 1 1 86 1 1 1 1 10 LYS QG 1 10 LYS HG* 1 1 86 1 2 1 1 11 TYR H 1 11 TYR HN 1 1 87 1 1 1 1 10 LYS QG 1 10 LYS HG* 1 1 87 1 2 1 1 11 TYR QD 1 11 TYR HD* 1 1 88 1 1 1 1 10 LYS QG 1 10 LYS HG* 1 1 88 1 2 1 1 11 TYR QE 1 11 TYR HE* 1 1 89 1 1 1 1 11 TYR H 1 11 TYR HN 1 1 89 1 2 1 1 11 TYR QB 1 11 TYR HB* 1 1 90 1 1 1 1 11 TYR H 1 11 TYR HN 1 1 90 1 2 1 1 11 TYR QD 1 11 TYR HD* 1 1 91 1 1 1 1 11 TYR H 1 11 TYR HN 1 1 91 1 2 1 1 12 LEU H 1 12 LEU HN 1 1 92 1 1 1 1 11 TYR H 1 11 TYR HN 1 1 92 1 2 1 1 12 LEU HA 1 12 LEU HA 1 1 93 1 1 1 1 11 TYR H 1 11 TYR HN 1 1 93 1 2 1 1 12 LEU QB 1 12 LEU HB* 1 1 94 1 1 1 1 11 TYR H 1 11 TYR HN 1 1 94 1 2 1 1 12 LEU QD 1 12 LEU HD* 1 1 95 1 1 1 1 11 TYR HA 1 11 TYR HA 1 1 95 1 2 1 1 11 TYR QE 1 11 TYR HE* 1 1 96 1 1 1 1 11 TYR HA 1 11 TYR HA 1 1 96 1 2 1 1 12 LEU H 1 12 LEU HN 1 1 97 1 1 1 1 11 TYR HA 1 11 TYR HA 1 1 97 1 2 1 1 13 ASP QB 1 13 ASP HB* 1 1 98 1 1 1 1 11 TYR HA 1 11 TYR HA 1 1 98 1 2 1 1 16 ARG QB 1 16 ARG HB* 1 1 99 1 1 1 1 11 TYR HA 1 11 TYR HA 1 1 99 1 2 1 1 16 ARG QG 1 16 ARG HG* 1 1 100 1 1 1 1 11 TYR HA 1 11 TYR HA 1 1 100 1 2 1 1 17 ALA H 1 17 ALA HN 1 1 101 1 1 1 1 11 TYR HA 1 11 TYR HA 1 1 101 1 2 1 1 17 ALA MB 1 17 ALA HB* 1 1 102 1 1 1 1 11 TYR QB 1 11 TYR HB* 1 1 102 1 2 1 1 12 LEU HA 1 12 LEU HA 1 1 103 1 1 1 1 11 TYR QB 1 11 TYR HB* 1 1 103 1 2 1 1 12 LEU QB 1 12 LEU HB* 1 1 104 1 1 1 1 11 TYR QB 1 11 TYR HB* 1 1 104 1 2 1 1 16 ARG QB 1 16 ARG HB* 1 1 105 1 1 1 1 11 TYR QB 1 11 TYR HB* 1 1 105 1 2 1 1 16 ARG QG 1 16 ARG HG* 1 1 106 1 1 1 1 11 TYR QD 1 11 TYR HD* 1 1 106 1 2 1 1 12 LEU HA 1 12 LEU HA 1 1 107 1 1 1 1 11 TYR QD 1 11 TYR HD* 1 1 107 1 2 1 1 12 LEU QB 1 12 LEU HB* 1 1 108 1 1 1 1 11 TYR QD 1 11 TYR HD* 1 1 108 1 2 1 1 12 LEU QD 1 12 LEU HD* 1 1 109 1 1 1 1 11 TYR QD 1 11 TYR HD* 1 1 109 1 2 1 1 13 ASP QB 1 13 ASP HB* 1 1 110 1 1 1 1 11 TYR QE 1 11 TYR HE* 1 1 110 1 2 1 1 12 LEU QD 1 12 LEU HD* 1 1 111 1 1 1 1 12 LEU H 1 12 LEU HN 1 1 111 1 2 1 1 12 LEU QB 1 12 LEU HB* 1 1 112 1 1 1 1 12 LEU HA 1 12 LEU HA 1 1 112 1 2 1 1 13 ASP H 1 13 ASP HN 1 1 113 1 1 1 1 12 LEU HA 1 12 LEU HA 1 1 113 1 2 1 1 17 ALA MB 1 17 ALA HB* 1 1 114 1 1 1 1 12 LEU HA 1 12 LEU HA 1 1 114 1 2 1 1 18 GLN HE21 1 18 GLN HE22 1 1 115 1 1 1 1 12 LEU HA 1 12 LEU HA 1 1 115 1 2 1 1 18 GLN HE22 1 18 GLN HE21 1 1 116 1 1 1 1 13 ASP H 1 13 ASP HN 1 1 116 1 2 1 1 14 SER H 1 14 SER HN 1 1 117 1 1 1 1 13 ASP H 1 13 ASP HN 1 1 117 1 2 1 1 16 ARG HE 1 16 ARG HE 1 1 118 1 1 1 1 13 ASP HA 1 13 ASP HA 1 1 118 1 2 1 1 14 SER H 1 14 SER HN 1 1 119 1 1 1 1 13 ASP HA 1 13 ASP HA 1 1 119 1 2 1 1 18 GLN HE21 1 18 GLN HE22 1 1 120 1 1 1 1 13 ASP HA 1 13 ASP HA 1 1 120 1 2 1 1 18 GLN HE22 1 18 GLN HE21 1 1 121 1 1 1 1 13 ASP QB 1 13 ASP HB* 1 1 121 1 2 1 1 14 SER H 1 14 SER HN 1 1 122 1 1 1 1 13 ASP QB 1 13 ASP HB* 1 1 122 1 2 1 1 15 ARG H 1 15 ARG HN 1 1 123 1 1 1 1 13 ASP QB 1 13 ASP HB* 1 1 123 1 2 1 1 16 ARG H 1 16 ARG HN 1 1 124 1 1 1 1 14 SER H 1 14 SER HN 1 1 124 1 2 1 1 15 ARG H 1 15 ARG HN 1 1 125 1 1 1 1 14 SER H 1 14 SER HN 1 1 125 1 2 1 1 16 ARG H 1 16 ARG HN 1 1 126 1 1 1 1 14 SER H 1 14 SER HN 1 1 126 1 2 1 1 16 ARG QB 1 16 ARG HB* 1 1 127 1 1 1 1 14 SER H 1 14 SER HN 1 1 127 1 2 1 1 17 ALA MB 1 17 ALA HB* 1 1 128 1 1 1 1 14 SER H 1 14 SER HN 1 1 128 1 2 1 1 18 GLN H 1 18 GLN HN 1 1 129 1 1 1 1 14 SER H 1 14 SER HN 1 1 129 1 2 1 1 18 GLN QG 1 18 GLN HG* 1 1 130 1 1 1 1 14 SER QB 1 14 SER HB* 1 1 130 1 2 1 1 15 ARG H 1 15 ARG HN 1 1 131 1 1 1 1 14 SER QB 1 14 SER HB* 1 1 131 1 2 1 1 16 ARG H 1 16 ARG HN 1 1 132 1 1 1 1 14 SER QB 1 14 SER HB* 1 1 132 1 2 1 1 17 ALA H 1 17 ALA HN 1 1 133 1 1 1 1 15 ARG H 1 15 ARG HN 1 1 133 1 2 1 1 15 ARG QB 1 15 ARG HB* 1 1 134 1 1 1 1 15 ARG H 1 15 ARG HN 1 1 134 1 2 1 1 15 ARG QD 1 15 ARG HD* 1 1 135 1 1 1 1 15 ARG H 1 15 ARG HN 1 1 135 1 2 1 1 15 ARG QG 1 15 ARG HG* 1 1 136 1 1 1 1 15 ARG H 1 15 ARG HN 1 1 136 1 2 1 1 16 ARG H 1 16 ARG HN 1 1 137 1 1 1 1 15 ARG H 1 15 ARG HN 1 1 137 1 2 1 1 16 ARG QG 1 16 ARG HG* 1 1 138 1 1 1 1 15 ARG H 1 15 ARG HN 1 1 138 1 2 1 1 17 ALA H 1 17 ALA HN 1 1 139 1 1 1 1 15 ARG H 1 15 ARG HN 1 1 139 1 2 1 1 17 ALA MB 1 17 ALA HB* 1 1 140 1 1 1 1 15 ARG H 1 15 ARG HN 1 1 140 1 2 1 1 18 GLN H 1 18 GLN HN 1 1 141 1 1 1 1 15 ARG H 1 15 ARG HN 1 1 141 1 2 1 1 18 GLN QB 1 18 GLN HB* 1 1 142 1 1 1 1 15 ARG HA 1 15 ARG HA 1 1 142 1 2 1 1 15 ARG QG 1 15 ARG HG* 1 1 143 1 1 1 1 15 ARG HA 1 15 ARG HA 1 1 143 1 2 1 1 16 ARG H 1 16 ARG HN 1 1 144 1 1 1 1 15 ARG HA 1 15 ARG HA 1 1 144 1 2 1 1 18 GLN H 1 18 GLN HN 1 1 145 1 1 1 1 15 ARG HA 1 15 ARG HA 1 1 145 1 2 1 1 18 GLN HE21 1 18 GLN HE22 1 1 146 1 1 1 1 15 ARG HA 1 15 ARG HA 1 1 146 1 2 1 1 18 GLN HE22 1 18 GLN HE21 1 1 147 1 1 1 1 15 ARG HA 1 15 ARG HA 1 1 147 1 2 1 1 19 ASP H 1 19 ASP HN 1 1 148 1 1 1 1 15 ARG QB 1 15 ARG HB* 1 1 148 1 2 1 1 19 ASP H 1 19 ASP HN 1 1 149 1 1 1 1 15 ARG QD 1 15 ARG HD* 1 1 149 1 2 1 1 17 ALA H 1 17 ALA HN 1 1 150 1 1 1 1 15 ARG QD 1 15 ARG HD* 1 1 150 1 2 1 1 18 GLN HE21 1 18 GLN HE22 1 1 151 1 1 1 1 15 ARG QD 1 15 ARG HD* 1 1 151 1 2 1 1 19 ASP H 1 19 ASP HN 1 1 152 1 1 1 1 15 ARG QD 1 15 ARG HD* 1 1 152 1 2 1 1 20 PHE QD 1 20 PHE HD* 1 1 153 1 1 1 1 15 ARG QG 1 15 ARG HG* 1 1 153 1 2 1 1 18 GLN HE21 1 18 GLN HE22 1 1 154 1 1 1 1 15 ARG QG 1 15 ARG HG* 1 1 154 1 2 1 1 19 ASP H 1 19 ASP HN 1 1 155 1 1 1 1 16 ARG H 1 16 ARG HN 1 1 155 1 2 1 1 16 ARG QD 1 16 ARG HD* 1 1 156 1 1 1 1 16 ARG H 1 16 ARG HN 1 1 156 1 2 1 1 17 ALA H 1 17 ALA HN 1 1 157 1 1 1 1 16 ARG H 1 16 ARG HN 1 1 157 1 2 1 1 19 ASP QB 1 19 ASP HB* 1 1 158 1 1 1 1 16 ARG HA 1 16 ARG HA 1 1 158 1 2 1 1 16 ARG QD 1 16 ARG HD* 1 1 159 1 1 1 1 16 ARG HA 1 16 ARG HA 1 1 159 1 2 1 1 16 ARG QG 1 16 ARG HG* 1 1 160 1 1 1 1 16 ARG HA 1 16 ARG HA 1 1 160 1 2 1 1 19 ASP H 1 19 ASP HN 1 1 161 1 1 1 1 16 ARG HA 1 16 ARG HA 1 1 161 1 2 1 1 19 ASP QB 1 19 ASP HB* 1 1 162 1 1 1 1 16 ARG QB 1 16 ARG HB* 1 1 162 1 2 1 1 17 ALA H 1 17 ALA HN 1 1 163 1 1 1 1 16 ARG QD 1 16 ARG HD* 1 1 163 1 2 1 1 17 ALA H 1 17 ALA HN 1 1 164 1 1 1 1 16 ARG HE 1 16 ARG HE 1 1 164 1 2 1 1 17 ALA MB 1 17 ALA HB* 1 1 165 1 1 1 1 16 ARG QG 1 16 ARG HG* 1 1 165 1 2 1 1 17 ALA H 1 17 ALA HN 1 1 166 1 1 1 1 16 ARG QG 1 16 ARG HG* 1 1 166 1 2 1 1 18 GLN H 1 18 GLN HN 1 1 167 1 1 1 1 16 ARG QG 1 16 ARG HG* 1 1 167 1 2 1 1 19 ASP H 1 19 ASP HN 1 1 168 1 1 1 1 16 ARG QG 1 16 ARG HG* 1 1 168 1 2 1 1 19 ASP QB 1 19 ASP HB* 1 1 169 1 1 1 1 16 ARG QG 1 16 ARG HG* 1 1 169 1 2 1 1 20 PHE H 1 20 PHE HN 1 1 170 1 1 1 1 16 ARG QG 1 16 ARG HG* 1 1 170 1 2 1 1 20 PHE QD 1 20 PHE HD* 1 1 171 1 1 1 1 17 ALA H 1 17 ALA HN 1 1 171 1 2 1 1 18 GLN H 1 18 GLN HN 1 1 172 1 1 1 1 17 ALA H 1 17 ALA HN 1 1 172 1 2 1 1 18 GLN QG 1 18 GLN HG* 1 1 173 1 1 1 1 17 ALA H 1 17 ALA HN 1 1 173 1 2 1 1 19 ASP H 1 19 ASP HN 1 1 174 1 1 1 1 17 ALA H 1 17 ALA HN 1 1 174 1 2 1 1 20 PHE H 1 20 PHE HN 1 1 175 1 1 1 1 17 ALA H 1 17 ALA HN 1 1 175 1 2 1 1 20 PHE QB 1 20 PHE HB* 1 1 176 1 1 1 1 17 ALA H 1 17 ALA HN 1 1 176 1 2 1 1 21 VAL QG 1 21 VAL HG* 1 1 177 1 1 1 1 17 ALA HA 1 17 ALA HA 1 1 177 1 2 1 1 18 GLN H 1 18 GLN HN 1 1 178 1 1 1 1 17 ALA HA 1 17 ALA HA 1 1 178 1 2 1 1 20 PHE H 1 20 PHE HN 1 1 179 1 1 1 1 17 ALA HA 1 17 ALA HA 1 1 179 1 2 1 1 20 PHE QB 1 20 PHE HB* 1 1 180 1 1 1 1 17 ALA HA 1 17 ALA HA 1 1 180 1 2 1 1 20 PHE QD 1 20 PHE HD* 1 1 181 1 1 1 1 17 ALA MB 1 17 ALA HB* 1 1 181 1 2 1 1 18 GLN H 1 18 GLN HN 1 1 182 1 1 1 1 17 ALA MB 1 17 ALA HB* 1 1 182 1 2 1 1 19 ASP H 1 19 ASP HN 1 1 183 1 1 1 1 18 GLN H 1 18 GLN HN 1 1 183 1 2 1 1 18 GLN QG 1 18 GLN HG* 1 1 184 1 1 1 1 18 GLN H 1 18 GLN HN 1 1 184 1 2 1 1 19 ASP H 1 19 ASP HN 1 1 185 1 1 1 1 18 GLN H 1 18 GLN HN 1 1 185 1 2 1 1 19 ASP QB 1 19 ASP HB* 1 1 186 1 1 1 1 18 GLN H 1 18 GLN HN 1 1 186 1 2 1 1 20 PHE QB 1 20 PHE HB* 1 1 187 1 1 1 1 18 GLN HA 1 18 GLN HA 1 1 187 1 2 1 1 19 ASP H 1 19 ASP HN 1 1 188 1 1 1 1 18 GLN HA 1 18 GLN HA 1 1 188 1 2 1 1 20 PHE H 1 20 PHE HN 1 1 189 1 1 1 1 18 GLN HA 1 18 GLN HA 1 1 189 1 2 1 1 21 VAL H 1 21 VAL HN 1 1 190 1 1 1 1 18 GLN QB 1 18 GLN HB* 1 1 190 1 2 1 1 19 ASP H 1 19 ASP HN 1 1 191 1 1 1 1 18 GLN QB 1 18 GLN HB* 1 1 191 1 2 1 1 21 VAL H 1 21 VAL HN 1 1 192 1 1 1 1 18 GLN HE22 1 18 GLN HE21 1 1 192 1 2 1 1 21 VAL QG 1 21 VAL HG* 1 1 193 1 1 1 1 18 GLN QG 1 18 GLN HG* 1 1 193 1 2 1 1 19 ASP H 1 19 ASP HN 1 1 194 1 1 1 1 19 ASP H 1 19 ASP HN 1 1 194 1 2 1 1 19 ASP QB 1 19 ASP HB* 1 1 195 1 1 1 1 19 ASP H 1 19 ASP HN 1 1 195 1 2 1 1 20 PHE H 1 20 PHE HN 1 1 196 1 1 1 1 19 ASP H 1 19 ASP HN 1 1 196 1 2 1 1 20 PHE QB 1 20 PHE HB* 1 1 197 1 1 1 1 19 ASP H 1 19 ASP HN 1 1 197 1 2 1 1 20 PHE QD 1 20 PHE HD* 1 1 198 1 1 1 1 19 ASP H 1 19 ASP HN 1 1 198 1 2 1 1 21 VAL H 1 21 VAL HN 1 1 199 1 1 1 1 19 ASP H 1 19 ASP HN 1 1 199 1 2 1 1 21 VAL QG 1 21 VAL HG* 1 1 200 1 1 1 1 19 ASP H 1 19 ASP HN 1 1 200 1 2 1 1 23 TRP H 1 23 TRP HN 1 1 201 1 1 1 1 19 ASP HA 1 19 ASP HA 1 1 201 1 2 1 1 22 GLN H 1 22 GLN HN 1 1 202 1 1 1 1 19 ASP QB 1 19 ASP HB* 1 1 202 1 2 1 1 20 PHE H 1 20 PHE HN 1 1 203 1 1 1 1 20 PHE H 1 20 PHE HN 1 1 203 1 2 1 1 20 PHE QB 1 20 PHE HB* 1 1 204 1 1 1 1 20 PHE H 1 20 PHE HN 1 1 204 1 2 1 1 20 PHE QD 1 20 PHE HD* 1 1 205 1 1 1 1 20 PHE H 1 20 PHE HN 1 1 205 1 2 1 1 21 VAL H 1 21 VAL HN 1 1 206 1 1 1 1 20 PHE H 1 20 PHE HN 1 1 206 1 2 1 1 21 VAL HA 1 21 VAL HA 1 1 207 1 1 1 1 20 PHE H 1 20 PHE HN 1 1 207 1 2 1 1 21 VAL QG 1 21 VAL HG* 1 1 208 1 1 1 1 20 PHE H 1 20 PHE HN 1 1 208 1 2 1 1 23 TRP H 1 23 TRP HN 1 1 209 1 1 1 1 20 PHE H 1 20 PHE HN 1 1 209 1 2 1 1 23 TRP QB 1 23 TRP HB* 1 1 210 1 1 1 1 20 PHE HA 1 20 PHE HA 1 1 210 1 2 1 1 21 VAL H 1 21 VAL HN 1 1 211 1 1 1 1 20 PHE HA 1 20 PHE HA 1 1 211 1 2 1 1 23 TRP H 1 23 TRP HN 1 1 212 1 1 1 1 20 PHE HA 1 20 PHE HA 1 1 212 1 2 1 1 23 TRP QB 1 23 TRP HB* 1 1 213 1 1 1 1 20 PHE HA 1 20 PHE HA 1 1 213 1 2 1 1 23 TRP HD1 1 23 TRP HD1 1 1 214 1 1 1 1 20 PHE HA 1 20 PHE HA 1 1 214 1 2 1 1 23 TRP HE3 1 23 TRP HE3 1 1 215 1 1 1 1 20 PHE QB 1 20 PHE HB* 1 1 215 1 2 1 1 21 VAL H 1 21 VAL HN 1 1 216 1 1 1 1 20 PHE QB 1 20 PHE HB* 1 1 216 1 2 1 1 21 VAL QG 1 21 VAL HG* 1 1 217 1 1 1 1 20 PHE QB 1 20 PHE HB* 1 1 217 1 2 1 1 24 LEU QB 1 24 LEU HB* 1 1 218 1 1 1 1 20 PHE QD 1 20 PHE HD* 1 1 218 1 2 1 1 21 VAL H 1 21 VAL HN 1 1 219 1 1 1 1 20 PHE QD 1 20 PHE HD* 1 1 219 1 2 1 1 21 VAL HA 1 21 VAL HA 1 1 220 1 1 1 1 20 PHE QD 1 20 PHE HD* 1 1 220 1 2 1 1 21 VAL HB 1 21 VAL HB 1 1 221 1 1 1 1 20 PHE QD 1 20 PHE HD* 1 1 221 1 2 1 1 21 VAL QG 1 21 VAL HG* 1 1 222 1 1 1 1 20 PHE QD 1 20 PHE HD* 1 1 222 1 2 1 1 23 TRP H 1 23 TRP HN 1 1 223 1 1 1 1 20 PHE QD 1 20 PHE HD* 1 1 223 1 2 1 1 23 TRP HA 1 23 TRP HA 1 1 224 1 1 1 1 20 PHE QD 1 20 PHE HD* 1 1 224 1 2 1 1 23 TRP QB 1 23 TRP HB* 1 1 225 1 1 1 1 20 PHE QD 1 20 PHE HD* 1 1 225 1 2 1 1 24 LEU H 1 24 LEU HN 1 1 226 1 1 1 1 20 PHE QD 1 20 PHE HD* 1 1 226 1 2 1 1 24 LEU QB 1 24 LEU HB* 1 1 227 1 1 1 1 20 PHE QD 1 20 PHE HD* 1 1 227 1 2 1 1 24 LEU QD 1 24 LEU HD* 1 1 228 1 1 1 1 21 VAL H 1 21 VAL HN 1 1 228 1 2 1 1 22 GLN H 1 22 GLN HN 1 1 229 1 1 1 1 21 VAL H 1 21 VAL HN 1 1 229 1 2 1 1 23 TRP H 1 23 TRP HN 1 1 230 1 1 1 1 21 VAL H 1 21 VAL HN 1 1 230 1 2 1 1 23 TRP QB 1 23 TRP HB* 1 1 231 1 1 1 1 21 VAL H 1 21 VAL HN 1 1 231 1 2 1 1 24 LEU QD 1 24 LEU HD* 1 1 232 1 1 1 1 21 VAL H 1 21 VAL HN 1 1 232 1 2 1 1 25 MET H 1 25 MET HN 1 1 233 1 1 1 1 21 VAL HA 1 21 VAL HA 1 1 233 1 2 1 1 22 GLN H 1 22 GLN HN 1 1 234 1 1 1 1 21 VAL HA 1 21 VAL HA 1 1 234 1 2 1 1 23 TRP H 1 23 TRP HN 1 1 235 1 1 1 1 21 VAL HA 1 21 VAL HA 1 1 235 1 2 1 1 23 TRP HE3 1 23 TRP HE3 1 1 236 1 1 1 1 21 VAL HA 1 21 VAL HA 1 1 236 1 2 1 1 24 LEU H 1 24 LEU HN 1 1 237 1 1 1 1 21 VAL HA 1 21 VAL HA 1 1 237 1 2 1 1 24 LEU QB 1 24 LEU HB* 1 1 238 1 1 1 1 21 VAL HA 1 21 VAL HA 1 1 238 1 2 1 1 24 LEU QD 1 24 LEU HD* 1 1 239 1 1 1 1 21 VAL HA 1 21 VAL HA 1 1 239 1 2 1 1 25 MET H 1 25 MET HN 1 1 240 1 1 1 1 21 VAL HA 1 21 VAL HA 1 1 240 1 2 1 1 25 MET QB 1 25 MET HB* 1 1 241 1 1 1 1 21 VAL HB 1 21 VAL HB 1 1 241 1 2 1 1 23 TRP H 1 23 TRP HN 1 1 242 1 1 1 1 21 VAL QG 1 21 VAL HG* 1 1 242 1 2 1 1 22 GLN H 1 22 GLN HN 1 1 243 1 1 1 1 21 VAL QG 1 21 VAL HG* 1 1 243 1 2 1 1 22 GLN HE21 1 22 GLN HE21 1 1 244 1 1 1 1 21 VAL QG 1 21 VAL HG* 1 1 244 1 2 1 1 23 TRP H 1 23 TRP HN 1 1 245 1 1 1 1 21 VAL QG 1 21 VAL HG* 1 1 245 1 2 1 1 23 TRP HE3 1 23 TRP HE3 1 1 246 1 1 1 1 21 VAL QG 1 21 VAL HG* 1 1 246 1 2 1 1 24 LEU H 1 24 LEU HN 1 1 247 1 1 1 1 21 VAL QG 1 21 VAL HG* 1 1 247 1 2 1 1 24 LEU QB 1 24 LEU HB* 1 1 248 1 1 1 1 21 VAL QG 1 21 VAL HG* 1 1 248 1 2 1 1 24 LEU QD 1 24 LEU HD* 1 1 249 1 1 1 1 21 VAL QG 1 21 VAL HG* 1 1 249 1 2 1 1 25 MET H 1 25 MET HN 1 1 250 1 1 1 1 21 VAL QG 1 21 VAL HG* 1 1 250 1 2 1 1 25 MET QB 1 25 MET HB* 1 1 251 1 1 1 1 21 VAL QG 1 21 VAL HG* 1 1 251 1 2 1 1 25 MET QG 1 25 MET HG* 1 1 252 1 1 1 1 22 GLN H 1 22 GLN HN 1 1 252 1 2 1 1 22 GLN QG 1 22 GLN HG* 1 1 253 1 1 1 1 22 GLN H 1 22 GLN HN 1 1 253 1 2 1 1 23 TRP H 1 23 TRP HN 1 1 254 1 1 1 1 22 GLN H 1 22 GLN HN 1 1 254 1 2 1 1 23 TRP QB 1 23 TRP HB* 1 1 255 1 1 1 1 22 GLN H 1 22 GLN HN 1 1 255 1 2 1 1 24 LEU QD 1 24 LEU HD* 1 1 256 1 1 1 1 22 GLN H 1 22 GLN HN 1 1 256 1 2 1 1 25 MET H 1 25 MET HN 1 1 257 1 1 1 1 22 GLN H 1 22 GLN HN 1 1 257 1 2 1 1 25 MET QB 1 25 MET HB* 1 1 258 1 1 1 1 22 GLN HA 1 22 GLN HA 1 1 258 1 2 1 1 22 GLN HE21 1 22 GLN HE21 1 1 259 1 1 1 1 22 GLN HA 1 22 GLN HA 1 1 259 1 2 1 1 23 TRP H 1 23 TRP HN 1 1 260 1 1 1 1 22 GLN HA 1 22 GLN HA 1 1 260 1 2 1 1 25 MET H 1 25 MET HN 1 1 261 1 1 1 1 22 GLN QB 1 22 GLN HB* 1 1 261 1 2 1 1 23 TRP H 1 23 TRP HN 1 1 262 1 1 1 1 22 GLN QB 1 22 GLN HB* 1 1 262 1 2 1 1 23 TRP HD1 1 23 TRP HD1 1 1 263 1 1 1 1 22 GLN QB 1 22 GLN HB* 1 1 263 1 2 1 1 26 ASN H 1 26 ASN HN 1 1 264 1 1 1 1 22 GLN QG 1 22 GLN HG* 1 1 264 1 2 1 1 23 TRP H 1 23 TRP HN 1 1 265 1 1 1 1 22 GLN QG 1 22 GLN HG* 1 1 265 1 2 1 1 24 LEU H 1 24 LEU HN 1 1 266 1 1 1 1 22 GLN QG 1 22 GLN HG* 1 1 266 1 2 1 1 25 MET H 1 25 MET HN 1 1 267 1 1 1 1 22 GLN QG 1 22 GLN HG* 1 1 267 1 2 1 1 26 ASN H 1 26 ASN HN 1 1 268 1 1 1 1 23 TRP H 1 23 TRP HN 1 1 268 1 2 1 1 23 TRP QB 1 23 TRP HB* 1 1 269 1 1 1 1 23 TRP H 1 23 TRP HN 1 1 269 1 2 1 1 23 TRP HD1 1 23 TRP HD1 1 1 270 1 1 1 1 23 TRP H 1 23 TRP HN 1 1 270 1 2 1 1 23 TRP HE3 1 23 TRP HE3 1 1 271 1 1 1 1 23 TRP H 1 23 TRP HN 1 1 271 1 2 1 1 24 LEU H 1 24 LEU HN 1 1 272 1 1 1 1 23 TRP H 1 23 TRP HN 1 1 272 1 2 1 1 24 LEU QB 1 24 LEU HB* 1 1 273 1 1 1 1 23 TRP H 1 23 TRP HN 1 1 273 1 2 1 1 24 LEU QD 1 24 LEU HD* 1 1 274 1 1 1 1 23 TRP H 1 23 TRP HN 1 1 274 1 2 1 1 25 MET QB 1 25 MET HB* 1 1 275 1 1 1 1 23 TRP HA 1 23 TRP HA 1 1 275 1 2 1 1 23 TRP HD1 1 23 TRP HD1 1 1 276 1 1 1 1 23 TRP HA 1 23 TRP HA 1 1 276 1 2 1 1 23 TRP HE3 1 23 TRP HE3 1 1 277 1 1 1 1 23 TRP HA 1 23 TRP HA 1 1 277 1 2 1 1 24 LEU QD 1 24 LEU HD* 1 1 278 1 1 1 1 23 TRP HA 1 23 TRP HA 1 1 278 1 2 1 1 25 MET H 1 25 MET HN 1 1 279 1 1 1 1 23 TRP HA 1 23 TRP HA 1 1 279 1 2 1 1 26 ASN QB 1 26 ASN HB* 1 1 280 1 1 1 1 23 TRP QB 1 23 TRP HB* 1 1 280 1 2 1 1 23 TRP HD1 1 23 TRP HD1 1 1 281 1 1 1 1 23 TRP QB 1 23 TRP HB* 1 1 281 1 2 1 1 23 TRP HE3 1 23 TRP HE3 1 1 282 1 1 1 1 23 TRP QB 1 23 TRP HB* 1 1 282 1 2 1 1 24 LEU H 1 24 LEU HN 1 1 283 1 1 1 1 23 TRP QB 1 23 TRP HB* 1 1 283 1 2 1 1 24 LEU QB 1 24 LEU HB* 1 1 284 1 1 1 1 23 TRP QB 1 23 TRP HB* 1 1 284 1 2 1 1 24 LEU QD 1 24 LEU HD* 1 1 285 1 1 1 1 23 TRP QB 1 23 TRP HB* 1 1 285 1 2 1 1 25 MET H 1 25 MET HN 1 1 286 1 1 1 1 23 TRP HD1 1 23 TRP HD1 1 1 286 1 2 1 1 24 LEU H 1 24 LEU HN 1 1 287 1 1 1 1 23 TRP HD1 1 23 TRP HD1 1 1 287 1 2 1 1 24 LEU QD 1 24 LEU HD* 1 1 288 1 1 1 1 23 TRP HD1 1 23 TRP HD1 1 1 288 1 2 1 1 25 MET H 1 25 MET HN 1 1 289 1 1 1 1 23 TRP HD1 1 23 TRP HD1 1 1 289 1 2 1 1 27 THR HA 1 27 THR HA 1 1 290 1 1 1 1 23 TRP HD1 1 23 TRP HD1 1 1 290 1 2 1 1 27 THR HB 1 27 THR HB 1 1 291 1 1 1 1 23 TRP HD1 1 23 TRP HD1 1 1 291 1 2 1 1 27 THR MG 1 27 THR HG2* 1 1 292 1 1 1 1 23 TRP HE3 1 23 TRP HE3 1 1 292 1 2 1 1 24 LEU H 1 24 LEU HN 1 1 293 1 1 1 1 23 TRP HE3 1 23 TRP HE3 1 1 293 1 2 1 1 24 LEU QB 1 24 LEU HB* 1 1 294 1 1 1 1 23 TRP HE3 1 23 TRP HE3 1 1 294 1 2 1 1 24 LEU QD 1 24 LEU HD* 1 1 295 1 1 1 1 23 TRP HE3 1 23 TRP HE3 1 1 295 1 2 1 1 25 MET H 1 25 MET HN 1 1 296 1 1 1 1 23 TRP HE3 1 23 TRP HE3 1 1 296 1 2 1 1 27 THR MG 1 27 THR HG2* 1 1 297 1 1 1 1 23 TRP HH2 1 23 TRP HH2 1 1 297 1 2 1 1 24 LEU QD 1 24 LEU HD* 1 1 298 1 1 1 1 23 TRP HH2 1 23 TRP HH2 1 1 298 1 2 1 1 27 THR MG 1 27 THR HG2* 1 1 299 1 1 1 1 23 TRP HZ2 1 23 TRP HZ2 1 1 299 1 2 1 1 24 LEU QD 1 24 LEU HD* 1 1 300 1 1 1 1 23 TRP HZ3 1 23 TRP HZ3 1 1 300 1 2 1 1 24 LEU H 1 24 LEU HN 1 1 301 1 1 1 1 23 TRP HZ3 1 23 TRP HZ3 1 1 301 1 2 1 1 24 LEU QB 1 24 LEU HB* 1 1 302 1 1 1 1 23 TRP HZ3 1 23 TRP HZ3 1 1 302 1 2 1 1 24 LEU QD 1 24 LEU HD* 1 1 303 1 1 1 1 23 TRP HZ3 1 23 TRP HZ3 1 1 303 1 2 1 1 27 THR MG 1 27 THR HG2* 1 1 304 1 1 1 1 24 LEU H 1 24 LEU HN 1 1 304 1 2 1 1 24 LEU QB 1 24 LEU HB* 1 1 305 1 1 1 1 24 LEU H 1 24 LEU HN 1 1 305 1 2 1 1 24 LEU HG 1 24 LEU HG 1 1 306 1 1 1 1 24 LEU H 1 24 LEU HN 1 1 306 1 2 1 1 25 MET H 1 25 MET HN 1 1 307 1 1 1 1 24 LEU H 1 24 LEU HN 1 1 307 1 2 1 1 25 MET QB 1 25 MET HB* 1 1 308 1 1 1 1 24 LEU H 1 24 LEU HN 1 1 308 1 2 1 1 26 ASN H 1 26 ASN HN 1 1 309 1 1 1 1 24 LEU HA 1 24 LEU HA 1 1 309 1 2 1 1 24 LEU QD 1 24 LEU HD* 1 1 310 1 1 1 1 24 LEU HA 1 24 LEU HA 1 1 310 1 2 1 1 25 MET QB 1 25 MET HB* 1 1 311 1 1 1 1 24 LEU HA 1 24 LEU HA 1 1 311 1 2 1 1 26 ASN H 1 26 ASN HN 1 1 312 1 1 1 1 24 LEU HA 1 24 LEU HA 1 1 312 1 2 1 1 27 THR MG 1 27 THR HG2* 1 1 313 1 1 1 1 24 LEU QB 1 24 LEU HB* 1 1 313 1 2 1 1 25 MET H 1 25 MET HN 1 1 314 1 1 1 1 24 LEU QB 1 24 LEU HB* 1 1 314 1 2 1 1 25 MET HA 1 25 MET HA 1 1 315 1 1 1 1 24 LEU QB 1 24 LEU HB* 1 1 315 1 2 1 1 25 MET QB 1 25 MET HB* 1 1 316 1 1 1 1 24 LEU QB 1 24 LEU HB* 1 1 316 1 2 1 1 25 MET QG 1 25 MET HG* 1 1 317 1 1 1 1 24 LEU QB 1 24 LEU HB* 1 1 317 1 2 1 1 26 ASN H 1 26 ASN HN 1 1 318 1 1 1 1 24 LEU QD 1 24 LEU HD* 1 1 318 1 2 1 1 25 MET H 1 25 MET HN 1 1 319 1 1 1 1 24 LEU QD 1 24 LEU HD* 1 1 319 1 2 1 1 25 MET HA 1 25 MET HA 1 1 320 1 1 1 1 24 LEU QD 1 24 LEU HD* 1 1 320 1 2 1 1 25 MET QB 1 25 MET HB* 1 1 321 1 1 1 1 24 LEU QD 1 24 LEU HD* 1 1 321 1 2 1 1 25 MET QG 1 25 MET HG* 1 1 322 1 1 1 1 24 LEU QD 1 24 LEU HD* 1 1 322 1 2 1 1 26 ASN H 1 26 ASN HN 1 1 323 1 1 1 1 24 LEU QD 1 24 LEU HD* 1 1 323 1 2 1 1 27 THR HB 1 27 THR HB 1 1 324 1 1 1 1 24 LEU HG 1 24 LEU HG 1 1 324 1 2 1 1 25 MET H 1 25 MET HN 1 1 325 1 1 1 1 25 MET H 1 25 MET HN 1 1 325 1 2 1 1 25 MET QB 1 25 MET HB* 1 1 326 1 1 1 1 25 MET H 1 25 MET HN 1 1 326 1 2 1 1 25 MET QG 1 25 MET HG* 1 1 327 1 1 1 1 25 MET H 1 25 MET HN 1 1 327 1 2 1 1 26 ASN H 1 26 ASN HN 1 1 328 1 1 1 1 25 MET H 1 25 MET HN 1 1 328 1 2 1 1 26 ASN QB 1 26 ASN HB* 1 1 329 1 1 1 1 25 MET H 1 25 MET HN 1 1 329 1 2 1 1 27 THR MG 1 27 THR HG2* 1 1 330 1 1 1 1 25 MET HA 1 25 MET HA 1 1 330 1 2 1 1 25 MET QG 1 25 MET HG* 1 1 331 1 1 1 1 25 MET HA 1 25 MET HA 1 1 331 1 2 1 1 26 ASN H 1 26 ASN HN 1 1 332 1 1 1 1 25 MET QB 1 25 MET HB* 1 1 332 1 2 1 1 26 ASN H 1 26 ASN HN 1 1 333 1 1 1 1 25 MET QB 1 25 MET HB* 1 1 333 1 2 1 1 26 ASN HD21 1 26 ASN HD21 1 1 334 1 1 1 1 25 MET QB 1 25 MET HB* 1 1 334 1 2 1 1 27 THR MG 1 27 THR HG2* 1 1 335 1 1 1 1 25 MET QG 1 25 MET HG* 1 1 335 1 2 1 1 26 ASN H 1 26 ASN HN 1 1 336 1 1 1 1 26 ASN H 1 26 ASN HN 1 1 336 1 2 1 1 27 THR HB 1 27 THR HB 1 1 337 1 1 1 1 26 ASN H 1 26 ASN HN 1 1 337 1 2 1 1 27 THR MG 1 27 THR HG2* 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 6.5 -1.0 6.5 1 1 2 1 . . . . . 6.5 -1.0 7.5 1 1 3 1 . . . . . 4.0 -1.0 4.0 1 1 4 1 . . . . . 5.0 -1.0 5.0 1 1 5 1 . . . . . 4.0 -1.0 5.0 1 1 6 1 . . . . . 4.0 -1.0 4.0 1 1 7 1 . . . . . 5.0 -1.0 5.0 1 1 8 1 . . . . . 6.5 -1.0 6.5 1 1 9 1 . . . . . 6.5 -1.0 7.5 1 1 10 1 . . . . . 3.3 -1.0 3.3 1 1 11 1 . . . . . 6.5 -1.0 8.5 1 1 12 1 . . . . . 6.5 -1.0 8.5 1 1 13 1 . . . . . 6.5 -1.0 9.0 1 1 14 1 . . . . . 4.0 -1.0 4.0 1 1 15 1 . . . . . 6.5 -1.0 7.5 1 1 16 1 . . . . . 4.0 -1.0 4.0 1 1 17 1 . . . . . 5.0 -1.0 5.0 1 1 18 1 . . . . . 5.0 -1.0 7.0 1 1 19 1 . . . . . 6.5 -1.0 8.5 1 1 20 1 . . . . . 4.0 -1.0 4.0 1 1 21 1 . . . . . 6.5 -1.0 8.5 1 1 22 1 . . . . . 5.0 -1.0 5.0 1 1 23 1 . . . . . 6.5 -1.0 8.5 1 1 24 1 . . . . . 4.442 -1.0 4.442 1 1 25 1 . . . . . 6.5 -1.0 9.5 1 1 26 1 . . . . . 6.5 -1.0 7.5 1 1 27 1 . . . . . 6.5 -1.0 7.5 1 1 28 1 . . . . . 3.3 -1.0 4.3 1 1 29 1 . . . . . 4.0 -1.0 4.0 1 1 30 1 . . . . . 6.5 -1.0 7.5 1 1 31 1 . . . . . 6.5 -1.0 8.5 1 1 32 1 . . . . . 6.5 -1.0 8.5 1 1 33 1 . . . . . 4.0 -1.0 4.0 1 1 34 1 . . . . . 6.5 -1.0 8.5 1 1 35 1 . . . . . 5.0 -1.0 5.0 1 1 36 1 . . . . . 6.5 -1.0 8.5 1 1 37 1 . . . . . 4.0 -1.0 5.0 1 1 38 1 . . . . . 5.0 -1.0 8.0 1 1 39 1 . . . . . 6.5 -1.0 9.5 1 1 40 1 . . . . . 6.5 -1.0 7.5 1 1 41 1 . . . . . 6.5 -1.0 9.5 1 1 42 1 . . . . . 6.5 -1.0 9.5 1 1 43 1 . . . . . 6.5 -1.0 9.5 1 1 44 1 . . . . . 6.5 -1.0 9.5 1 1 45 1 . . . . . 3.183 -1.0 3.183 1 1 46 1 . . . . . 4.0 -1.0 6.0 1 1 47 1 . . . . . 5.0 -1.0 7.0 1 1 48 1 . . . . . 6.5 -1.0 6.5 1 1 49 1 . . . . . 5.0 -1.0 7.0 1 1 50 1 . . . . . 6.5 -1.0 8.5 1 1 51 1 . . . . . 8.455 -1.0 8.455 1 1 52 1 . . . . . 6.5 -1.0 8.5 1 1 53 1 . . . . . 5.0 -1.0 7.0 1 1 54 1 . . . . . 8.455 -1.0 8.455 1 1 55 1 . . . . . 8.857 -1.0 8.857 1 1 56 1 . . . . . 6.5 -1.0 9.5 1 1 57 1 . . . . . 8.455 -1.0 8.455 1 1 58 1 . . . . . 8.857 -1.0 8.857 1 1 59 1 . . . . . 3.3 -1.0 3.3 1 1 60 1 . . . . . 5.0 -1.0 6.0 1 1 61 1 . . . . . 5.731 -1.0 5.731 1 1 62 1 . . . . . 5.0 -1.0 5.0 1 1 63 1 . . . . . 5.0 -1.0 6.0 1 1 64 1 . . . . . 6.5 -1.0 8.9 1 1 65 1 . . . . . 4.922 -1.0 4.922 1 1 66 1 . . . . . 6.44 -1.0 6.44 1 1 67 1 . . . . . 3.56 -1.0 3.56 1 1 68 1 . . . . . 5.0 -1.0 6.0 1 1 69 1 . . . . . 3.902 -1.0 3.902 1 1 70 1 . . . . . 3.3 -1.0 3.3 1 1 71 1 . . . . . 6.5 -1.0 6.5 1 1 72 1 . . . . . 6.5 -1.0 7.5 1 1 73 1 . . . . . 6.5 -1.0 8.9 1 1 74 1 . . . . . 5.0 -1.0 6.0 1 1 75 1 . . . . . 4.0 -1.0 4.0 1 1 76 1 . . . . . 5.0 -1.0 6.0 1 1 77 1 . . . . . 3.902 -1.0 3.902 1 1 78 1 . . . . . 4.991 -1.0 4.991 1 1 79 1 . . . . . 7.736 -1.0 7.736 1 1 80 1 . . . . . 8.454 -1.0 8.454 1 1 81 1 . . . . . 6.5 -1.0 9.9 1 1 82 1 . . . . . 6.5 -1.0 7.5 1 1 83 1 . . . . . 6.5 -1.0 9.5 1 1 84 1 . . . . . 6.5 -1.0 9.5 1 1 85 1 . . . . . 6.5 -1.0 7.5 1 1 86 1 . . . . . 4.441 -1.0 4.441 1 1 87 1 . . . . . 5.0 -1.0 8.0 1 1 88 1 . . . . . 6.5 -1.0 9.5 1 1 89 1 . . . . . 3.183 -1.0 3.183 1 1 90 1 . . . . . 5.0 -1.0 7.0 1 1 91 1 . . . . . 3.3 -1.0 3.3 1 1 92 1 . . . . . 5.0 -1.0 5.0 1 1 93 1 . . . . . 4.0 -1.0 5.0 1 1 94 1 . . . . . 6.5 -1.0 8.9 1 1 95 1 . . . . . 5.0 -1.0 7.0 1 1 96 1 . . . . . 4.0 -1.0 4.0 1 1 97 1 . . . . . 5.0 -1.0 6.0 1 1 98 1 . . . . . 5.0 -1.0 6.0 1 1 99 1 . . . . . 5.0 -1.0 6.0 1 1 100 1 . . . . . 5.0 -1.0 5.0 1 1 101 1 . . . . . 4.0 -1.0 4.5 1 1 102 1 . . . . . 5.0 -1.0 6.0 1 1 103 1 . . . . . 4.0 -1.0 6.0 1 1 104 1 . . . . . 4.0 -1.0 6.0 1 1 105 1 . . . . . 3.3 -1.0 5.3 1 1 106 1 . . . . . 6.5 -1.0 8.5 1 1 107 1 . . . . . 5.0 -1.0 8.0 1 1 108 1 . . . . . 6.5 -1.0 10.9 1 1 109 1 . . . . . 5.0 -1.0 8.0 1 1 110 1 . . . . . 6.5 -1.0 10.9 1 1 111 1 . . . . . 3.903 -1.0 3.903 1 1 112 1 . . . . . 4.0 -1.0 4.0 1 1 113 1 . . . . . 6.5 -1.0 7.0 1 1 114 1 . . . . . 6.5 -1.0 6.5 1 1 115 1 . . . . . 6.5 -1.0 6.5 1 1 116 1 . . . . . 5.0 -1.0 5.0 1 1 117 1 . . . . . 4.0 -1.0 4.0 1 1 118 1 . . . . . 3.3 -1.0 3.3 1 1 119 1 . . . . . 6.5 -1.0 6.5 1 1 120 1 . . . . . 6.5 -1.0 6.5 1 1 121 1 . . . . . 4.923 -1.0 4.923 1 1 122 1 . . . . . 6.441 -1.0 6.441 1 1 123 1 . . . . . 5.732 -1.0 5.732 1 1 124 1 . . . . . 6.5 -1.0 6.5 1 1 125 1 . . . . . 5.0 -1.0 5.0 1 1 126 1 . . . . . 6.5 -1.0 7.5 1 1 127 1 . . . . . 6.5 -1.0 7.0 1 1 128 1 . . . . . 6.5 -1.0 6.5 1 1 129 1 . . . . . 6.5 -1.0 7.5 1 1 130 1 . . . . . 5.325 -1.0 5.325 1 1 131 1 . . . . . 5.0 -1.0 6.0 1 1 132 1 . . . . . 6.44 -1.0 6.44 1 1 133 1 . . . . . 3.3 -1.0 4.3 1 1 134 1 . . . . . 5.0 -1.0 6.0 1 1 135 1 . . . . . 4.0 -1.0 5.0 1 1 136 1 . . . . . 3.3 -1.0 3.3 1 1 137 1 . . . . . 5.0 -1.0 6.0 1 1 138 1 . . . . . 6.5 -1.0 6.5 1 1 139 1 . . . . . 6.5 -1.0 7.0 1 1 140 1 . . . . . 6.5 -1.0 6.5 1 1 141 1 . . . . . 6.5 -1.0 7.5 1 1 142 1 . . . . . 3.3 -1.0 4.3 1 1 143 1 . . . . . 6.5 -1.0 6.5 1 1 144 1 . . . . . 5.0 -1.0 5.0 1 1 145 1 . . . . . 6.5 -1.0 6.5 1 1 146 1 . . . . . 6.5 -1.0 6.5 1 1 147 1 . . . . . 5.0 -1.0 5.0 1 1 148 1 . . . . . 6.5 -1.0 7.5 1 1 149 1 . . . . . 6.5 -1.0 7.5 1 1 150 1 . . . . . 6.5 -1.0 7.5 1 1 151 1 . . . . . 6.5 -1.0 7.5 1 1 152 1 . . . . . 6.5 -1.0 9.5 1 1 153 1 . . . . . 6.5 -1.0 7.5 1 1 154 1 . . . . . 5.0 -1.0 6.0 1 1 155 1 . . . . . 4.439 -1.0 4.439 1 1 156 1 . . . . . 3.3 -1.0 3.3 1 1 157 1 . . . . . 5.0 -1.0 6.0 1 1 158 1 . . . . . 4.92 -1.0 4.92 1 1 159 1 . . . . . 3.3 -1.0 4.3 1 1 160 1 . . . . . 6.5 -1.0 6.5 1 1 161 1 . . . . . 3.561 -1.0 3.561 1 1 162 1 . . . . . 4.0 -1.0 5.0 1 1 163 1 . . . . . 5.0 -1.0 6.0 1 1 164 1 . . . . . 6.5 -1.0 7.0 1 1 165 1 . . . . . 4.0 -1.0 5.0 1 1 166 1 . . . . . 5.0 -1.0 6.0 1 1 167 1 . . . . . 5.0 -1.0 6.0 1 1 168 1 . . . . . 5.0 -1.0 7.0 1 1 169 1 . . . . . 6.5 -1.0 7.5 1 1 170 1 . . . . . 6.5 -1.0 9.5 1 1 171 1 . . . . . 3.3 -1.0 3.3 1 1 172 1 . . . . . 5.0 -1.0 6.0 1 1 173 1 . . . . . 5.0 -1.0 5.0 1 1 174 1 . . . . . 6.5 -1.0 6.5 1 1 175 1 . . . . . 5.0 -1.0 6.0 1 1 176 1 . . . . . 6.5 -1.0 8.9 1 1 177 1 . . . . . 5.0 -1.0 5.0 1 1 178 1 . . . . . 4.0 -1.0 4.0 1 1 179 1 . . . . . 3.3 -1.0 4.3 1 1 180 1 . . . . . 5.0 -1.0 7.0 1 1 181 1 . . . . . 6.5 -1.0 7.0 1 1 182 1 . . . . . 5.0 -1.0 5.5 1 1 183 1 . . . . . 4.923 -1.0 4.923 1 1 184 1 . . . . . 5.0 -1.0 5.0 1 1 185 1 . . . . . 6.441 -1.0 6.441 1 1 186 1 . . . . . 6.5 -1.0 7.5 1 1 187 1 . . . . . 4.0 -1.0 4.0 1 1 188 1 . . . . . 6.5 -1.0 6.5 1 1 189 1 . . . . . 3.3 -1.0 3.3 1 1 190 1 . . . . . 5.0 -1.0 6.0 1 1 191 1 . . . . . 6.5 -1.0 7.5 1 1 192 1 . . . . . 6.5 -1.0 8.9 1 1 193 1 . . . . . 4.923 -1.0 4.923 1 1 194 1 . . . . . 3.182 -1.0 3.182 1 1 195 1 . . . . . 5.0 -1.0 5.0 1 1 196 1 . . . . . 5.0 -1.0 6.0 1 1 197 1 . . . . . 6.5 -1.0 8.5 1 1 198 1 . . . . . 4.0 -1.0 4.0 1 1 199 1 . . . . . 6.5 -1.0 8.9 1 1 200 1 . . . . . 6.5 -1.0 6.5 1 1 201 1 . . . . . 6.5 -1.0 6.5 1 1 202 1 . . . . . 3.561 -1.0 3.561 1 1 203 1 . . . . . 3.3 -1.0 4.3 1 1 204 1 . . . . . 4.0 -1.0 6.0 1 1 205 1 . . . . . 5.0 -1.0 5.0 1 1 206 1 . . . . . 6.5 -1.0 6.5 1 1 207 1 . . . . . 6.822 -1.0 6.822 1 1 208 1 . . . . . 6.5 -1.0 6.5 1 1 209 1 . . . . . 5.0 -1.0 6.0 1 1 210 1 . . . . . 5.0 -1.0 5.0 1 1 211 1 . . . . . 4.0 -1.0 4.0 1 1 212 1 . . . . . 3.3 -1.0 4.3 1 1 213 1 . . . . . 6.5 -1.0 6.5 1 1 214 1 . . . . . 4.0 -1.0 4.0 1 1 215 1 . . . . . 5.0 -1.0 6.0 1 1 216 1 . . . . . 7.118 -1.0 7.118 1 1 217 1 . . . . . 5.0 -1.0 7.0 1 1 218 1 . . . . . 5.0 -1.0 7.0 1 1 219 1 . . . . . 5.0 -1.0 7.0 1 1 220 1 . . . . . 6.5 -1.0 8.5 1 1 221 1 . . . . . 8.134 -1.0 8.134 1 1 222 1 . . . . . 6.5 -1.0 8.5 1 1 223 1 . . . . . 6.5 -1.0 8.5 1 1 224 1 . . . . . 5.0 -1.0 8.0 1 1 225 1 . . . . . 5.0 -1.0 7.0 1 1 226 1 . . . . . 7.737 -1.0 7.737 1 1 227 1 . . . . . 6.5 -1.0 10.9 1 1 228 1 . . . . . 5.0 -1.0 5.0 1 1 229 1 . . . . . 6.5 -1.0 6.5 1 1 230 1 . . . . . 6.5 -1.0 7.5 1 1 231 1 . . . . . 6.5 -1.0 8.9 1 1 232 1 . . . . . 6.5 -1.0 6.5 1 1 233 1 . . . . . 5.0 -1.0 5.0 1 1 234 1 . . . . . 4.0 -1.0 4.0 1 1 235 1 . . . . . 5.0 -1.0 5.0 1 1 236 1 . . . . . 6.5 -1.0 6.5 1 1 237 1 . . . . . 3.182 -1.0 3.182 1 1 238 1 . . . . . 5.0 -1.0 7.4 1 1 239 1 . . . . . 4.0 -1.0 4.0 1 1 240 1 . . . . . 6.5 -1.0 7.5 1 1 241 1 . . . . . 6.5 -1.0 6.5 1 1 242 1 . . . . . 6.822 -1.0 6.822 1 1 243 1 . . . . . 6.5 -1.0 8.9 1 1 244 1 . . . . . 6.822 -1.0 6.822 1 1 245 1 . . . . . 6.5 -1.0 8.9 1 1 246 1 . . . . . 6.822 -1.0 6.822 1 1 247 1 . . . . . 6.5 -1.0 9.9 1 1 248 1 . . . . . 5.0 -1.0 9.8 1 1 249 1 . . . . . 6.822 -1.0 6.822 1 1 250 1 . . . . . 6.5 -1.0 9.9 1 1 251 1 . . . . . 5.428 -1.0 8.828 1 1 252 1 . . . . . 4.923 -1.0 4.923 1 1 253 1 . . . . . 5.0 -1.0 5.0 1 1 254 1 . . . . . 6.5 -1.0 7.5 1 1 255 1 . . . . . 6.5 -1.0 8.9 1 1 256 1 . . . . . 5.0 -1.0 5.0 1 1 257 1 . . . . . 6.5 -1.0 7.5 1 1 258 1 . . . . . 5.0 -1.0 5.0 1 1 259 1 . . . . . 6.5 -1.0 6.5 1 1 260 1 . . . . . 4.0 -1.0 4.0 1 1 261 1 . . . . . 5.0 -1.0 6.0 1 1 262 1 . . . . . 6.5 -1.0 7.5 1 1 263 1 . . . . . 5.0 -1.0 6.0 1 1 264 1 . . . . . 4.443 -1.0 4.443 1 1 265 1 . . . . . 6.5 -1.0 7.5 1 1 266 1 . . . . . 6.5 -1.0 7.5 1 1 267 1 . . . . . 6.5 -1.0 7.5 1 1 268 1 . . . . . 3.182 -1.0 3.182 1 1 269 1 . . . . . 5.0 -1.0 5.0 1 1 270 1 . . . . . 4.0 -1.0 4.0 1 1 271 1 . . . . . 5.0 -1.0 5.0 1 1 272 1 . . . . . 4.442 -1.0 4.442 1 1 273 1 . . . . . 6.5 -1.0 8.9 1 1 274 1 . . . . . 5.0 -1.0 6.0 1 1 275 1 . . . . . 3.3 -1.0 3.3 1 1 276 1 . . . . . 5.0 -1.0 5.0 1 1 277 1 . . . . . 6.5 -1.0 8.9 1 1 278 1 . . . . . 6.5 -1.0 6.5 1 1 279 1 . . . . . 4.443 -1.0 4.443 1 1 280 1 . . . . . 3.561 -1.0 3.561 1 1 281 1 . . . . . 3.182 -1.0 3.182 1 1 282 1 . . . . . 3.3 -1.0 4.3 1 1 283 1 . . . . . 5.0 -1.0 7.0 1 1 284 1 . . . . . 6.5 -1.0 9.9 1 1 285 1 . . . . . 5.0 -1.0 6.0 1 1 286 1 . . . . . 5.0 -1.0 5.0 1 1 287 1 . . . . . 6.5 -1.0 8.9 1 1 288 1 . . . . . 6.5 -1.0 6.5 1 1 289 1 . . . . . 6.5 -1.0 6.5 1 1 290 1 . . . . . 6.5 -1.0 6.5 1 1 291 1 . . . . . 6.5 -1.0 7.0 1 1 292 1 . . . . . 4.0 -1.0 4.0 1 1 293 1 . . . . . 3.56 -1.0 3.56 1 1 294 1 . . . . . 6.5 -1.0 8.9 1 1 295 1 . . . . . 5.0 -1.0 5.0 1 1 296 1 . . . . . 6.5 -1.0 7.0 1 1 297 1 . . . . . 6.5 -1.0 8.9 1 1 298 1 . . . . . 6.5 -1.0 7.0 1 1 299 1 . . . . . 6.5 -1.0 8.9 1 1 300 1 . . . . . 5.0 -1.0 5.0 1 1 301 1 . . . . . 5.732 -1.0 5.732 1 1 302 1 . . . . . 5.0 -1.0 7.4 1 1 303 1 . . . . . 6.5 -1.0 7.0 1 1 304 1 . . . . . 3.56 -1.0 3.56 1 1 305 1 . . . . . 5.0 -1.0 5.0 1 1 306 1 . . . . . 3.3 -1.0 3.3 1 1 307 1 . . . . . 5.0 -1.0 6.0 1 1 308 1 . . . . . 5.0 -1.0 5.0 1 1 309 1 . . . . . 4.0 -1.0 6.4 1 1 310 1 . . . . . 6.5 -1.0 7.5 1 1 311 1 . . . . . 5.0 -1.0 5.0 1 1 312 1 . . . . . 5.0 -1.0 5.5 1 1 313 1 . . . . . 4.145 -1.0 4.145 1 1 314 1 . . . . . 4.0 -1.0 5.0 1 1 315 1 . . . . . 6.5 -1.0 8.5 1 1 316 1 . . . . . 5.269 -1.0 5.269 1 1 317 1 . . . . . 5.0 -1.0 6.0 1 1 318 1 . . . . . 6.5 -1.0 8.9 1 1 319 1 . . . . . 6.5 -1.0 8.9 1 1 320 1 . . . . . 6.5 -1.0 9.9 1 1 321 1 . . . . . 8.856 -1.0 8.856 1 1 322 1 . . . . . 6.5 -1.0 8.9 1 1 323 1 . . . . . 6.5 -1.0 8.9 1 1 324 1 . . . . . 5.0 -1.0 5.0 1 1 325 1 . . . . . 3.3 -1.0 4.3 1 1 326 1 . . . . . 3.558 -1.0 3.558 1 1 327 1 . . . . . 3.3 -1.0 3.3 1 1 328 1 . . . . . 6.5 -1.0 7.5 1 1 329 1 . . . . . 6.5 -1.0 7.0 1 1 330 1 . . . . . 3.558 -1.0 3.558 1 1 331 1 . . . . . 6.5 -1.0 6.5 1 1 332 1 . . . . . 4.0 -1.0 5.0 1 1 333 1 . . . . . 6.5 -1.0 7.5 1 1 334 1 . . . . . 6.5 -1.0 8.0 1 1 335 1 . . . . . 4.0 -1.0 5.0 1 1 336 1 . . . . . 6.5 -1.0 6.5 1 1 337 1 . . . . . 6.5 -1.0 7.0 1 1 stop_ save_ save_Discover_dihedral_5 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 3 GLY C 1 1 4 THR N 1 1 4 THR CA 1 1 4 THR C -179.0 -1.0 1 3 GLY C 1 4 THR N 1 4 THR CA 1 4 THR C 1 1 2 . 1 1 5 THR C 1 1 6 SER N 1 1 6 SER CA 1 1 6 SER C -89.99999 -40.0 1 5 THR C 1 6 SER N 1 6 SER CA 1 6 SER C 1 1 3 . 1 1 6 SER C 1 1 7 GLU N 1 1 7 GLU CA 1 1 7 GLU C -89.99999 -40.0 1 6 SER C 1 7 GLU N 1 7 GLU CA 1 7 GLU C 1 1 4 . 1 1 7 GLU C 1 1 8 TYR N 1 1 8 TYR CA 1 1 8 TYR C -179.0 -1.0 1 7 GLU C 1 8 TYR N 1 8 TYR CA 1 8 TYR C 1 1 5 . 1 1 8 TYR C 1 1 9 SER N 1 1 9 SER CA 1 1 9 SER C -89.99999 -40.0 1 8 TYR C 1 9 SER N 1 9 SER CA 1 9 SER C 1 1 6 . 1 1 9 SER C 1 1 10 LYS N 1 1 10 LYS CA 1 1 10 LYS C -89.99999 -40.0 1 9 SER C 1 10 LYS N 1 10 LYS CA 1 10 LYS C 1 1 7 . 1 1 13 ASP C 1 1 14 SER N 1 1 14 SER CA 1 1 14 SER C -150.0 -89.99999 1 13 ASP C 1 14 SER N 1 14 SER CA 1 14 SER C 1 1 8 . 1 1 14 SER C 1 1 15 ARG N 1 1 15 ARG CA 1 1 15 ARG C -179.0 -1.0 1 14 SER C 1 15 ARG N 1 15 ARG CA 1 15 ARG C 1 1 9 . 1 1 15 ARG C 1 1 16 ARG N 1 1 16 ARG CA 1 1 16 ARG C -89.99999 -40.0 1 15 ARG C 1 16 ARG N 1 16 ARG CA 1 16 ARG C 1 1 10 . 1 1 17 ALA C 1 1 18 GLN N 1 1 18 GLN CA 1 1 18 GLN C -89.99999 -40.0 1 17 ALA C 1 18 GLN N 1 18 GLN CA 1 18 GLN C 1 1 11 . 1 1 21 VAL C 1 1 22 GLN N 1 1 22 GLN CA 1 1 22 GLN C -89.99999 -40.0 1 21 VAL C 1 22 GLN N 1 22 GLN CA 1 22 GLN C 1 1 12 . 1 1 1 SER O 1 1 1 SER C 1 1 2 GLN N 1 1 2 GLN CA -5.0 5.0 1 1 SERN O 1 1 SERN C 1 2 GLN N 1 2 GLN CA 1 1 13 . 1 1 2 GLN O 1 1 2 GLN C 1 1 3 GLY N 1 1 3 GLY CA -5.0 5.0 1 2 GLN O 1 2 GLN C 1 3 GLY N 1 3 GLY CA 1 1 14 . 1 1 3 GLY O 1 1 3 GLY C 1 1 4 THR N 1 1 4 THR CA -5.0 5.0 1 3 GLY O 1 3 GLY C 1 4 THR N 1 4 THR CA 1 1 15 . 1 1 4 THR O 1 1 4 THR C 1 1 5 THR N 1 1 5 THR CA -5.0 5.0 1 4 THR O 1 4 THR C 1 5 THR N 1 5 THR CA 1 1 16 . 1 1 5 THR O 1 1 5 THR C 1 1 6 SER N 1 1 6 SER CA -5.0 5.0 1 5 THR O 1 5 THR C 1 6 SER N 1 6 SER CA 1 1 17 . 1 1 6 SER O 1 1 6 SER C 1 1 7 GLU N 1 1 7 GLU CA -5.0 5.0 1 6 SER O 1 6 SER C 1 7 GLU N 1 7 GLU CA 1 1 18 . 1 1 7 GLU O 1 1 7 GLU C 1 1 8 TYR N 1 1 8 TYR CA -5.0 5.0 1 7 GLU O 1 7 GLU C 1 8 TYR N 1 8 TYR CA 1 1 19 . 1 1 8 TYR O 1 1 8 TYR C 1 1 9 SER N 1 1 9 SER CA -5.0 5.0 1 8 TYR O 1 8 TYR C 1 9 SER N 1 9 SER CA 1 1 20 . 1 1 9 SER O 1 1 9 SER C 1 1 10 LYS N 1 1 10 LYS CA -5.0 5.0 1 9 SER O 1 9 SER C 1 10 LYS N 1 10 LYS CA 1 1 21 . 1 1 10 LYS O 1 1 10 LYS C 1 1 11 TYR N 1 1 11 TYR CA -5.0 5.0 1 10 LYS O 1 10 LYS C 1 11 TYR N 1 11 TYR CA 1 1 22 . 1 1 11 TYR O 1 1 11 TYR C 1 1 12 LEU N 1 1 12 LEU CA -5.0 5.0 1 11 TYR O 1 11 TYR C 1 12 LEU N 1 12 LEU CA 1 1 23 . 1 1 12 LEU O 1 1 12 LEU C 1 1 13 ASP N 1 1 13 ASP CA -5.0 5.0 1 12 LEU O 1 12 LEU C 1 13 ASP N 1 13 ASP CA 1 1 24 . 1 1 13 ASP O 1 1 13 ASP C 1 1 14 SER N 1 1 14 SER CA -5.0 5.0 1 13 ASP O 1 13 ASP C 1 14 SER N 1 14 SER CA 1 1 25 . 1 1 14 SER O 1 1 14 SER C 1 1 15 ARG N 1 1 15 ARG CA -5.0 5.0 1 14 SER O 1 14 SER C 1 15 ARG N 1 15 ARG CA 1 1 26 . 1 1 15 ARG O 1 1 15 ARG C 1 1 16 ARG N 1 1 16 ARG CA -5.0 5.0 1 15 ARG O 1 15 ARG C 1 16 ARG N 1 16 ARG CA 1 1 27 . 1 1 16 ARG O 1 1 16 ARG C 1 1 17 ALA N 1 1 17 ALA CA -5.0 5.0 1 16 ARG O 1 16 ARG C 1 17 ALA N 1 17 ALA CA 1 1 28 . 1 1 17 ALA O 1 1 17 ALA C 1 1 18 GLN N 1 1 18 GLN CA -5.0 5.0 1 17 ALA O 1 17 ALA C 1 18 GLN N 1 18 GLN CA 1 1 29 . 1 1 18 GLN O 1 1 18 GLN C 1 1 19 ASP N 1 1 19 ASP CA -5.0 5.0 1 18 GLN O 1 18 GLN C 1 19 ASP N 1 19 ASP CA 1 1 30 . 1 1 19 ASP O 1 1 19 ASP C 1 1 20 PHE N 1 1 20 PHE CA -5.0 5.0 1 19 ASP O 1 19 ASP C 1 20 PHE N 1 20 PHE CA 1 1 31 . 1 1 20 PHE O 1 1 20 PHE C 1 1 21 VAL N 1 1 21 VAL CA -5.0 5.0 1 20 PHE O 1 20 PHE C 1 21 VAL N 1 21 VAL CA 1 1 32 . 1 1 21 VAL O 1 1 21 VAL C 1 1 22 GLN N 1 1 22 GLN CA -5.0 5.0 1 21 VAL O 1 21 VAL C 1 22 GLN N 1 22 GLN CA 1 1 33 . 1 1 22 GLN O 1 1 22 GLN C 1 1 23 TRP N 1 1 23 TRP CA -5.0 5.0 1 22 GLN O 1 22 GLN C 1 23 TRP N 1 23 TRP CA 1 1 34 . 1 1 23 TRP O 1 1 23 TRP C 1 1 24 LEU N 1 1 24 LEU CA -5.0 5.0 1 23 TRP O 1 23 TRP C 1 24 LEU N 1 24 LEU CA 1 1 35 . 1 1 24 LEU O 1 1 24 LEU C 1 1 25 MET N 1 1 25 MET CA -5.0 5.0 1 24 LEU O 1 24 LEU C 1 25 MET N 1 25 MET CA 1 1 36 . 1 1 25 MET O 1 1 25 MET C 1 1 26 ASN N 1 1 26 ASN CA -5.0 5.0 1 25 MET O 1 25 MET C 1 26 ASN N 1 26 ASN CA 1 1 37 . 1 1 26 ASN O 1 1 26 ASN C 1 1 27 THR N 1 1 27 THR CA -5.0 5.0 1 26 ASN O 1 26 ASN C 1 27 THR N 1 27 THR CA 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 SER C C -3.700 -5.535 4.291 1.00 . A A . 1 SER C 1 1 1 2 1 1 1 SER CA C -2.755 -6.406 5.121 1.00 . A A . 1 SER CA 1 1 1 3 1 1 1 SER CB C -2.429 -5.736 6.460 1.00 . A A . 1 SER CB 1 1 1 4 1 1 1 SER H1 H -0.945 -7.346 4.945 1.00 . A A . 1 SER H1 1 1 1 5 1 1 1 SER H2 H -1.763 -7.206 3.519 1.00 . A A . 1 SER H2 1 1 1 6 1 1 1 SER H3 H -1.019 -5.890 4.176 1.00 . A A . 1 SER H3 1 1 1 7 1 1 1 SER HA H -3.259 -7.350 5.335 1.00 . A A . 1 SER HA 1 1 1 8 1 1 1 SER HB2 H -3.352 -5.533 7.004 1.00 . A A . 1 SER HB2 1 1 1 9 1 1 1 SER HB3 H -1.807 -6.402 7.059 1.00 . A A . 1 SER HB3 1 1 1 10 1 1 1 SER HG H -2.298 -3.928 5.752 1.00 . A A . 1 SER HG 1 1 1 11 1 1 1 SER N N -1.524 -6.739 4.382 1.00 . A A . 1 SER N 1 1 1 12 1 1 1 SER O O -3.249 -4.718 3.488 1.00 . A A . 1 SER O 1 1 1 13 1 1 1 SER OG O -1.735 -4.523 6.256 1.00 . A A . 1 SER OG 1 1 1 14 1 1 2 GLN C C -6.193 -3.568 4.377 1.00 . A A . 2 GLN C 1 1 1 15 1 1 2 GLN CA C -6.054 -4.974 3.793 1.00 . A A . 2 GLN CA 1 1 1 16 1 1 2 GLN CB C -7.384 -5.734 3.880 1.00 . A A . 2 GLN CB 1 1 1 17 1 1 2 GLN CD C -8.637 -7.842 3.188 1.00 . A A . 2 GLN CD 1 1 1 18 1 1 2 GLN CG C -7.308 -7.087 3.157 1.00 . A A . 2 GLN CG 1 1 1 19 1 1 2 GLN H H -5.308 -6.401 5.171 1.00 . A A . 2 GLN H 1 1 1 20 1 1 2 GLN HA H -5.785 -4.884 2.739 1.00 . A A . 2 GLN HA 1 1 1 21 1 1 2 GLN HB2 H -7.648 -5.895 4.926 1.00 . A A . 2 GLN HB2 1 1 1 22 1 1 2 GLN HB3 H -8.161 -5.129 3.410 1.00 . A A . 2 GLN HB3 1 1 1 23 1 1 2 GLN HE21 H -7.872 -9.328 2.021 1.00 . A A . 2 GLN HE21 1 1 1 24 1 1 2 GLN HE22 H -9.542 -9.529 2.509 1.00 . A A . 2 GLN HE22 1 1 1 25 1 1 2 GLN HG2 H -7.029 -6.917 2.117 1.00 . A A . 2 GLN HG2 1 1 1 26 1 1 2 GLN HG3 H -6.549 -7.712 3.627 1.00 . A A . 2 GLN HG3 1 1 1 27 1 1 2 GLN N N -5.012 -5.714 4.494 1.00 . A A . 2 GLN N 1 1 1 28 1 1 2 GLN NE2 N -8.686 -8.994 2.517 1.00 . A A . 2 GLN NE2 1 1 1 29 1 1 2 GLN O O -6.129 -2.587 3.640 1.00 . A A . 2 GLN O 1 1 1 30 1 1 2 GLN OE1 O -9.604 -7.401 3.804 1.00 . A A . 2 GLN OE1 1 1 1 31 1 1 3 GLY C C -7.908 -1.615 6.276 1.00 . A A . 3 GLY C 1 1 1 32 1 1 3 GLY CA C -6.514 -2.222 6.419 1.00 . A A . 3 GLY CA 1 1 1 33 1 1 3 GLY H H -6.434 -4.332 6.237 1.00 . A A . 3 GLY H 1 1 1 34 1 1 3 GLY HA2 H -6.320 -2.406 7.476 1.00 . A A . 3 GLY HA2 1 1 1 35 1 1 3 GLY HA3 H -5.777 -1.509 6.054 1.00 . A A . 3 GLY HA3 1 1 1 36 1 1 3 GLY N N -6.382 -3.480 5.700 1.00 . A A . 3 GLY N 1 1 1 37 1 1 3 GLY O O -8.836 -2.263 5.795 1.00 . A A . 3 GLY O 1 1 1 38 1 1 4 THR C C -9.021 1.834 6.259 1.00 . A A . 4 THR C 1 1 1 39 1 1 4 THR CA C -9.281 0.400 6.737 1.00 . A A . 4 THR CA 1 1 1 40 1 1 4 THR CB C -9.887 0.375 8.152 1.00 . A A . 4 THR CB 1 1 1 41 1 1 4 THR CG2 C -10.431 -1.012 8.509 1.00 . A A . 4 THR CG2 1 1 1 42 1 1 4 THR H H -7.218 0.099 7.083 1.00 . A A . 4 THR H 1 1 1 43 1 1 4 THR HA H -10.007 -0.050 6.058 1.00 . A A . 4 THR HA 1 1 1 44 1 1 4 THR HB H -10.718 1.081 8.186 1.00 . A A . 4 THR HB 1 1 1 45 1 1 4 THR HG1 H -8.229 0.101 9.137 1.00 . A A . 4 THR HG1 1 1 1 46 1 1 4 THR HG21 H -10.917 -0.969 9.485 1.00 . A A . 4 THR HG21 1 1 1 47 1 1 4 THR HG22 H -11.163 -1.328 7.765 1.00 . A A . 4 THR HG22 1 1 1 48 1 1 4 THR HG23 H -9.624 -1.743 8.553 1.00 . A A . 4 THR HG23 1 1 1 49 1 1 4 THR N N -8.037 -0.357 6.713 1.00 . A A . 4 THR N 1 1 1 50 1 1 4 THR O O -8.495 2.654 7.008 1.00 . A A . 4 THR O 1 1 1 51 1 1 4 THR OG1 O -8.933 0.754 9.124 1.00 . A A . 4 THR OG1 1 1 1 52 1 1 5 THR C C -8.050 4.189 4.637 1.00 . A A . 5 THR C 1 1 1 53 1 1 5 THR CA C -9.354 3.427 4.355 1.00 . A A . 5 THR CA 1 1 1 54 1 1 5 THR CB C -10.672 4.203 4.580 1.00 . A A . 5 THR CB 1 1 1 55 1 1 5 THR CG2 C -11.166 4.246 6.034 1.00 . A A . 5 THR CG2 1 1 1 56 1 1 5 THR H H -9.819 1.374 4.469 1.00 . A A . 5 THR H 1 1 1 57 1 1 5 THR HA H -9.310 3.219 3.287 1.00 . A A . 5 THR HA 1 1 1 58 1 1 5 THR HB H -11.449 3.696 4.007 1.00 . A A . 5 THR HB 1 1 1 59 1 1 5 THR HG1 H -10.386 5.473 3.132 1.00 . A A . 5 THR HG1 1 1 1 60 1 1 5 THR HG21 H -12.049 4.884 6.090 1.00 . A A . 5 THR HG21 1 1 1 61 1 1 5 THR HG22 H -11.451 3.247 6.364 1.00 . A A . 5 THR HG22 1 1 1 62 1 1 5 THR HG23 H -10.410 4.640 6.711 1.00 . A A . 5 THR HG23 1 1 1 63 1 1 5 THR N N -9.412 2.122 5.010 1.00 . A A . 5 THR N 1 1 1 64 1 1 5 THR O O -7.002 3.795 4.129 1.00 . A A . 5 THR O 1 1 1 65 1 1 5 THR OG1 O -10.579 5.518 4.072 1.00 . A A . 5 THR OG1 1 1 1 66 1 1 6 SER C C -5.778 5.310 6.306 1.00 . A A . 6 SER C 1 1 1 67 1 1 6 SER CA C -6.978 6.115 5.795 1.00 . A A . 6 SER CA 1 1 1 68 1 1 6 SER CB C -7.438 7.137 6.842 1.00 . A A . 6 SER CB 1 1 1 69 1 1 6 SER H H -9.016 5.559 5.757 1.00 . A A . 6 SER H 1 1 1 70 1 1 6 SER HA H -6.673 6.665 4.905 1.00 . A A . 6 SER HA 1 1 1 71 1 1 6 SER HB2 H -8.291 7.697 6.457 1.00 . A A . 6 SER HB2 1 1 1 72 1 1 6 SER HB3 H -7.735 6.623 7.757 1.00 . A A . 6 SER HB3 1 1 1 73 1 1 6 SER HG H -6.141 8.496 6.331 1.00 . A A . 6 SER HG 1 1 1 74 1 1 6 SER N N -8.108 5.269 5.429 1.00 . A A . 6 SER N 1 1 1 75 1 1 6 SER O O -4.637 5.687 6.049 1.00 . A A . 6 SER O 1 1 1 76 1 1 6 SER OG O -6.399 8.045 7.139 1.00 . A A . 6 SER OG 1 1 1 77 1 1 7 GLU C C -4.174 2.757 6.345 1.00 . A A . 7 GLU C 1 1 1 78 1 1 7 GLU CA C -4.981 3.329 7.517 1.00 . A A . 7 GLU CA 1 1 1 79 1 1 7 GLU CB C -5.616 2.247 8.405 1.00 . A A . 7 GLU CB 1 1 1 80 1 1 7 GLU CD C -3.641 0.635 8.497 1.00 . A A . 7 GLU CD 1 1 1 81 1 1 7 GLU CG C -4.612 1.502 9.292 1.00 . A A . 7 GLU CG 1 1 1 82 1 1 7 GLU H H -6.988 3.932 7.183 1.00 . A A . 7 GLU H 1 1 1 83 1 1 7 GLU HA H -4.317 3.928 8.143 1.00 . A A . 7 GLU HA 1 1 1 84 1 1 7 GLU HB2 H -6.332 2.730 9.073 1.00 . A A . 7 GLU HB2 1 1 1 85 1 1 7 GLU HB3 H -6.158 1.536 7.787 1.00 . A A . 7 GLU HB3 1 1 1 86 1 1 7 GLU HG2 H -4.058 2.225 9.892 1.00 . A A . 7 GLU HG2 1 1 1 87 1 1 7 GLU HG3 H -5.168 0.852 9.969 1.00 . A A . 7 GLU HG3 1 1 1 88 1 1 7 GLU N N -6.028 4.204 7.016 1.00 . A A . 7 GLU N 1 1 1 89 1 1 7 GLU O O -2.952 2.898 6.322 1.00 . A A . 7 GLU O 1 1 1 90 1 1 7 GLU OE1 O -4.132 -0.267 7.783 1.00 . A A . 7 GLU OE1 1 1 1 91 1 1 7 GLU OE2 O -2.423 0.890 8.619 1.00 . A A . 7 GLU OE2 1 1 1 92 1 1 8 TYR C C -3.622 2.638 3.261 1.00 . A A . 8 TYR C 1 1 1 93 1 1 8 TYR CA C -4.162 1.569 4.205 1.00 . A A . 8 TYR CA 1 1 1 94 1 1 8 TYR CB C -5.018 0.532 3.465 1.00 . A A . 8 TYR CB 1 1 1 95 1 1 8 TYR CD1 C -6.130 1.779 1.545 1.00 . A A . 8 TYR CD1 1 1 1 96 1 1 8 TYR CD2 C -7.508 0.471 3.058 1.00 . A A . 8 TYR CD2 1 1 1 97 1 1 8 TYR CE1 C -7.267 2.092 0.781 1.00 . A A . 8 TYR CE1 1 1 1 98 1 1 8 TYR CE2 C -8.633 0.727 2.256 1.00 . A A . 8 TYR CE2 1 1 1 99 1 1 8 TYR CG C -6.254 1.016 2.724 1.00 . A A . 8 TYR CG 1 1 1 100 1 1 8 TYR CZ C -8.518 1.561 1.132 1.00 . A A . 8 TYR CZ 1 1 1 101 1 1 8 TYR H H -5.853 2.075 5.405 1.00 . A A . 8 TYR H 1 1 1 102 1 1 8 TYR HA H -3.296 1.031 4.581 1.00 . A A . 8 TYR HA 1 1 1 103 1 1 8 TYR HB2 H -4.387 0.046 2.722 1.00 . A A . 8 TYR HB2 1 1 1 104 1 1 8 TYR HB3 H -5.303 -0.223 4.194 1.00 . A A . 8 TYR HB3 1 1 1 105 1 1 8 TYR HD1 H -5.164 2.117 1.200 1.00 . A A . 8 TYR HD1 1 1 1 106 1 1 8 TYR HD2 H -7.606 -0.167 3.920 1.00 . A A . 8 TYR HD2 1 1 1 107 1 1 8 TYR HE1 H -7.175 2.723 -0.091 1.00 . A A . 8 TYR HE1 1 1 1 108 1 1 8 TYR HE2 H -9.585 0.285 2.511 1.00 . A A . 8 TYR HE2 1 1 1 109 1 1 8 TYR HH H -10.418 1.425 0.691 1.00 . A A . 8 TYR HH 1 1 1 110 1 1 8 TYR N N -4.845 2.131 5.366 1.00 . A A . 8 TYR N 1 1 1 111 1 1 8 TYR O O -2.654 2.371 2.551 1.00 . A A . 8 TYR O 1 1 1 112 1 1 8 TYR OH O -9.618 1.856 0.381 1.00 . A A . 8 TYR OH 1 1 1 113 1 1 9 SER C C -2.343 5.229 2.492 1.00 . A A . 9 SER C 1 1 1 114 1 1 9 SER CA C -3.846 4.942 2.391 1.00 . A A . 9 SER CA 1 1 1 115 1 1 9 SER CB C -4.684 6.179 2.726 1.00 . A A . 9 SER CB 1 1 1 116 1 1 9 SER H H -5.049 3.958 3.838 1.00 . A A . 9 SER H 1 1 1 117 1 1 9 SER HA H -4.094 4.668 1.368 1.00 . A A . 9 SER HA 1 1 1 118 1 1 9 SER HB2 H -5.744 5.922 2.699 1.00 . A A . 9 SER HB2 1 1 1 119 1 1 9 SER HB3 H -4.428 6.551 3.715 1.00 . A A . 9 SER HB3 1 1 1 120 1 1 9 SER HG H -4.651 6.874 0.908 1.00 . A A . 9 SER HG 1 1 1 121 1 1 9 SER N N -4.238 3.829 3.247 1.00 . A A . 9 SER N 1 1 1 122 1 1 9 SER O O -1.718 5.606 1.503 1.00 . A A . 9 SER O 1 1 1 123 1 1 9 SER OG O -4.447 7.205 1.787 1.00 . A A . 9 SER OG 1 1 1 124 1 1 10 LYS C C 0.490 4.244 3.109 1.00 . A A . 10 LYS C 1 1 1 125 1 1 10 LYS CA C -0.346 5.218 3.938 1.00 . A A . 10 LYS CA 1 1 1 126 1 1 10 LYS CB C -0.076 5.062 5.437 1.00 . A A . 10 LYS CB 1 1 1 127 1 1 10 LYS CD C -0.900 7.441 6.066 1.00 . A A . 10 LYS CD 1 1 1 128 1 1 10 LYS CE C -1.888 7.955 5.005 1.00 . A A . 10 LYS CE 1 1 1 129 1 1 10 LYS CG C -0.976 5.928 6.334 1.00 . A A . 10 LYS CG 1 1 1 130 1 1 10 LYS H H -2.320 4.695 4.452 1.00 . A A . 10 LYS H 1 1 1 131 1 1 10 LYS HA H -0.048 6.222 3.639 1.00 . A A . 10 LYS HA 1 1 1 132 1 1 10 LYS HB2 H -0.219 4.016 5.716 1.00 . A A . 10 LYS HB2 1 1 1 133 1 1 10 LYS HB3 H 0.961 5.328 5.629 1.00 . A A . 10 LYS HB3 1 1 1 134 1 1 10 LYS HD2 H -1.154 7.936 7.004 1.00 . A A . 10 LYS HD2 1 1 1 135 1 1 10 LYS HD3 H 0.120 7.720 5.798 1.00 . A A . 10 LYS HD3 1 1 1 136 1 1 10 LYS HE2 H -1.592 7.666 3.998 1.00 . A A . 10 LYS HE2 1 1 1 137 1 1 10 LYS HE3 H -2.882 7.556 5.202 1.00 . A A . 10 LYS HE3 1 1 1 138 1 1 10 LYS HG2 H -2.011 5.594 6.284 1.00 . A A . 10 LYS HG2 1 1 1 139 1 1 10 LYS HG3 H -0.635 5.761 7.357 1.00 . A A . 10 LYS HG3 1 1 1 140 1 1 10 LYS HZ1 H -2.629 9.733 4.324 1.00 . A A . 10 LYS HZ1 1 1 1 141 1 1 10 LYS HZ2 H -2.278 9.734 5.935 1.00 . A A . 10 LYS HZ2 1 1 1 142 1 1 10 LYS HZ3 H -1.061 9.816 4.825 1.00 . A A . 10 LYS HZ3 1 1 1 143 1 1 10 LYS N N -1.761 5.029 3.681 1.00 . A A . 10 LYS N 1 1 1 144 1 1 10 LYS NZ N -1.970 9.424 5.024 1.00 . A A . 10 LYS NZ 1 1 1 145 1 1 10 LYS O O 1.408 4.678 2.416 1.00 . A A . 10 LYS O 1 1 1 146 1 1 11 TYR C C 0.251 1.723 1.002 1.00 . A A . 11 TYR C 1 1 1 147 1 1 11 TYR CA C 0.855 1.913 2.392 1.00 . A A . 11 TYR CA 1 1 1 148 1 1 11 TYR CB C 0.958 0.631 3.216 1.00 . A A . 11 TYR CB 1 1 1 149 1 1 11 TYR CD1 C -1.190 -0.703 2.944 1.00 . A A . 11 TYR CD1 1 1 1 150 1 1 11 TYR CD2 C -0.527 0.033 5.165 1.00 . A A . 11 TYR CD2 1 1 1 151 1 1 11 TYR CE1 C -2.233 -1.458 3.507 1.00 . A A . 11 TYR CE1 1 1 1 152 1 1 11 TYR CE2 C -1.543 -0.754 5.729 1.00 . A A . 11 TYR CE2 1 1 1 153 1 1 11 TYR CG C -0.327 0.043 3.772 1.00 . A A . 11 TYR CG 1 1 1 154 1 1 11 TYR CZ C -2.390 -1.509 4.901 1.00 . A A . 11 TYR CZ 1 1 1 155 1 1 11 TYR H H -0.680 2.661 3.627 1.00 . A A . 11 TYR H 1 1 1 156 1 1 11 TYR HA H 1.878 2.229 2.209 1.00 . A A . 11 TYR HA 1 1 1 157 1 1 11 TYR HB2 H 1.451 -0.116 2.602 1.00 . A A . 11 TYR HB2 1 1 1 158 1 1 11 TYR HB3 H 1.616 0.858 4.055 1.00 . A A . 11 TYR HB3 1 1 1 159 1 1 11 TYR HD1 H -1.044 -0.728 1.876 1.00 . A A . 11 TYR HD1 1 1 1 160 1 1 11 TYR HD2 H 0.123 0.601 5.815 1.00 . A A . 11 TYR HD2 1 1 1 161 1 1 11 TYR HE1 H -2.913 -1.999 2.865 1.00 . A A . 11 TYR HE1 1 1 1 162 1 1 11 TYR HE2 H -1.663 -0.783 6.800 1.00 . A A . 11 TYR HE2 1 1 1 163 1 1 11 TYR HH H -3.436 -2.178 6.404 1.00 . A A . 11 TYR HH 1 1 1 164 1 1 11 TYR N N 0.162 2.945 3.151 1.00 . A A . 11 TYR N 1 1 1 165 1 1 11 TYR O O 0.419 0.680 0.373 1.00 . A A . 11 TYR O 1 1 1 166 1 1 11 TYR OH O -3.362 -2.290 5.453 1.00 . A A . 11 TYR OH 1 1 1 167 1 1 12 LEU C C -0.276 4.202 -1.448 1.00 . A A . 12 LEU C 1 1 1 168 1 1 12 LEU CA C -0.904 2.937 -0.833 1.00 . A A . 12 LEU CA 1 1 1 169 1 1 12 LEU CB C -2.435 2.972 -0.736 1.00 . A A . 12 LEU CB 1 1 1 170 1 1 12 LEU CD1 C -2.908 2.478 -3.184 1.00 . A A . 12 LEU CD1 1 1 1 171 1 1 12 LEU CD2 C -4.694 3.408 -1.716 1.00 . A A . 12 LEU CD2 1 1 1 172 1 1 12 LEU CG C -3.188 3.410 -1.998 1.00 . A A . 12 LEU CG 1 1 1 173 1 1 12 LEU H H -0.549 3.571 1.117 1.00 . A A . 12 LEU H 1 1 1 174 1 1 12 LEU HA H -0.607 2.076 -1.426 1.00 . A A . 12 LEU HA 1 1 1 175 1 1 12 LEU HB2 H -2.775 1.980 -0.432 1.00 . A A . 12 LEU HB2 1 1 1 176 1 1 12 LEU HB3 H -2.690 3.669 0.054 1.00 . A A . 12 LEU HB3 1 1 1 177 1 1 12 LEU HD11 H -1.850 2.479 -3.441 1.00 . A A . 12 LEU HD11 1 1 1 178 1 1 12 LEU HD12 H -3.209 1.460 -2.935 1.00 . A A . 12 LEU HD12 1 1 1 179 1 1 12 LEU HD13 H -3.474 2.813 -4.054 1.00 . A A . 12 LEU HD13 1 1 1 180 1 1 12 LEU HD21 H -5.236 3.751 -2.597 1.00 . A A . 12 LEU HD21 1 1 1 181 1 1 12 LEU HD22 H -5.025 2.400 -1.465 1.00 . A A . 12 LEU HD22 1 1 1 182 1 1 12 LEU HD23 H -4.918 4.077 -0.885 1.00 . A A . 12 LEU HD23 1 1 1 183 1 1 12 LEU HG H -2.902 4.437 -2.234 1.00 . A A . 12 LEU HG 1 1 1 184 1 1 12 LEU N N -0.400 2.779 0.512 1.00 . A A . 12 LEU N 1 1 1 185 1 1 12 LEU O O -0.346 4.396 -2.659 1.00 . A A . 12 LEU O 1 1 1 186 1 1 13 ASP C C 2.393 6.038 -1.578 1.00 . A A . 13 ASP C 1 1 1 187 1 1 13 ASP CA C 0.983 6.298 -1.030 1.00 . A A . 13 ASP CA 1 1 1 188 1 1 13 ASP CB C 0.912 7.276 0.155 1.00 . A A . 13 ASP CB 1 1 1 189 1 1 13 ASP CG C 1.384 8.683 -0.209 1.00 . A A . 13 ASP CG 1 1 1 190 1 1 13 ASP H H 0.397 4.850 0.366 1.00 . A A . 13 ASP H 1 1 1 191 1 1 13 ASP HA H 0.408 6.739 -1.842 1.00 . A A . 13 ASP HA 1 1 1 192 1 1 13 ASP HB2 H -0.127 7.348 0.479 1.00 . A A . 13 ASP HB2 1 1 1 193 1 1 13 ASP HB3 H 1.489 6.885 0.994 1.00 . A A . 13 ASP HB3 1 1 1 194 1 1 13 ASP N N 0.356 5.053 -0.622 1.00 . A A . 13 ASP N 1 1 1 195 1 1 13 ASP O O 2.531 5.411 -2.626 1.00 . A A . 13 ASP O 1 1 1 196 1 1 13 ASP OD1 O 0.658 9.347 -0.980 1.00 . A A . 13 ASP OD1 1 1 1 197 1 1 13 ASP OD2 O 2.464 9.069 0.290 1.00 . A A . 13 ASP OD2 1 1 1 198 1 1 14 SER C C 5.605 5.380 -0.800 1.00 . A A . 14 SER C 1 1 1 199 1 1 14 SER CA C 4.807 6.552 -1.385 1.00 . A A . 14 SER CA 1 1 1 200 1 1 14 SER CB C 5.428 7.930 -1.108 1.00 . A A . 14 SER CB 1 1 1 201 1 1 14 SER H H 3.233 7.068 -0.062 1.00 . A A . 14 SER H 1 1 1 202 1 1 14 SER HA H 4.814 6.428 -2.469 1.00 . A A . 14 SER HA 1 1 1 203 1 1 14 SER HB2 H 5.449 8.136 -0.037 1.00 . A A . 14 SER HB2 1 1 1 204 1 1 14 SER HB3 H 6.443 7.966 -1.506 1.00 . A A . 14 SER HB3 1 1 1 205 1 1 14 SER HG H 3.796 8.970 -1.330 1.00 . A A . 14 SER HG 1 1 1 206 1 1 14 SER N N 3.430 6.556 -0.908 1.00 . A A . 14 SER N 1 1 1 207 1 1 14 SER O O 5.315 4.233 -1.133 1.00 . A A . 14 SER O 1 1 1 208 1 1 14 SER OG O 4.667 8.942 -1.735 1.00 . A A . 14 SER OG 1 1 1 209 1 1 15 ARG C C 6.945 3.414 1.055 1.00 . A A . 15 ARG C 1 1 1 210 1 1 15 ARG CA C 7.585 4.718 0.584 1.00 . A A . 15 ARG CA 1 1 1 211 1 1 15 ARG CB C 8.362 5.418 1.713 1.00 . A A . 15 ARG CB 1 1 1 212 1 1 15 ARG CD C 8.964 3.774 3.581 1.00 . A A . 15 ARG CD 1 1 1 213 1 1 15 ARG CG C 9.460 4.557 2.358 1.00 . A A . 15 ARG CG 1 1 1 214 1 1 15 ARG CZ C 9.896 2.063 5.135 1.00 . A A . 15 ARG CZ 1 1 1 215 1 1 15 ARG H H 6.774 6.632 0.275 1.00 . A A . 15 ARG H 1 1 1 216 1 1 15 ARG HA H 8.299 4.481 -0.205 1.00 . A A . 15 ARG HA 1 1 1 217 1 1 15 ARG HB2 H 8.848 6.292 1.275 1.00 . A A . 15 ARG HB2 1 1 1 218 1 1 15 ARG HB3 H 7.674 5.770 2.483 1.00 . A A . 15 ARG HB3 1 1 1 219 1 1 15 ARG HD2 H 8.552 4.467 4.315 1.00 . A A . 15 ARG HD2 1 1 1 220 1 1 15 ARG HD3 H 8.192 3.068 3.287 1.00 . A A . 15 ARG HD3 1 1 1 221 1 1 15 ARG HE H 10.994 3.237 3.899 1.00 . A A . 15 ARG HE 1 1 1 222 1 1 15 ARG HG2 H 9.883 3.875 1.619 1.00 . A A . 15 ARG HG2 1 1 1 223 1 1 15 ARG HG3 H 10.252 5.226 2.699 1.00 . A A . 15 ARG HG3 1 1 1 224 1 1 15 ARG HH11 H 7.857 2.202 5.231 1.00 . A A . 15 ARG HH11 1 1 1 225 1 1 15 ARG HH12 H 8.576 1.004 6.280 1.00 . A A . 15 ARG HH12 1 1 1 226 1 1 15 ARG HH21 H 11.894 1.668 5.286 1.00 . A A . 15 ARG HH21 1 1 1 227 1 1 15 ARG HH22 H 10.860 0.704 6.315 1.00 . A A . 15 ARG HH22 1 1 1 228 1 1 15 ARG N N 6.617 5.665 0.035 1.00 . A A . 15 ARG N 1 1 1 229 1 1 15 ARG NE N 10.056 3.021 4.206 1.00 . A A . 15 ARG NE 1 1 1 230 1 1 15 ARG NH1 N 8.676 1.730 5.585 1.00 . A A . 15 ARG NH1 1 1 1 231 1 1 15 ARG NH2 N 10.972 1.427 5.619 1.00 . A A . 15 ARG NH2 1 1 1 232 1 1 15 ARG O O 7.381 2.333 0.668 1.00 . A A . 15 ARG O 1 1 1 233 1 1 16 ARG C C 4.646 1.445 1.520 1.00 . A A . 16 ARG C 1 1 1 234 1 1 16 ARG CA C 5.282 2.379 2.546 1.00 . A A . 16 ARG CA 1 1 1 235 1 1 16 ARG CB C 4.227 2.898 3.514 1.00 . A A . 16 ARG CB 1 1 1 236 1 1 16 ARG CD C 3.867 4.803 5.101 1.00 . A A . 16 ARG CD 1 1 1 237 1 1 16 ARG CG C 4.854 3.728 4.638 1.00 . A A . 16 ARG CG 1 1 1 238 1 1 16 ARG CZ C 4.423 6.723 3.586 1.00 . A A . 16 ARG CZ 1 1 1 239 1 1 16 ARG H H 5.582 4.437 2.144 1.00 . A A . 16 ARG H 1 1 1 240 1 1 16 ARG HA H 6.028 1.820 3.113 1.00 . A A . 16 ARG HA 1 1 1 241 1 1 16 ARG HB2 H 3.544 3.508 2.931 1.00 . A A . 16 ARG HB2 1 1 1 242 1 1 16 ARG HB3 H 3.675 2.067 3.953 1.00 . A A . 16 ARG HB3 1 1 1 243 1 1 16 ARG HD2 H 2.937 4.308 5.384 1.00 . A A . 16 ARG HD2 1 1 1 244 1 1 16 ARG HD3 H 4.256 5.323 5.976 1.00 . A A . 16 ARG HD3 1 1 1 245 1 1 16 ARG HE H 2.705 5.652 3.539 1.00 . A A . 16 ARG HE 1 1 1 246 1 1 16 ARG HG2 H 5.103 3.054 5.457 1.00 . A A . 16 ARG HG2 1 1 1 247 1 1 16 ARG HG3 H 5.773 4.206 4.301 1.00 . A A . 16 ARG HG3 1 1 1 248 1 1 16 ARG HH11 H 5.893 6.370 4.963 1.00 . A A . 16 ARG HH11 1 1 1 249 1 1 16 ARG HH12 H 6.225 7.654 3.825 1.00 . A A . 16 ARG HH12 1 1 1 250 1 1 16 ARG HH21 H 3.175 7.334 2.089 1.00 . A A . 16 ARG HH21 1 1 1 251 1 1 16 ARG HH22 H 4.689 8.199 2.201 1.00 . A A . 16 ARG HH22 1 1 1 252 1 1 16 ARG N N 5.921 3.518 1.904 1.00 . A A . 16 ARG N 1 1 1 253 1 1 16 ARG NE N 3.585 5.768 4.026 1.00 . A A . 16 ARG NE 1 1 1 254 1 1 16 ARG NH1 N 5.611 6.932 4.173 1.00 . A A . 16 ARG NH1 1 1 1 255 1 1 16 ARG NH2 N 4.067 7.479 2.539 1.00 . A A . 16 ARG NH2 1 1 1 256 1 1 16 ARG O O 4.665 0.232 1.706 1.00 . A A . 16 ARG O 1 1 1 257 1 1 17 ALA C C 4.681 0.410 -1.332 1.00 . A A . 17 ALA C 1 1 1 258 1 1 17 ALA CA C 3.566 1.210 -0.658 1.00 . A A . 17 ALA CA 1 1 1 259 1 1 17 ALA CB C 2.829 2.104 -1.657 1.00 . A A . 17 ALA CB 1 1 1 260 1 1 17 ALA H H 4.119 3.008 0.323 1.00 . A A . 17 ALA H 1 1 1 261 1 1 17 ALA HA H 2.843 0.505 -0.253 1.00 . A A . 17 ALA HA 1 1 1 262 1 1 17 ALA HB1 H 3.525 2.762 -2.171 1.00 . A A . 17 ALA HB1 1 1 1 263 1 1 17 ALA HB2 H 2.321 1.483 -2.396 1.00 . A A . 17 ALA HB2 1 1 1 264 1 1 17 ALA HB3 H 2.092 2.707 -1.132 1.00 . A A . 17 ALA HB3 1 1 1 265 1 1 17 ALA N N 4.094 2.004 0.437 1.00 . A A . 17 ALA N 1 1 1 266 1 1 17 ALA O O 4.435 -0.705 -1.784 1.00 . A A . 17 ALA O 1 1 1 267 1 1 18 GLN C C 7.452 -0.927 -1.153 1.00 . A A . 18 GLN C 1 1 1 268 1 1 18 GLN CA C 7.033 0.274 -2.004 1.00 . A A . 18 GLN CA 1 1 1 269 1 1 18 GLN CB C 8.226 1.214 -2.240 1.00 . A A . 18 GLN CB 1 1 1 270 1 1 18 GLN CD C 6.878 2.485 -4.001 1.00 . A A . 18 GLN CD 1 1 1 271 1 1 18 GLN CG C 7.855 2.580 -2.832 1.00 . A A . 18 GLN CG 1 1 1 272 1 1 18 GLN H H 6.074 1.834 -0.900 1.00 . A A . 18 GLN H 1 1 1 273 1 1 18 GLN HA H 6.706 -0.091 -2.975 1.00 . A A . 18 GLN HA 1 1 1 274 1 1 18 GLN HB2 H 8.758 1.383 -1.304 1.00 . A A . 18 GLN HB2 1 1 1 275 1 1 18 GLN HB3 H 8.911 0.714 -2.926 1.00 . A A . 18 GLN HB3 1 1 1 276 1 1 18 GLN HE21 H 5.463 3.522 -2.966 1.00 . A A . 18 GLN HE21 1 1 1 277 1 1 18 GLN HE22 H 5.001 3.025 -4.582 1.00 . A A . 18 GLN HE22 1 1 1 278 1 1 18 GLN HG2 H 7.428 3.197 -2.046 1.00 . A A . 18 GLN HG2 1 1 1 279 1 1 18 GLN HG3 H 8.767 3.068 -3.178 1.00 . A A . 18 GLN HG3 1 1 1 280 1 1 18 GLN N N 5.904 0.958 -1.383 1.00 . A A . 18 GLN N 1 1 1 281 1 1 18 GLN NE2 N 5.684 3.061 -3.840 1.00 . A A . 18 GLN NE2 1 1 1 282 1 1 18 GLN O O 7.778 -1.990 -1.680 1.00 . A A . 18 GLN O 1 1 1 283 1 1 18 GLN OE1 O 7.195 1.902 -5.035 1.00 . A A . 18 GLN OE1 1 1 1 284 1 1 19 ASP C C 6.659 -2.871 1.071 1.00 . A A . 19 ASP C 1 1 1 285 1 1 19 ASP CA C 7.725 -1.780 1.145 1.00 . A A . 19 ASP CA 1 1 1 286 1 1 19 ASP CB C 7.808 -1.172 2.552 1.00 . A A . 19 ASP CB 1 1 1 287 1 1 19 ASP CG C 9.096 -0.374 2.749 1.00 . A A . 19 ASP CG 1 1 1 288 1 1 19 ASP H H 7.088 0.140 0.515 1.00 . A A . 19 ASP H 1 1 1 289 1 1 19 ASP HA H 8.691 -2.229 0.907 1.00 . A A . 19 ASP HA 1 1 1 290 1 1 19 ASP HB2 H 6.952 -0.523 2.734 1.00 . A A . 19 ASP HB2 1 1 1 291 1 1 19 ASP HB3 H 7.785 -1.977 3.287 1.00 . A A . 19 ASP HB3 1 1 1 292 1 1 19 ASP N N 7.425 -0.746 0.170 1.00 . A A . 19 ASP N 1 1 1 293 1 1 19 ASP O O 6.987 -4.054 1.095 1.00 . A A . 19 ASP O 1 1 1 294 1 1 19 ASP OD1 O 9.191 0.721 2.155 1.00 . A A . 19 ASP OD1 1 1 1 295 1 1 19 ASP OD2 O 9.968 -0.874 3.493 1.00 . A A . 19 ASP OD2 1 1 1 296 1 1 20 PHE C C 4.388 -4.231 -0.450 1.00 . A A . 20 PHE C 1 1 1 297 1 1 20 PHE CA C 4.277 -3.402 0.828 1.00 . A A . 20 PHE CA 1 1 1 298 1 1 20 PHE CB C 2.925 -2.682 0.927 1.00 . A A . 20 PHE CB 1 1 1 299 1 1 20 PHE CD1 C 3.013 -2.245 3.426 1.00 . A A . 20 PHE CD1 1 1 1 300 1 1 20 PHE CD2 C 1.050 -3.348 2.500 1.00 . A A . 20 PHE CD2 1 1 1 301 1 1 20 PHE CE1 C 2.458 -2.341 4.714 1.00 . A A . 20 PHE CE1 1 1 1 302 1 1 20 PHE CE2 C 0.501 -3.451 3.789 1.00 . A A . 20 PHE CE2 1 1 1 303 1 1 20 PHE CG C 2.306 -2.739 2.313 1.00 . A A . 20 PHE CG 1 1 1 304 1 1 20 PHE CZ C 1.203 -2.948 4.897 1.00 . A A . 20 PHE CZ 1 1 1 305 1 1 20 PHE H H 5.178 -1.483 0.972 1.00 . A A . 20 PHE H 1 1 1 306 1 1 20 PHE HA H 4.332 -4.107 1.659 1.00 . A A . 20 PHE HA 1 1 1 307 1 1 20 PHE HB2 H 3.028 -1.643 0.621 1.00 . A A . 20 PHE HB2 1 1 1 308 1 1 20 PHE HB3 H 2.233 -3.154 0.228 1.00 . A A . 20 PHE HB3 1 1 1 309 1 1 20 PHE HD1 H 3.984 -1.790 3.300 1.00 . A A . 20 PHE HD1 1 1 1 310 1 1 20 PHE HD2 H 0.499 -3.741 1.659 1.00 . A A . 20 PHE HD2 1 1 1 311 1 1 20 PHE HE1 H 2.998 -1.952 5.565 1.00 . A A . 20 PHE HE1 1 1 1 312 1 1 20 PHE HE2 H -0.467 -3.907 3.925 1.00 . A A . 20 PHE HE2 1 1 1 313 1 1 20 PHE HZ H 0.777 -3.024 5.887 1.00 . A A . 20 PHE HZ 1 1 1 314 1 1 20 PHE N N 5.385 -2.473 0.964 1.00 . A A . 20 PHE N 1 1 1 315 1 1 20 PHE O O 4.140 -5.433 -0.384 1.00 . A A . 20 PHE O 1 1 1 316 1 1 21 VAL C C 6.056 -5.416 -2.708 1.00 . A A . 21 VAL C 1 1 1 317 1 1 21 VAL CA C 4.853 -4.477 -2.805 1.00 . A A . 21 VAL CA 1 1 1 318 1 1 21 VAL CB C 4.794 -3.695 -4.129 1.00 . A A . 21 VAL CB 1 1 1 319 1 1 21 VAL CG1 C 3.446 -2.977 -4.276 1.00 . A A . 21 VAL CG1 1 1 1 320 1 1 21 VAL CG2 C 5.947 -2.710 -4.312 1.00 . A A . 21 VAL CG2 1 1 1 321 1 1 21 VAL H H 5.005 -2.658 -1.632 1.00 . A A . 21 VAL H 1 1 1 322 1 1 21 VAL HA H 3.977 -5.126 -2.824 1.00 . A A . 21 VAL HA 1 1 1 323 1 1 21 VAL HB H 4.857 -4.421 -4.941 1.00 . A A . 21 VAL HB 1 1 1 324 1 1 21 VAL HG11 H 2.634 -3.702 -4.217 1.00 . A A . 21 VAL HG11 1 1 1 325 1 1 21 VAL HG12 H 3.315 -2.236 -3.490 1.00 . A A . 21 VAL HG12 1 1 1 326 1 1 21 VAL HG13 H 3.400 -2.478 -5.244 1.00 . A A . 21 VAL HG13 1 1 1 327 1 1 21 VAL HG21 H 5.837 -2.183 -5.260 1.00 . A A . 21 VAL HG21 1 1 1 328 1 1 21 VAL HG22 H 5.919 -1.994 -3.502 1.00 . A A . 21 VAL HG22 1 1 1 329 1 1 21 VAL HG23 H 6.904 -3.230 -4.312 1.00 . A A . 21 VAL HG23 1 1 1 330 1 1 21 VAL N N 4.754 -3.646 -1.602 1.00 . A A . 21 VAL N 1 1 1 331 1 1 21 VAL O O 5.931 -6.593 -3.031 1.00 . A A . 21 VAL O 1 1 1 332 1 1 22 GLN C C 8.056 -6.908 -1.062 1.00 . A A . 22 GLN C 1 1 1 333 1 1 22 GLN CA C 8.387 -5.723 -1.974 1.00 . A A . 22 GLN CA 1 1 1 334 1 1 22 GLN CB C 9.471 -4.825 -1.361 1.00 . A A . 22 GLN CB 1 1 1 335 1 1 22 GLN CD C 11.416 -6.284 -2.178 1.00 . A A . 22 GLN CD 1 1 1 336 1 1 22 GLN CG C 10.773 -5.555 -1.000 1.00 . A A . 22 GLN CG 1 1 1 337 1 1 22 GLN H H 7.247 -3.930 -1.996 1.00 . A A . 22 GLN H 1 1 1 338 1 1 22 GLN HA H 8.746 -6.108 -2.930 1.00 . A A . 22 GLN HA 1 1 1 339 1 1 22 GLN HB2 H 9.695 -4.020 -2.061 1.00 . A A . 22 GLN HB2 1 1 1 340 1 1 22 GLN HB3 H 9.082 -4.379 -0.447 1.00 . A A . 22 GLN HB3 1 1 1 341 1 1 22 GLN HE21 H 11.244 -4.652 -3.389 1.00 . A A . 22 GLN HE21 1 1 1 342 1 1 22 GLN HE22 H 11.978 -6.065 -4.117 1.00 . A A . 22 GLN HE22 1 1 1 343 1 1 22 GLN HG2 H 11.486 -4.820 -0.624 1.00 . A A . 22 GLN HG2 1 1 1 344 1 1 22 GLN HG3 H 10.578 -6.271 -0.201 1.00 . A A . 22 GLN HG3 1 1 1 345 1 1 22 GLN N N 7.202 -4.914 -2.233 1.00 . A A . 22 GLN N 1 1 1 346 1 1 22 GLN NE2 N 11.557 -5.609 -3.321 1.00 . A A . 22 GLN NE2 1 1 1 347 1 1 22 GLN O O 8.547 -8.013 -1.283 1.00 . A A . 22 GLN O 1 1 1 348 1 1 22 GLN OE1 O 11.791 -7.447 -2.055 1.00 . A A . 22 GLN OE1 1 1 1 349 1 1 23 TRP C C 5.958 -8.730 0.270 1.00 . A A . 23 TRP C 1 1 1 350 1 1 23 TRP CA C 6.856 -7.691 0.931 1.00 . A A . 23 TRP CA 1 1 1 351 1 1 23 TRP CB C 6.142 -7.009 2.099 1.00 . A A . 23 TRP CB 1 1 1 352 1 1 23 TRP CD1 C 5.823 -8.864 3.775 1.00 . A A . 23 TRP CD1 1 1 1 353 1 1 23 TRP CD2 C 3.892 -8.135 2.915 1.00 . A A . 23 TRP CD2 1 1 1 354 1 1 23 TRP CE2 C 3.569 -9.181 3.826 1.00 . A A . 23 TRP CE2 1 1 1 355 1 1 23 TRP CE3 C 2.836 -7.567 2.177 1.00 . A A . 23 TRP CE3 1 1 1 356 1 1 23 TRP CG C 5.330 -7.933 2.938 1.00 . A A . 23 TRP CG 1 1 1 357 1 1 23 TRP CH2 C 1.216 -9.010 3.295 1.00 . A A . 23 TRP CH2 1 1 1 358 1 1 23 TRP CZ2 C 2.251 -9.615 4.025 1.00 . A A . 23 TRP CZ2 1 1 1 359 1 1 23 TRP CZ3 C 1.509 -7.995 2.366 1.00 . A A . 23 TRP CZ3 1 1 1 360 1 1 23 TRP H H 6.746 -5.793 0.043 1.00 . A A . 23 TRP H 1 1 1 361 1 1 23 TRP HA H 7.754 -8.183 1.309 1.00 . A A . 23 TRP HA 1 1 1 362 1 1 23 TRP HB2 H 6.875 -6.502 2.726 1.00 . A A . 23 TRP HB2 1 1 1 363 1 1 23 TRP HB3 H 5.457 -6.256 1.713 1.00 . A A . 23 TRP HB3 1 1 1 364 1 1 23 TRP HD1 H 6.878 -9.016 3.925 1.00 . A A . 23 TRP HD1 1 1 1 365 1 1 23 TRP HE1 H 4.875 -10.327 5.013 1.00 . A A . 23 TRP HE1 1 1 1 366 1 1 23 TRP HE3 H 3.080 -6.814 1.441 1.00 . A A . 23 TRP HE3 1 1 1 367 1 1 23 TRP HH2 H 0.199 -9.338 3.443 1.00 . A A . 23 TRP HH2 1 1 1 368 1 1 23 TRP HZ2 H 2.036 -10.410 4.724 1.00 . A A . 23 TRP HZ2 1 1 1 369 1 1 23 TRP HZ3 H 0.714 -7.549 1.788 1.00 . A A . 23 TRP HZ3 1 1 1 370 1 1 23 TRP N N 7.218 -6.684 -0.043 1.00 . A A . 23 TRP N 1 1 1 371 1 1 23 TRP NE1 N 4.786 -9.579 4.342 1.00 . A A . 23 TRP NE1 1 1 1 372 1 1 23 TRP O O 6.278 -9.914 0.277 1.00 . A A . 23 TRP O 1 1 1 373 1 1 24 LEU C C 4.501 -9.989 -2.010 1.00 . A A . 24 LEU C 1 1 1 374 1 1 24 LEU CA C 3.842 -9.059 -0.991 1.00 . A A . 24 LEU CA 1 1 1 375 1 1 24 LEU CB C 2.859 -8.096 -1.669 1.00 . A A . 24 LEU CB 1 1 1 376 1 1 24 LEU CD1 C 0.859 -9.664 -1.520 1.00 . A A . 24 LEU CD1 1 1 1 377 1 1 24 LEU CD2 C 0.843 -7.716 -3.090 1.00 . A A . 24 LEU CD2 1 1 1 378 1 1 24 LEU CG C 1.722 -8.788 -2.437 1.00 . A A . 24 LEU CG 1 1 1 379 1 1 24 LEU H H 4.667 -7.269 -0.229 1.00 . A A . 24 LEU H 1 1 1 380 1 1 24 LEU HA H 3.308 -9.644 -0.244 1.00 . A A . 24 LEU HA 1 1 1 381 1 1 24 LEU HB2 H 2.427 -7.449 -0.904 1.00 . A A . 24 LEU HB2 1 1 1 382 1 1 24 LEU HB3 H 3.422 -7.471 -2.363 1.00 . A A . 24 LEU HB3 1 1 1 383 1 1 24 LEU HD11 H 0.004 -10.046 -2.077 1.00 . A A . 24 LEU HD11 1 1 1 384 1 1 24 LEU HD12 H 1.433 -10.515 -1.154 1.00 . A A . 24 LEU HD12 1 1 1 385 1 1 24 LEU HD13 H 0.499 -9.079 -0.673 1.00 . A A . 24 LEU HD13 1 1 1 386 1 1 24 LEU HD21 H 0.049 -8.190 -3.669 1.00 . A A . 24 LEU HD21 1 1 1 387 1 1 24 LEU HD22 H 0.396 -7.080 -2.325 1.00 . A A . 24 LEU HD22 1 1 1 388 1 1 24 LEU HD23 H 1.445 -7.101 -3.759 1.00 . A A . 24 LEU HD23 1 1 1 389 1 1 24 LEU HG H 2.137 -9.410 -3.231 1.00 . A A . 24 LEU HG 1 1 1 390 1 1 24 LEU N N 4.840 -8.262 -0.294 1.00 . A A . 24 LEU N 1 1 1 391 1 1 24 LEU O O 4.123 -11.152 -2.135 1.00 . A A . 24 LEU O 1 1 1 392 1 1 25 MET C C 7.060 -11.314 -3.059 1.00 . A A . 25 MET C 1 1 1 393 1 1 25 MET CA C 6.276 -10.182 -3.718 1.00 . A A . 25 MET CA 1 1 1 394 1 1 25 MET CB C 7.233 -9.223 -4.431 1.00 . A A . 25 MET CB 1 1 1 395 1 1 25 MET CE C 6.301 -6.313 -7.304 1.00 . A A . 25 MET CE 1 1 1 396 1 1 25 MET CG C 6.508 -8.391 -5.493 1.00 . A A . 25 MET CG 1 1 1 397 1 1 25 MET H H 5.751 -8.498 -2.514 1.00 . A A . 25 MET H 1 1 1 398 1 1 25 MET HA H 5.598 -10.616 -4.455 1.00 . A A . 25 MET HA 1 1 1 399 1 1 25 MET HB2 H 7.697 -8.569 -3.692 1.00 . A A . 25 MET HB2 1 1 1 400 1 1 25 MET HB3 H 8.019 -9.799 -4.920 1.00 . A A . 25 MET HB3 1 1 1 401 1 1 25 MET HE1 H 6.097 -7.057 -8.075 1.00 . A A . 25 MET HE1 1 1 1 402 1 1 25 MET HE2 H 5.372 -6.050 -6.799 1.00 . A A . 25 MET HE2 1 1 1 403 1 1 25 MET HE3 H 6.727 -5.422 -7.766 1.00 . A A . 25 MET HE3 1 1 1 404 1 1 25 MET HG2 H 6.264 -9.039 -6.335 1.00 . A A . 25 MET HG2 1 1 1 405 1 1 25 MET HG3 H 5.575 -8.006 -5.085 1.00 . A A . 25 MET HG3 1 1 1 406 1 1 25 MET N N 5.498 -9.456 -2.724 1.00 . A A . 25 MET N 1 1 1 407 1 1 25 MET O O 6.939 -12.465 -3.474 1.00 . A A . 25 MET O 1 1 1 408 1 1 25 MET SD S 7.478 -6.988 -6.105 1.00 . A A . 25 MET SD 1 1 1 409 1 1 26 ASN C C 7.797 -13.073 -0.726 1.00 . A A . 26 ASN C 1 1 1 410 1 1 26 ASN CA C 8.670 -11.961 -1.314 1.00 . A A . 26 ASN CA 1 1 1 411 1 1 26 ASN CB C 9.496 -11.266 -0.223 1.00 . A A . 26 ASN CB 1 1 1 412 1 1 26 ASN CG C 10.514 -10.281 -0.798 1.00 . A A . 26 ASN CG 1 1 1 413 1 1 26 ASN H H 7.924 -10.015 -1.754 1.00 . A A . 26 ASN H 1 1 1 414 1 1 26 ASN HA H 9.358 -12.430 -2.019 1.00 . A A . 26 ASN HA 1 1 1 415 1 1 26 ASN HB2 H 8.826 -10.739 0.458 1.00 . A A . 26 ASN HB2 1 1 1 416 1 1 26 ASN HB3 H 10.041 -12.022 0.344 1.00 . A A . 26 ASN HB3 1 1 1 417 1 1 26 ASN HD21 H 10.706 -9.327 0.997 1.00 . A A . 26 ASN HD21 1 1 1 418 1 1 26 ASN HD22 H 11.644 -8.668 -0.335 1.00 . A A . 26 ASN HD22 1 1 1 419 1 1 26 ASN N N 7.864 -10.985 -2.040 1.00 . A A . 26 ASN N 1 1 1 420 1 1 26 ASN ND2 N 11.001 -9.358 0.033 1.00 . A A . 26 ASN ND2 1 1 1 421 1 1 26 ASN O O 8.195 -14.237 -0.746 1.00 . A A . 26 ASN O 1 1 1 422 1 1 26 ASN OD1 O 10.859 -10.344 -1.976 1.00 . A A . 26 ASN OD1 1 1 1 423 1 1 27 THR C C 4.840 -14.275 -0.896 1.00 . A A . 27 THR C 1 1 1 424 1 1 27 THR CA C 5.628 -13.679 0.276 1.00 . A A . 27 THR CA 1 1 1 425 1 1 27 THR CB C 4.720 -12.987 1.304 1.00 . A A . 27 THR CB 1 1 1 426 1 1 27 THR CG2 C 5.532 -12.477 2.497 1.00 . A A . 27 THR CG2 1 1 1 427 1 1 27 THR H H 6.336 -11.750 -0.228 1.00 . A A . 27 THR H 1 1 1 428 1 1 27 THR HA H 6.141 -14.496 0.787 1.00 . A A . 27 THR HA 1 1 1 429 1 1 27 THR HB H 3.984 -13.706 1.667 1.00 . A A . 27 THR HB 1 1 1 430 1 1 27 THR HG1 H 3.629 -12.188 -0.092 1.00 . A A . 27 THR HG1 1 1 1 431 1 1 27 THR HG21 H 6.105 -13.294 2.932 1.00 . A A . 27 THR HG21 1 1 1 432 1 1 27 THR HG22 H 6.216 -11.686 2.187 1.00 . A A . 27 THR HG22 1 1 1 433 1 1 27 THR HG23 H 4.848 -12.079 3.244 1.00 . A A . 27 THR HG23 1 1 1 434 1 1 27 THR N N 6.605 -12.726 -0.227 1.00 . A A . 27 THR N 1 1 1 435 1 1 27 THR O O 3.632 -14.077 -1.012 1.00 . A A . 27 THR O 1 1 1 436 1 1 27 THR OG1 O 4.045 -11.893 0.724 1.00 . A A . 27 THR OG1 1 1 1 437 1 1 28 NH2 HN1 H 6.522 -15.135 -1.647 1.00 . A A . 28 NH2 HN1 1 1 1 438 1 1 28 NH2 HN2 H 5.053 -15.424 -2.564 1.00 . A A . 28 NH2 HN2 1 1 1 439 1 1 28 NH2 N N 5.525 -15.013 -1.772 1.00 . A A . 28 NH2 N 1 1 2 440 1 1 1 SER C C -10.348 4.238 -4.628 1.00 . A A . 1 SER C 1 1 2 441 1 1 1 SER CA C -11.873 4.246 -4.788 1.00 . A A . 1 SER CA 1 1 2 442 1 1 1 SER CB C -12.509 2.906 -4.388 1.00 . A A . 1 SER CB 1 1 2 443 1 1 1 SER H1 H -13.287 4.667 -6.206 1.00 . A A . 1 SER H1 1 1 2 444 1 1 1 SER H2 H -11.887 5.517 -6.396 1.00 . A A . 1 SER H2 1 1 2 445 1 1 1 SER H3 H -11.943 3.922 -6.804 1.00 . A A . 1 SER H3 1 1 2 446 1 1 1 SER HA H -12.264 5.010 -4.116 1.00 . A A . 1 SER HA 1 1 2 447 1 1 1 SER HB2 H -12.232 2.649 -3.365 1.00 . A A . 1 SER HB2 1 1 2 448 1 1 1 SER HB3 H -13.595 2.992 -4.438 1.00 . A A . 1 SER HB3 1 1 2 449 1 1 1 SER HG H -12.396 2.067 -6.143 1.00 . A A . 1 SER HG 1 1 2 450 1 1 1 SER N N -12.280 4.618 -6.155 1.00 . A A . 1 SER N 1 1 2 451 1 1 1 SER O O -9.781 3.300 -4.070 1.00 . A A . 1 SER O 1 1 2 452 1 1 1 SER OG O -12.092 1.870 -5.254 1.00 . A A . 1 SER OG 1 1 2 453 1 1 2 GLN C C -7.850 6.908 -5.362 1.00 . A A . 2 GLN C 1 1 2 454 1 1 2 GLN CA C -8.241 5.455 -5.075 1.00 . A A . 2 GLN CA 1 1 2 455 1 1 2 GLN CB C -7.519 4.455 -6.002 1.00 . A A . 2 GLN CB 1 1 2 456 1 1 2 GLN CD C -9.191 4.537 -7.935 1.00 . A A . 2 GLN CD 1 1 2 457 1 1 2 GLN CG C -7.728 4.647 -7.513 1.00 . A A . 2 GLN CG 1 1 2 458 1 1 2 GLN H H -10.223 6.032 -5.560 1.00 . A A . 2 GLN H 1 1 2 459 1 1 2 GLN HA H -7.924 5.229 -4.057 1.00 . A A . 2 GLN HA 1 1 2 460 1 1 2 GLN HB2 H -6.449 4.544 -5.812 1.00 . A A . 2 GLN HB2 1 1 2 461 1 1 2 GLN HB3 H -7.812 3.439 -5.740 1.00 . A A . 2 GLN HB3 1 1 2 462 1 1 2 GLN HE21 H -9.132 2.504 -7.833 1.00 . A A . 2 GLN HE21 1 1 2 463 1 1 2 GLN HE22 H -10.665 3.193 -8.324 1.00 . A A . 2 GLN HE22 1 1 2 464 1 1 2 GLN HG2 H -7.328 5.612 -7.825 1.00 . A A . 2 GLN HG2 1 1 2 465 1 1 2 GLN HG3 H -7.159 3.877 -8.036 1.00 . A A . 2 GLN HG3 1 1 2 466 1 1 2 GLN N N -9.689 5.295 -5.121 1.00 . A A . 2 GLN N 1 1 2 467 1 1 2 GLN NE2 N -9.704 3.310 -8.038 1.00 . A A . 2 GLN NE2 1 1 2 468 1 1 2 GLN O O -7.031 7.477 -4.645 1.00 . A A . 2 GLN O 1 1 2 469 1 1 2 GLN OE1 O -9.849 5.550 -8.162 1.00 . A A . 2 GLN OE1 1 1 2 470 1 1 3 GLY C C -8.813 9.898 -5.953 1.00 . A A . 3 GLY C 1 1 2 471 1 1 3 GLY CA C -8.122 8.864 -6.838 1.00 . A A . 3 GLY CA 1 1 2 472 1 1 3 GLY H H -9.101 6.989 -6.960 1.00 . A A . 3 GLY H 1 1 2 473 1 1 3 GLY HA2 H -7.043 9.026 -6.820 1.00 . A A . 3 GLY HA2 1 1 2 474 1 1 3 GLY HA3 H -8.468 8.985 -7.865 1.00 . A A . 3 GLY HA3 1 1 2 475 1 1 3 GLY N N -8.434 7.511 -6.406 1.00 . A A . 3 GLY N 1 1 2 476 1 1 3 GLY O O -9.776 10.533 -6.380 1.00 . A A . 3 GLY O 1 1 2 477 1 1 4 THR C C -7.688 11.476 -2.843 1.00 . A A . 4 THR C 1 1 2 478 1 1 4 THR CA C -8.840 11.012 -3.749 1.00 . A A . 4 THR CA 1 1 2 479 1 1 4 THR CB C -10.032 10.361 -3.015 1.00 . A A . 4 THR CB 1 1 2 480 1 1 4 THR CG2 C -9.637 9.069 -2.294 1.00 . A A . 4 THR CG2 1 1 2 481 1 1 4 THR H H -7.547 9.475 -4.426 1.00 . A A . 4 THR H 1 1 2 482 1 1 4 THR HA H -9.206 11.899 -4.268 1.00 . A A . 4 THR HA 1 1 2 483 1 1 4 THR HB H -10.794 10.106 -3.754 1.00 . A A . 4 THR HB 1 1 2 484 1 1 4 THR HG1 H -10.983 12.004 -2.584 1.00 . A A . 4 THR HG1 1 1 2 485 1 1 4 THR HG21 H -10.489 8.710 -1.716 1.00 . A A . 4 THR HG21 1 1 2 486 1 1 4 THR HG22 H -9.357 8.302 -3.015 1.00 . A A . 4 THR HG22 1 1 2 487 1 1 4 THR HG23 H -8.798 9.249 -1.625 1.00 . A A . 4 THR HG23 1 1 2 488 1 1 4 THR N N -8.317 10.065 -4.722 1.00 . A A . 4 THR N 1 1 2 489 1 1 4 THR O O -6.545 11.538 -3.291 1.00 . A A . 4 THR O 1 1 2 490 1 1 4 THR OG1 O -10.635 11.252 -2.097 1.00 . A A . 4 THR OG1 1 1 2 491 1 1 5 THR C C -7.145 11.208 0.624 1.00 . A A . 5 THR C 1 1 2 492 1 1 5 THR CA C -7.037 12.187 -0.546 1.00 . A A . 5 THR CA 1 1 2 493 1 1 5 THR CB C -7.317 13.630 -0.098 1.00 . A A . 5 THR CB 1 1 2 494 1 1 5 THR CG2 C -6.983 14.626 -1.213 1.00 . A A . 5 THR CG2 1 1 2 495 1 1 5 THR H H -8.960 11.764 -1.308 1.00 . A A . 5 THR H 1 1 2 496 1 1 5 THR HA H -6.018 12.133 -0.923 1.00 . A A . 5 THR HA 1 1 2 497 1 1 5 THR HB H -6.693 13.859 0.767 1.00 . A A . 5 THR HB 1 1 2 498 1 1 5 THR HG1 H -8.825 14.682 0.543 1.00 . A A . 5 THR HG1 1 1 2 499 1 1 5 THR HG21 H -5.938 14.516 -1.506 1.00 . A A . 5 THR HG21 1 1 2 500 1 1 5 THR HG22 H -7.619 14.455 -2.082 1.00 . A A . 5 THR HG22 1 1 2 501 1 1 5 THR HG23 H -7.142 15.643 -0.853 1.00 . A A . 5 THR HG23 1 1 2 502 1 1 5 THR N N -7.988 11.803 -1.581 1.00 . A A . 5 THR N 1 1 2 503 1 1 5 THR O O -6.133 10.692 1.098 1.00 . A A . 5 THR O 1 1 2 504 1 1 5 THR OG1 O -8.677 13.775 0.263 1.00 . A A . 5 THR OG1 1 1 2 505 1 1 6 SER C C -8.176 8.628 1.842 1.00 . A A . 6 SER C 1 1 2 506 1 1 6 SER CA C -8.712 10.030 2.143 1.00 . A A . 6 SER CA 1 1 2 507 1 1 6 SER CB C -10.233 10.025 2.352 1.00 . A A . 6 SER CB 1 1 2 508 1 1 6 SER H H -9.146 11.458 0.642 1.00 . A A . 6 SER H 1 1 2 509 1 1 6 SER HA H -8.247 10.386 3.064 1.00 . A A . 6 SER HA 1 1 2 510 1 1 6 SER HB2 H -10.494 9.270 3.094 1.00 . A A . 6 SER HB2 1 1 2 511 1 1 6 SER HB3 H -10.551 11.001 2.720 1.00 . A A . 6 SER HB3 1 1 2 512 1 1 6 SER HG H -10.802 10.484 0.538 1.00 . A A . 6 SER HG 1 1 2 513 1 1 6 SER N N -8.381 10.957 1.072 1.00 . A A . 6 SER N 1 1 2 514 1 1 6 SER O O -7.319 8.128 2.567 1.00 . A A . 6 SER O 1 1 2 515 1 1 6 SER OG O -10.920 9.750 1.145 1.00 . A A . 6 SER OG 1 1 2 516 1 1 7 GLU C C -7.120 6.841 -0.676 1.00 . A A . 7 GLU C 1 1 2 517 1 1 7 GLU CA C -8.273 6.683 0.311 1.00 . A A . 7 GLU CA 1 1 2 518 1 1 7 GLU CB C -9.490 5.958 -0.283 1.00 . A A . 7 GLU CB 1 1 2 519 1 1 7 GLU CD C -10.465 3.726 -1.018 1.00 . A A . 7 GLU CD 1 1 2 520 1 1 7 GLU CG C -9.208 4.478 -0.584 1.00 . A A . 7 GLU CG 1 1 2 521 1 1 7 GLU H H -9.343 8.518 0.209 1.00 . A A . 7 GLU H 1 1 2 522 1 1 7 GLU HA H -7.917 6.097 1.157 1.00 . A A . 7 GLU HA 1 1 2 523 1 1 7 GLU HB2 H -10.302 6.009 0.444 1.00 . A A . 7 GLU HB2 1 1 2 524 1 1 7 GLU HB3 H -9.809 6.460 -1.197 1.00 . A A . 7 GLU HB3 1 1 2 525 1 1 7 GLU HG2 H -8.473 4.382 -1.382 1.00 . A A . 7 GLU HG2 1 1 2 526 1 1 7 GLU HG3 H -8.807 4.007 0.313 1.00 . A A . 7 GLU HG3 1 1 2 527 1 1 7 GLU N N -8.677 8.006 0.770 1.00 . A A . 7 GLU N 1 1 2 528 1 1 7 GLU O O -7.213 6.436 -1.833 1.00 . A A . 7 GLU O 1 1 2 529 1 1 7 GLU OE1 O -11.426 4.399 -1.453 1.00 . A A . 7 GLU OE1 1 1 2 530 1 1 7 GLU OE2 O -10.443 2.481 -0.910 1.00 . A A . 7 GLU OE2 1 1 2 531 1 1 8 TYR C C -3.661 8.032 -0.239 1.00 . A A . 8 TYR C 1 1 2 532 1 1 8 TYR CA C -4.914 7.802 -1.073 1.00 . A A . 8 TYR CA 1 1 2 533 1 1 8 TYR CB C -5.287 9.018 -1.921 1.00 . A A . 8 TYR CB 1 1 2 534 1 1 8 TYR CD1 C -4.049 8.597 -4.075 1.00 . A A . 8 TYR CD1 1 1 2 535 1 1 8 TYR CD2 C -3.598 10.652 -2.850 1.00 . A A . 8 TYR CD2 1 1 2 536 1 1 8 TYR CE1 C -3.274 9.064 -5.147 1.00 . A A . 8 TYR CE1 1 1 2 537 1 1 8 TYR CE2 C -2.816 11.116 -3.919 1.00 . A A . 8 TYR CE2 1 1 2 538 1 1 8 TYR CG C -4.247 9.409 -2.944 1.00 . A A . 8 TYR CG 1 1 2 539 1 1 8 TYR CZ C -2.667 10.330 -5.076 1.00 . A A . 8 TYR CZ 1 1 2 540 1 1 8 TYR H H -6.008 7.768 0.748 1.00 . A A . 8 TYR H 1 1 2 541 1 1 8 TYR HA H -4.713 6.980 -1.750 1.00 . A A . 8 TYR HA 1 1 2 542 1 1 8 TYR HB2 H -6.207 8.804 -2.465 1.00 . A A . 8 TYR HB2 1 1 2 543 1 1 8 TYR HB3 H -5.491 9.864 -1.272 1.00 . A A . 8 TYR HB3 1 1 2 544 1 1 8 TYR HD1 H -4.504 7.620 -4.132 1.00 . A A . 8 TYR HD1 1 1 2 545 1 1 8 TYR HD2 H -3.718 11.268 -1.970 1.00 . A A . 8 TYR HD2 1 1 2 546 1 1 8 TYR HE1 H -3.161 8.443 -6.023 1.00 . A A . 8 TYR HE1 1 1 2 547 1 1 8 TYR HE2 H -2.345 12.083 -3.843 1.00 . A A . 8 TYR HE2 1 1 2 548 1 1 8 TYR HH H -1.559 11.662 -5.976 1.00 . A A . 8 TYR HH 1 1 2 549 1 1 8 TYR N N -6.030 7.461 -0.215 1.00 . A A . 8 TYR N 1 1 2 550 1 1 8 TYR O O -2.728 7.232 -0.299 1.00 . A A . 8 TYR O 1 1 2 551 1 1 8 TYR OH O -1.931 10.791 -6.128 1.00 . A A . 8 TYR OH 1 1 2 552 1 1 9 SER C C -1.961 8.537 2.291 1.00 . A A . 9 SER C 1 1 2 553 1 1 9 SER CA C -2.515 9.590 1.321 1.00 . A A . 9 SER CA 1 1 2 554 1 1 9 SER CB C -2.899 10.875 2.064 1.00 . A A . 9 SER CB 1 1 2 555 1 1 9 SER H H -4.482 9.702 0.555 1.00 . A A . 9 SER H 1 1 2 556 1 1 9 SER HA H -1.727 9.862 0.623 1.00 . A A . 9 SER HA 1 1 2 557 1 1 9 SER HB2 H -3.623 10.661 2.849 1.00 . A A . 9 SER HB2 1 1 2 558 1 1 9 SER HB3 H -2.007 11.308 2.518 1.00 . A A . 9 SER HB3 1 1 2 559 1 1 9 SER HG H -4.352 11.526 0.945 1.00 . A A . 9 SER HG 1 1 2 560 1 1 9 SER N N -3.652 9.125 0.535 1.00 . A A . 9 SER N 1 1 2 561 1 1 9 SER O O -0.841 8.685 2.776 1.00 . A A . 9 SER O 1 1 2 562 1 1 9 SER OG O -3.463 11.815 1.173 1.00 . A A . 9 SER OG 1 1 2 563 1 1 10 LYS C C -1.257 5.561 2.981 1.00 . A A . 10 LYS C 1 1 2 564 1 1 10 LYS CA C -2.394 6.432 3.520 1.00 . A A . 10 LYS CA 1 1 2 565 1 1 10 LYS CB C -3.619 5.553 3.814 1.00 . A A . 10 LYS CB 1 1 2 566 1 1 10 LYS CD C -5.052 7.309 5.108 1.00 . A A . 10 LYS CD 1 1 2 567 1 1 10 LYS CE C -4.562 8.706 4.704 1.00 . A A . 10 LYS CE 1 1 2 568 1 1 10 LYS CG C -4.967 6.271 3.978 1.00 . A A . 10 LYS CG 1 1 2 569 1 1 10 LYS H H -3.618 7.391 2.104 1.00 . A A . 10 LYS H 1 1 2 570 1 1 10 LYS HA H -2.069 6.891 4.456 1.00 . A A . 10 LYS HA 1 1 2 571 1 1 10 LYS HB2 H -3.741 4.851 2.988 1.00 . A A . 10 LYS HB2 1 1 2 572 1 1 10 LYS HB3 H -3.416 4.973 4.716 1.00 . A A . 10 LYS HB3 1 1 2 573 1 1 10 LYS HD2 H -6.108 7.400 5.370 1.00 . A A . 10 LYS HD2 1 1 2 574 1 1 10 LYS HD3 H -4.512 6.957 5.987 1.00 . A A . 10 LYS HD3 1 1 2 575 1 1 10 LYS HE2 H -3.474 8.745 4.703 1.00 . A A . 10 LYS HE2 1 1 2 576 1 1 10 LYS HE3 H -4.933 8.953 3.709 1.00 . A A . 10 LYS HE3 1 1 2 577 1 1 10 LYS HG2 H -5.267 6.719 3.032 1.00 . A A . 10 LYS HG2 1 1 2 578 1 1 10 LYS HG3 H -5.698 5.493 4.205 1.00 . A A . 10 LYS HG3 1 1 2 579 1 1 10 LYS HZ1 H -4.705 10.640 5.348 1.00 . A A . 10 LYS HZ1 1 1 2 580 1 1 10 LYS HZ2 H -6.052 9.738 5.649 1.00 . A A . 10 LYS HZ2 1 1 2 581 1 1 10 LYS HZ3 H -4.699 9.532 6.569 1.00 . A A . 10 LYS HZ3 1 1 2 582 1 1 10 LYS N N -2.736 7.482 2.577 1.00 . A A . 10 LYS N 1 1 2 583 1 1 10 LYS NZ N -5.042 9.734 5.641 1.00 . A A . 10 LYS NZ 1 1 2 584 1 1 10 LYS O O -0.488 5.025 3.774 1.00 . A A . 10 LYS O 1 1 2 585 1 1 11 TYR C C 0.654 5.385 -0.037 1.00 . A A . 11 TYR C 1 1 2 586 1 1 11 TYR CA C -0.215 4.580 0.937 1.00 . A A . 11 TYR CA 1 1 2 587 1 1 11 TYR CB C -0.975 3.470 0.217 1.00 . A A . 11 TYR CB 1 1 2 588 1 1 11 TYR CD1 C -1.813 4.214 -2.061 1.00 . A A . 11 TYR CD1 1 1 2 589 1 1 11 TYR CD2 C -3.421 3.933 -0.256 1.00 . A A . 11 TYR CD2 1 1 2 590 1 1 11 TYR CE1 C -2.860 4.542 -2.941 1.00 . A A . 11 TYR CE1 1 1 2 591 1 1 11 TYR CE2 C -4.468 4.257 -1.135 1.00 . A A . 11 TYR CE2 1 1 2 592 1 1 11 TYR CG C -2.090 3.912 -0.715 1.00 . A A . 11 TYR CG 1 1 2 593 1 1 11 TYR CZ C -4.187 4.570 -2.477 1.00 . A A . 11 TYR CZ 1 1 2 594 1 1 11 TYR H H -1.874 5.855 1.071 1.00 . A A . 11 TYR H 1 1 2 595 1 1 11 TYR HA H 0.446 4.078 1.640 1.00 . A A . 11 TYR HA 1 1 2 596 1 1 11 TYR HB2 H -0.248 2.888 -0.344 1.00 . A A . 11 TYR HB2 1 1 2 597 1 1 11 TYR HB3 H -1.401 2.838 0.995 1.00 . A A . 11 TYR HB3 1 1 2 598 1 1 11 TYR HD1 H -0.797 4.188 -2.427 1.00 . A A . 11 TYR HD1 1 1 2 599 1 1 11 TYR HD2 H -3.646 3.690 0.772 1.00 . A A . 11 TYR HD2 1 1 2 600 1 1 11 TYR HE1 H -2.643 4.778 -3.972 1.00 . A A . 11 TYR HE1 1 1 2 601 1 1 11 TYR HE2 H -5.487 4.265 -0.777 1.00 . A A . 11 TYR HE2 1 1 2 602 1 1 11 TYR HH H -6.022 5.120 -2.871 1.00 . A A . 11 TYR HH 1 1 2 603 1 1 11 TYR N N -1.175 5.412 1.650 1.00 . A A . 11 TYR N 1 1 2 604 1 1 11 TYR O O 1.780 4.988 -0.319 1.00 . A A . 11 TYR O 1 1 2 605 1 1 11 TYR OH O -5.198 4.916 -3.325 1.00 . A A . 11 TYR OH 1 1 2 606 1 1 12 LEU C C 2.238 7.597 -1.383 1.00 . A A . 12 LEU C 1 1 2 607 1 1 12 LEU CA C 0.725 7.416 -1.518 1.00 . A A . 12 LEU CA 1 1 2 608 1 1 12 LEU CB C -0.021 8.745 -1.357 1.00 . A A . 12 LEU CB 1 1 2 609 1 1 12 LEU CD1 C 1.592 10.688 -1.862 1.00 . A A . 12 LEU CD1 1 1 2 610 1 1 12 LEU CD2 C 0.387 9.513 -3.747 1.00 . A A . 12 LEU CD2 1 1 2 611 1 1 12 LEU CG C 0.325 9.927 -2.273 1.00 . A A . 12 LEU CG 1 1 2 612 1 1 12 LEU H H -0.819 6.733 -0.268 1.00 . A A . 12 LEU H 1 1 2 613 1 1 12 LEU HA H 0.537 7.004 -2.511 1.00 . A A . 12 LEU HA 1 1 2 614 1 1 12 LEU HB2 H -1.072 8.528 -1.540 1.00 . A A . 12 LEU HB2 1 1 2 615 1 1 12 LEU HB3 H 0.092 9.058 -0.320 1.00 . A A . 12 LEU HB3 1 1 2 616 1 1 12 LEU HD11 H 2.491 10.120 -2.090 1.00 . A A . 12 LEU HD11 1 1 2 617 1 1 12 LEU HD12 H 1.635 11.629 -2.411 1.00 . A A . 12 LEU HD12 1 1 2 618 1 1 12 LEU HD13 H 1.564 10.908 -0.795 1.00 . A A . 12 LEU HD13 1 1 2 619 1 1 12 LEU HD21 H 1.275 8.911 -3.938 1.00 . A A . 12 LEU HD21 1 1 2 620 1 1 12 LEU HD22 H -0.496 8.930 -4.003 1.00 . A A . 12 LEU HD22 1 1 2 621 1 1 12 LEU HD23 H 0.425 10.403 -4.375 1.00 . A A . 12 LEU HD23 1 1 2 622 1 1 12 LEU HG H -0.506 10.625 -2.145 1.00 . A A . 12 LEU HG 1 1 2 623 1 1 12 LEU N N 0.125 6.502 -0.549 1.00 . A A . 12 LEU N 1 1 2 624 1 1 12 LEU O O 2.942 7.531 -2.389 1.00 . A A . 12 LEU O 1 1 2 625 1 1 13 ASP C C 4.998 6.943 -0.525 1.00 . A A . 13 ASP C 1 1 2 626 1 1 13 ASP CA C 4.149 8.044 0.120 1.00 . A A . 13 ASP CA 1 1 2 627 1 1 13 ASP CB C 4.328 8.128 1.640 1.00 . A A . 13 ASP CB 1 1 2 628 1 1 13 ASP CG C 5.745 7.822 2.121 1.00 . A A . 13 ASP CG 1 1 2 629 1 1 13 ASP H H 2.106 7.838 0.631 1.00 . A A . 13 ASP H 1 1 2 630 1 1 13 ASP HA H 4.442 9.005 -0.306 1.00 . A A . 13 ASP HA 1 1 2 631 1 1 13 ASP HB2 H 4.036 9.122 1.980 1.00 . A A . 13 ASP HB2 1 1 2 632 1 1 13 ASP HB3 H 3.645 7.412 2.082 1.00 . A A . 13 ASP HB3 1 1 2 633 1 1 13 ASP N N 2.734 7.836 -0.161 1.00 . A A . 13 ASP N 1 1 2 634 1 1 13 ASP O O 4.660 5.762 -0.461 1.00 . A A . 13 ASP O 1 1 2 635 1 1 13 ASP OD1 O 6.669 8.541 1.682 1.00 . A A . 13 ASP OD1 1 1 2 636 1 1 13 ASP OD2 O 5.875 6.871 2.924 1.00 . A A . 13 ASP OD2 1 1 2 637 1 1 14 SER C C 7.966 5.789 -1.147 1.00 . A A . 14 SER C 1 1 2 638 1 1 14 SER CA C 6.892 6.453 -1.999 1.00 . A A . 14 SER CA 1 1 2 639 1 1 14 SER CB C 7.481 7.229 -3.171 1.00 . A A . 14 SER CB 1 1 2 640 1 1 14 SER H H 6.329 8.326 -1.198 1.00 . A A . 14 SER H 1 1 2 641 1 1 14 SER HA H 6.251 5.690 -2.431 1.00 . A A . 14 SER HA 1 1 2 642 1 1 14 SER HB2 H 8.114 6.552 -3.744 1.00 . A A . 14 SER HB2 1 1 2 643 1 1 14 SER HB3 H 6.657 7.577 -3.791 1.00 . A A . 14 SER HB3 1 1 2 644 1 1 14 SER HG H 8.941 8.004 -2.156 1.00 . A A . 14 SER HG 1 1 2 645 1 1 14 SER N N 6.086 7.346 -1.189 1.00 . A A . 14 SER N 1 1 2 646 1 1 14 SER O O 9.155 6.086 -1.255 1.00 . A A . 14 SER O 1 1 2 647 1 1 14 SER OG O 8.233 8.335 -2.716 1.00 . A A . 14 SER OG 1 1 2 648 1 1 15 ARG C C 7.367 3.065 1.264 1.00 . A A . 15 ARG C 1 1 2 649 1 1 15 ARG CA C 8.282 4.129 0.668 1.00 . A A . 15 ARG CA 1 1 2 650 1 1 15 ARG CB C 8.851 5.093 1.725 1.00 . A A . 15 ARG CB 1 1 2 651 1 1 15 ARG CD C 8.833 3.840 4.003 1.00 . A A . 15 ARG CD 1 1 2 652 1 1 15 ARG CG C 9.662 4.430 2.852 1.00 . A A . 15 ARG CG 1 1 2 653 1 1 15 ARG CZ C 6.926 4.545 5.452 1.00 . A A . 15 ARG CZ 1 1 2 654 1 1 15 ARG H H 6.497 4.722 -0.301 1.00 . A A . 15 ARG H 1 1 2 655 1 1 15 ARG HA H 9.110 3.637 0.154 1.00 . A A . 15 ARG HA 1 1 2 656 1 1 15 ARG HB2 H 9.536 5.770 1.214 1.00 . A A . 15 ARG HB2 1 1 2 657 1 1 15 ARG HB3 H 8.049 5.699 2.139 1.00 . A A . 15 ARG HB3 1 1 2 658 1 1 15 ARG HD2 H 8.301 2.950 3.674 1.00 . A A . 15 ARG HD2 1 1 2 659 1 1 15 ARG HD3 H 9.520 3.539 4.796 1.00 . A A . 15 ARG HD3 1 1 2 660 1 1 15 ARG HE H 7.971 5.770 4.226 1.00 . A A . 15 ARG HE 1 1 2 661 1 1 15 ARG HG2 H 10.304 3.654 2.431 1.00 . A A . 15 ARG HG2 1 1 2 662 1 1 15 ARG HG3 H 10.305 5.198 3.285 1.00 . A A . 15 ARG HG3 1 1 2 663 1 1 15 ARG HH11 H 7.385 2.561 5.648 1.00 . A A . 15 ARG HH11 1 1 2 664 1 1 15 ARG HH12 H 6.041 3.120 6.617 1.00 . A A . 15 ARG HH12 1 1 2 665 1 1 15 ARG HH21 H 6.209 6.457 5.484 1.00 . A A . 15 ARG HH21 1 1 2 666 1 1 15 ARG HH22 H 5.378 5.329 6.530 1.00 . A A . 15 ARG HH22 1 1 2 667 1 1 15 ARG N N 7.497 4.875 -0.297 1.00 . A A . 15 ARG N 1 1 2 668 1 1 15 ARG NE N 7.887 4.819 4.554 1.00 . A A . 15 ARG NE 1 1 2 669 1 1 15 ARG NH1 N 6.772 3.307 5.946 1.00 . A A . 15 ARG NH1 1 1 2 670 1 1 15 ARG NH2 N 6.107 5.525 5.858 1.00 . A A . 15 ARG NH2 1 1 2 671 1 1 15 ARG O O 7.733 1.893 1.308 1.00 . A A . 15 ARG O 1 1 2 672 1 1 16 ARG C C 4.620 1.593 1.385 1.00 . A A . 16 ARG C 1 1 2 673 1 1 16 ARG CA C 5.240 2.572 2.377 1.00 . A A . 16 ARG CA 1 1 2 674 1 1 16 ARG CB C 4.191 3.338 3.183 1.00 . A A . 16 ARG CB 1 1 2 675 1 1 16 ARG CD C 2.442 5.098 3.279 1.00 . A A . 16 ARG CD 1 1 2 676 1 1 16 ARG CG C 3.334 4.286 2.350 1.00 . A A . 16 ARG CG 1 1 2 677 1 1 16 ARG CZ C 2.751 6.721 5.141 1.00 . A A . 16 ARG CZ 1 1 2 678 1 1 16 ARG H H 5.906 4.439 1.558 1.00 . A A . 16 ARG H 1 1 2 679 1 1 16 ARG HA H 5.787 1.995 3.121 1.00 . A A . 16 ARG HA 1 1 2 680 1 1 16 ARG HB2 H 3.529 2.620 3.669 1.00 . A A . 16 ARG HB2 1 1 2 681 1 1 16 ARG HB3 H 4.703 3.908 3.953 1.00 . A A . 16 ARG HB3 1 1 2 682 1 1 16 ARG HD2 H 1.750 5.676 2.670 1.00 . A A . 16 ARG HD2 1 1 2 683 1 1 16 ARG HD3 H 1.904 4.401 3.921 1.00 . A A . 16 ARG HD3 1 1 2 684 1 1 16 ARG HE H 4.150 6.235 3.741 1.00 . A A . 16 ARG HE 1 1 2 685 1 1 16 ARG HG2 H 3.951 4.966 1.770 1.00 . A A . 16 ARG HG2 1 1 2 686 1 1 16 ARG HG3 H 2.704 3.702 1.685 1.00 . A A . 16 ARG HG3 1 1 2 687 1 1 16 ARG HH11 H 0.867 5.924 5.077 1.00 . A A . 16 ARG HH11 1 1 2 688 1 1 16 ARG HH12 H 1.153 7.072 6.365 1.00 . A A . 16 ARG HH12 1 1 2 689 1 1 16 ARG HH21 H 4.506 7.716 5.460 1.00 . A A . 16 ARG HH21 1 1 2 690 1 1 16 ARG HH22 H 3.214 8.102 6.573 1.00 . A A . 16 ARG HH22 1 1 2 691 1 1 16 ARG N N 6.173 3.474 1.713 1.00 . A A . 16 ARG N 1 1 2 692 1 1 16 ARG NE N 3.219 6.040 4.084 1.00 . A A . 16 ARG NE 1 1 2 693 1 1 16 ARG NH1 N 1.489 6.556 5.564 1.00 . A A . 16 ARG NH1 1 1 2 694 1 1 16 ARG NH2 N 3.557 7.583 5.777 1.00 . A A . 16 ARG NH2 1 1 2 695 1 1 16 ARG O O 4.663 0.387 1.604 1.00 . A A . 16 ARG O 1 1 2 696 1 1 17 ALA C C 4.456 0.377 -1.395 1.00 . A A . 17 ALA C 1 1 2 697 1 1 17 ALA CA C 3.426 1.296 -0.741 1.00 . A A . 17 ALA CA 1 1 2 698 1 1 17 ALA CB C 2.756 2.221 -1.756 1.00 . A A . 17 ALA CB 1 1 2 699 1 1 17 ALA H H 4.103 3.102 0.128 1.00 . A A . 17 ALA H 1 1 2 700 1 1 17 ALA HA H 2.651 0.679 -0.287 1.00 . A A . 17 ALA HA 1 1 2 701 1 1 17 ALA HB1 H 3.450 2.996 -2.080 1.00 . A A . 17 ALA HB1 1 1 2 702 1 1 17 ALA HB2 H 2.413 1.649 -2.617 1.00 . A A . 17 ALA HB2 1 1 2 703 1 1 17 ALA HB3 H 1.897 2.695 -1.285 1.00 . A A . 17 ALA HB3 1 1 2 704 1 1 17 ALA N N 4.059 2.106 0.286 1.00 . A A . 17 ALA N 1 1 2 705 1 1 17 ALA O O 4.177 -0.787 -1.660 1.00 . A A . 17 ALA O 1 1 2 706 1 1 18 GLN C C 7.227 -0.944 -1.279 1.00 . A A . 18 GLN C 1 1 2 707 1 1 18 GLN CA C 6.789 0.196 -2.198 1.00 . A A . 18 GLN CA 1 1 2 708 1 1 18 GLN CB C 7.923 1.206 -2.416 1.00 . A A . 18 GLN CB 1 1 2 709 1 1 18 GLN CD C 6.371 2.376 -4.129 1.00 . A A . 18 GLN CD 1 1 2 710 1 1 18 GLN CG C 7.796 1.980 -3.736 1.00 . A A . 18 GLN CG 1 1 2 711 1 1 18 GLN H H 5.801 1.875 -1.381 1.00 . A A . 18 GLN H 1 1 2 712 1 1 18 GLN HA H 6.498 -0.249 -3.151 1.00 . A A . 18 GLN HA 1 1 2 713 1 1 18 GLN HB2 H 7.949 1.910 -1.583 1.00 . A A . 18 GLN HB2 1 1 2 714 1 1 18 GLN HB3 H 8.878 0.679 -2.438 1.00 . A A . 18 GLN HB3 1 1 2 715 1 1 18 GLN HE21 H 6.230 3.759 -2.634 1.00 . A A . 18 GLN HE21 1 1 2 716 1 1 18 GLN HE22 H 4.837 3.620 -3.681 1.00 . A A . 18 GLN HE22 1 1 2 717 1 1 18 GLN HG2 H 8.413 2.875 -3.668 1.00 . A A . 18 GLN HG2 1 1 2 718 1 1 18 GLN HG3 H 8.190 1.340 -4.524 1.00 . A A . 18 GLN HG3 1 1 2 719 1 1 18 GLN N N 5.657 0.908 -1.630 1.00 . A A . 18 GLN N 1 1 2 720 1 1 18 GLN NE2 N 5.770 3.333 -3.422 1.00 . A A . 18 GLN NE2 1 1 2 721 1 1 18 GLN O O 7.501 -2.042 -1.756 1.00 . A A . 18 GLN O 1 1 2 722 1 1 18 GLN OE1 O 5.814 1.822 -5.073 1.00 . A A . 18 GLN OE1 1 1 2 723 1 1 19 ASP C C 6.513 -2.793 1.025 1.00 . A A . 19 ASP C 1 1 2 724 1 1 19 ASP CA C 7.583 -1.699 1.036 1.00 . A A . 19 ASP CA 1 1 2 725 1 1 19 ASP CB C 7.710 -1.046 2.418 1.00 . A A . 19 ASP CB 1 1 2 726 1 1 19 ASP CG C 7.929 -2.085 3.514 1.00 . A A . 19 ASP CG 1 1 2 727 1 1 19 ASP H H 7.057 0.247 0.342 1.00 . A A . 19 ASP H 1 1 2 728 1 1 19 ASP HA H 8.545 -2.152 0.792 1.00 . A A . 19 ASP HA 1 1 2 729 1 1 19 ASP HB2 H 8.556 -0.358 2.412 1.00 . A A . 19 ASP HB2 1 1 2 730 1 1 19 ASP HB3 H 6.808 -0.480 2.648 1.00 . A A . 19 ASP HB3 1 1 2 731 1 1 19 ASP N N 7.281 -0.688 0.031 1.00 . A A . 19 ASP N 1 1 2 732 1 1 19 ASP O O 6.845 -3.977 1.042 1.00 . A A . 19 ASP O 1 1 2 733 1 1 19 ASP OD1 O 9.078 -2.566 3.620 1.00 . A A . 19 ASP OD1 1 1 2 734 1 1 19 ASP OD2 O 6.943 -2.382 4.224 1.00 . A A . 19 ASP OD2 1 1 2 735 1 1 20 PHE C C 4.203 -4.193 -0.351 1.00 . A A . 20 PHE C 1 1 2 736 1 1 20 PHE CA C 4.118 -3.334 0.915 1.00 . A A . 20 PHE CA 1 1 2 737 1 1 20 PHE CB C 2.781 -2.581 0.990 1.00 . A A . 20 PHE CB 1 1 2 738 1 1 20 PHE CD1 C 3.279 -1.839 3.393 1.00 . A A . 20 PHE CD1 1 1 2 739 1 1 20 PHE CD2 C 1.639 -0.610 2.081 1.00 . A A . 20 PHE CD2 1 1 2 740 1 1 20 PHE CE1 C 3.113 -0.928 4.450 1.00 . A A . 20 PHE CE1 1 1 2 741 1 1 20 PHE CE2 C 1.473 0.301 3.139 1.00 . A A . 20 PHE CE2 1 1 2 742 1 1 20 PHE CG C 2.562 -1.669 2.190 1.00 . A A . 20 PHE CG 1 1 2 743 1 1 20 PHE CZ C 2.212 0.143 4.324 1.00 . A A . 20 PHE CZ 1 1 2 744 1 1 20 PHE H H 5.023 -1.413 0.998 1.00 . A A . 20 PHE H 1 1 2 745 1 1 20 PHE HA H 4.177 -4.013 1.766 1.00 . A A . 20 PHE HA 1 1 2 746 1 1 20 PHE HB2 H 2.685 -1.975 0.088 1.00 . A A . 20 PHE HB2 1 1 2 747 1 1 20 PHE HB3 H 1.975 -3.315 0.984 1.00 . A A . 20 PHE HB3 1 1 2 748 1 1 20 PHE HD1 H 3.972 -2.656 3.522 1.00 . A A . 20 PHE HD1 1 1 2 749 1 1 20 PHE HD2 H 1.057 -0.487 1.180 1.00 . A A . 20 PHE HD2 1 1 2 750 1 1 20 PHE HE1 H 3.679 -1.052 5.362 1.00 . A A . 20 PHE HE1 1 1 2 751 1 1 20 PHE HE2 H 0.776 1.120 3.043 1.00 . A A . 20 PHE HE2 1 1 2 752 1 1 20 PHE HZ H 2.086 0.841 5.138 1.00 . A A . 20 PHE HZ 1 1 2 753 1 1 20 PHE N N 5.234 -2.402 0.984 1.00 . A A . 20 PHE N 1 1 2 754 1 1 20 PHE O O 3.913 -5.386 -0.298 1.00 . A A . 20 PHE O 1 1 2 755 1 1 21 VAL C C 5.943 -5.354 -2.559 1.00 . A A . 21 VAL C 1 1 2 756 1 1 21 VAL CA C 4.792 -4.363 -2.718 1.00 . A A . 21 VAL CA 1 1 2 757 1 1 21 VAL CB C 4.970 -3.414 -3.918 1.00 . A A . 21 VAL CB 1 1 2 758 1 1 21 VAL CG1 C 5.492 -4.147 -5.162 1.00 . A A . 21 VAL CG1 1 1 2 759 1 1 21 VAL CG2 C 3.625 -2.769 -4.276 1.00 . A A . 21 VAL CG2 1 1 2 760 1 1 21 VAL H H 4.855 -2.621 -1.483 1.00 . A A . 21 VAL H 1 1 2 761 1 1 21 VAL HA H 3.894 -4.958 -2.882 1.00 . A A . 21 VAL HA 1 1 2 762 1 1 21 VAL HB H 5.683 -2.631 -3.660 1.00 . A A . 21 VAL HB 1 1 2 763 1 1 21 VAL HG11 H 5.499 -3.464 -6.013 1.00 . A A . 21 VAL HG11 1 1 2 764 1 1 21 VAL HG12 H 6.512 -4.499 -5.003 1.00 . A A . 21 VAL HG12 1 1 2 765 1 1 21 VAL HG13 H 4.850 -4.997 -5.394 1.00 . A A . 21 VAL HG13 1 1 2 766 1 1 21 VAL HG21 H 2.937 -3.528 -4.652 1.00 . A A . 21 VAL HG21 1 1 2 767 1 1 21 VAL HG22 H 3.176 -2.297 -3.404 1.00 . A A . 21 VAL HG22 1 1 2 768 1 1 21 VAL HG23 H 3.774 -2.012 -5.047 1.00 . A A . 21 VAL HG23 1 1 2 769 1 1 21 VAL N N 4.616 -3.608 -1.484 1.00 . A A . 21 VAL N 1 1 2 770 1 1 21 VAL O O 5.769 -6.537 -2.835 1.00 . A A . 21 VAL O 1 1 2 771 1 1 22 GLN C C 7.930 -6.887 -0.913 1.00 . A A . 22 GLN C 1 1 2 772 1 1 22 GLN CA C 8.272 -5.719 -1.843 1.00 . A A . 22 GLN CA 1 1 2 773 1 1 22 GLN CB C 9.395 -4.850 -1.259 1.00 . A A . 22 GLN CB 1 1 2 774 1 1 22 GLN CD C 11.313 -6.248 -2.195 1.00 . A A . 22 GLN CD 1 1 2 775 1 1 22 GLN CG C 10.687 -5.620 -0.950 1.00 . A A . 22 GLN CG 1 1 2 776 1 1 22 GLN H H 7.183 -3.898 -1.888 1.00 . A A . 22 GLN H 1 1 2 777 1 1 22 GLN HA H 8.601 -6.118 -2.803 1.00 . A A . 22 GLN HA 1 1 2 778 1 1 22 GLN HB2 H 9.627 -4.050 -1.964 1.00 . A A . 22 GLN HB2 1 1 2 779 1 1 22 GLN HB3 H 9.047 -4.398 -0.330 1.00 . A A . 22 GLN HB3 1 1 2 780 1 1 22 GLN HE21 H 10.239 -7.962 -1.946 1.00 . A A . 22 GLN HE21 1 1 2 781 1 1 22 GLN HE22 H 11.331 -7.942 -3.320 1.00 . A A . 22 GLN HE22 1 1 2 782 1 1 22 GLN HG2 H 11.403 -4.914 -0.528 1.00 . A A . 22 GLN HG2 1 1 2 783 1 1 22 GLN HG3 H 10.500 -6.387 -0.199 1.00 . A A . 22 GLN HG3 1 1 2 784 1 1 22 GLN N N 7.107 -4.884 -2.097 1.00 . A A . 22 GLN N 1 1 2 785 1 1 22 GLN NE2 N 10.934 -7.489 -2.510 1.00 . A A . 22 GLN NE2 1 1 2 786 1 1 22 GLN O O 8.474 -7.979 -1.075 1.00 . A A . 22 GLN O 1 1 2 787 1 1 22 GLN OE1 O 12.134 -5.623 -2.861 1.00 . A A . 22 GLN OE1 1 1 2 788 1 1 23 TRP C C 5.799 -8.738 0.300 1.00 . A A . 23 TRP C 1 1 2 789 1 1 23 TRP CA C 6.643 -7.683 1.007 1.00 . A A . 23 TRP CA 1 1 2 790 1 1 23 TRP CB C 5.868 -7.031 2.152 1.00 . A A . 23 TRP CB 1 1 2 791 1 1 23 TRP CD1 C 5.581 -8.944 3.761 1.00 . A A . 23 TRP CD1 1 1 2 792 1 1 23 TRP CD2 C 3.653 -8.304 2.832 1.00 . A A . 23 TRP CD2 1 1 2 793 1 1 23 TRP CE2 C 3.356 -9.413 3.673 1.00 . A A . 23 TRP CE2 1 1 2 794 1 1 23 TRP CE3 C 2.606 -7.780 2.050 1.00 . A A . 23 TRP CE3 1 1 2 795 1 1 23 TRP CG C 5.070 -8.007 2.943 1.00 . A A . 23 TRP CG 1 1 2 796 1 1 23 TRP CH2 C 1.035 -9.392 2.995 1.00 . A A . 23 TRP CH2 1 1 2 797 1 1 23 TRP CZ2 C 2.066 -9.952 3.767 1.00 . A A . 23 TRP CZ2 1 1 2 798 1 1 23 TRP CZ3 C 1.307 -8.315 2.132 1.00 . A A . 23 TRP CZ3 1 1 2 799 1 1 23 TRP H H 6.523 -5.793 0.093 1.00 . A A . 23 TRP H 1 1 2 800 1 1 23 TRP HA H 7.533 -8.160 1.421 1.00 . A A . 23 TRP HA 1 1 2 801 1 1 23 TRP HB2 H 6.562 -6.509 2.811 1.00 . A A . 23 TRP HB2 1 1 2 802 1 1 23 TRP HB3 H 5.171 -6.297 1.750 1.00 . A A . 23 TRP HB3 1 1 2 803 1 1 23 TRP HD1 H 6.638 -9.048 3.939 1.00 . A A . 23 TRP HD1 1 1 2 804 1 1 23 TRP HE1 H 4.674 -10.525 4.879 1.00 . A A . 23 TRP HE1 1 1 2 805 1 1 23 TRP HE3 H 2.841 -6.978 1.364 1.00 . A A . 23 TRP HE3 1 1 2 806 1 1 23 TRP HH2 H 0.040 -9.801 3.060 1.00 . A A . 23 TRP HH2 1 1 2 807 1 1 23 TRP HZ2 H 1.870 -10.793 4.415 1.00 . A A . 23 TRP HZ2 1 1 2 808 1 1 23 TRP HZ3 H 0.518 -7.903 1.521 1.00 . A A . 23 TRP HZ3 1 1 2 809 1 1 23 TRP N N 7.029 -6.669 0.051 1.00 . A A . 23 TRP N 1 1 2 810 1 1 23 TRP NE1 N 4.568 -9.751 4.242 1.00 . A A . 23 TRP NE1 1 1 2 811 1 1 23 TRP O O 6.140 -9.915 0.326 1.00 . A A . 23 TRP O 1 1 2 812 1 1 24 LEU C C 4.554 -10.013 -2.066 1.00 . A A . 24 LEU C 1 1 2 813 1 1 24 LEU CA C 3.780 -9.127 -1.088 1.00 . A A . 24 LEU CA 1 1 2 814 1 1 24 LEU CB C 2.786 -8.193 -1.798 1.00 . A A . 24 LEU CB 1 1 2 815 1 1 24 LEU CD1 C 2.030 -9.358 -3.962 1.00 . A A . 24 LEU CD1 1 1 2 816 1 1 24 LEU CD2 C 0.945 -9.968 -1.766 1.00 . A A . 24 LEU CD2 1 1 2 817 1 1 24 LEU CG C 1.629 -8.855 -2.569 1.00 . A A . 24 LEU CG 1 1 2 818 1 1 24 LEU H H 4.497 -7.307 -0.267 1.00 . A A . 24 LEU H 1 1 2 819 1 1 24 LEU HA H 3.239 -9.752 -0.379 1.00 . A A . 24 LEU HA 1 1 2 820 1 1 24 LEU HB2 H 2.336 -7.567 -1.026 1.00 . A A . 24 LEU HB2 1 1 2 821 1 1 24 LEU HB3 H 3.332 -7.533 -2.472 1.00 . A A . 24 LEU HB3 1 1 2 822 1 1 24 LEU HD11 H 2.652 -10.248 -3.903 1.00 . A A . 24 LEU HD11 1 1 2 823 1 1 24 LEU HD12 H 1.130 -9.609 -4.524 1.00 . A A . 24 LEU HD12 1 1 2 824 1 1 24 LEU HD13 H 2.569 -8.577 -4.500 1.00 . A A . 24 LEU HD13 1 1 2 825 1 1 24 LEU HD21 H 0.039 -10.284 -2.284 1.00 . A A . 24 LEU HD21 1 1 2 826 1 1 24 LEU HD22 H 1.604 -10.829 -1.661 1.00 . A A . 24 LEU HD22 1 1 2 827 1 1 24 LEU HD23 H 0.673 -9.597 -0.778 1.00 . A A . 24 LEU HD23 1 1 2 828 1 1 24 LEU HG H 0.887 -8.071 -2.732 1.00 . A A . 24 LEU HG 1 1 2 829 1 1 24 LEU N N 4.702 -8.296 -0.325 1.00 . A A . 24 LEU N 1 1 2 830 1 1 24 LEU O O 4.286 -11.207 -2.181 1.00 . A A . 24 LEU O 1 1 2 831 1 1 25 MET C C 7.233 -11.155 -3.028 1.00 . A A . 25 MET C 1 1 2 832 1 1 25 MET CA C 6.400 -10.073 -3.709 1.00 . A A . 25 MET CA 1 1 2 833 1 1 25 MET CB C 7.328 -9.047 -4.367 1.00 . A A . 25 MET CB 1 1 2 834 1 1 25 MET CE C 7.677 -9.492 -7.673 1.00 . A A . 25 MET CE 1 1 2 835 1 1 25 MET CG C 6.609 -8.208 -5.432 1.00 . A A . 25 MET CG 1 1 2 836 1 1 25 MET H H 5.706 -8.435 -2.529 1.00 . A A . 25 MET H 1 1 2 837 1 1 25 MET HA H 5.782 -10.548 -4.472 1.00 . A A . 25 MET HA 1 1 2 838 1 1 25 MET HB2 H 7.729 -8.394 -3.592 1.00 . A A . 25 MET HB2 1 1 2 839 1 1 25 MET HB3 H 8.166 -9.572 -4.823 1.00 . A A . 25 MET HB3 1 1 2 840 1 1 25 MET HE1 H 8.260 -8.580 -7.804 1.00 . A A . 25 MET HE1 1 1 2 841 1 1 25 MET HE2 H 8.225 -10.190 -7.041 1.00 . A A . 25 MET HE2 1 1 2 842 1 1 25 MET HE3 H 7.510 -9.954 -8.647 1.00 . A A . 25 MET HE3 1 1 2 843 1 1 25 MET HG2 H 5.716 -7.766 -4.993 1.00 . A A . 25 MET HG2 1 1 2 844 1 1 25 MET HG3 H 7.271 -7.397 -5.739 1.00 . A A . 25 MET HG3 1 1 2 845 1 1 25 MET N N 5.533 -9.409 -2.747 1.00 . A A . 25 MET N 1 1 2 846 1 1 25 MET O O 7.239 -12.299 -3.480 1.00 . A A . 25 MET O 1 1 2 847 1 1 25 MET SD S 6.076 -9.093 -6.925 1.00 . A A . 25 MET SD 1 1 2 848 1 1 26 ASN C C 7.954 -12.914 -0.713 1.00 . A A . 26 ASN C 1 1 2 849 1 1 26 ASN CA C 8.766 -11.704 -1.181 1.00 . A A . 26 ASN CA 1 1 2 850 1 1 26 ASN CB C 9.395 -10.960 0.002 1.00 . A A . 26 ASN CB 1 1 2 851 1 1 26 ASN CG C 10.311 -11.873 0.811 1.00 . A A . 26 ASN CG 1 1 2 852 1 1 26 ASN H H 7.885 -9.827 -1.635 1.00 . A A . 26 ASN H 1 1 2 853 1 1 26 ASN HA H 9.568 -12.056 -1.832 1.00 . A A . 26 ASN HA 1 1 2 854 1 1 26 ASN HB2 H 9.980 -10.117 -0.368 1.00 . A A . 26 ASN HB2 1 1 2 855 1 1 26 ASN HB3 H 8.613 -10.577 0.658 1.00 . A A . 26 ASN HB3 1 1 2 856 1 1 26 ASN HD21 H 11.725 -11.838 -0.656 1.00 . A A . 26 ASN HD21 1 1 2 857 1 1 26 ASN HD22 H 12.116 -12.802 0.751 1.00 . A A . 26 ASN HD22 1 1 2 858 1 1 26 ASN N N 7.937 -10.787 -1.950 1.00 . A A . 26 ASN N 1 1 2 859 1 1 26 ASN ND2 N 11.481 -12.195 0.256 1.00 . A A . 26 ASN ND2 1 1 2 860 1 1 26 ASN O O 8.437 -14.043 -0.778 1.00 . A A . 26 ASN O 1 1 2 861 1 1 26 ASN OD1 O 9.968 -12.281 1.917 1.00 . A A . 26 ASN OD1 1 1 2 862 1 1 27 THR C C 5.096 -14.318 -1.068 1.00 . A A . 27 THR C 1 1 2 863 1 1 27 THR CA C 5.789 -13.715 0.159 1.00 . A A . 27 THR CA 1 1 2 864 1 1 27 THR CB C 4.793 -13.123 1.169 1.00 . A A . 27 THR CB 1 1 2 865 1 1 27 THR CG2 C 5.525 -12.600 2.408 1.00 . A A . 27 THR CG2 1 1 2 866 1 1 27 THR H H 6.380 -11.725 -0.229 1.00 . A A . 27 THR H 1 1 2 867 1 1 27 THR HA H 6.336 -14.513 0.664 1.00 . A A . 27 THR HA 1 1 2 868 1 1 27 THR HB H 4.095 -13.902 1.478 1.00 . A A . 27 THR HB 1 1 2 869 1 1 27 THR HG1 H 3.723 -12.340 -0.255 1.00 . A A . 27 THR HG1 1 1 2 870 1 1 27 THR HG21 H 6.134 -13.392 2.840 1.00 . A A . 27 THR HG21 1 1 2 871 1 1 27 THR HG22 H 6.168 -11.758 2.150 1.00 . A A . 27 THR HG22 1 1 2 872 1 1 27 THR HG23 H 4.789 -12.269 3.139 1.00 . A A . 27 THR HG23 1 1 2 873 1 1 27 THR N N 6.716 -12.678 -0.261 1.00 . A A . 27 THR N 1 1 2 874 1 1 27 THR O O 3.883 -14.204 -1.230 1.00 . A A . 27 THR O 1 1 2 875 1 1 27 THR OG1 O 4.068 -12.055 0.597 1.00 . A A . 27 THR OG1 1 1 2 876 1 1 28 NH2 HN1 H 6.868 -15.020 -1.776 1.00 . A A . 28 NH2 HN1 1 1 2 877 1 1 28 NH2 HN2 H 5.464 -15.378 -2.767 1.00 . A A . 28 NH2 HN2 1 1 2 878 1 1 28 NH2 N N 5.871 -14.967 -1.940 1.00 . A A . 28 NH2 N 1 1 3 879 1 1 1 SER C C -8.938 -0.542 1.462 1.00 . A A . 1 SER C 1 1 3 880 1 1 1 SER CA C -9.956 -1.664 1.241 1.00 . A A . 1 SER CA 1 1 3 881 1 1 1 SER CB C -11.294 -1.151 0.689 1.00 . A A . 1 SER CB 1 1 3 882 1 1 1 SER H1 H -10.545 -1.858 3.187 1.00 . A A . 1 SER H1 1 1 3 883 1 1 1 SER H2 H -10.786 -3.217 2.283 1.00 . A A . 1 SER H2 1 1 3 884 1 1 1 SER H3 H -9.266 -2.817 2.782 1.00 . A A . 1 SER H3 1 1 3 885 1 1 1 SER HA H -9.538 -2.339 0.493 1.00 . A A . 1 SER HA 1 1 3 886 1 1 1 SER HB2 H -11.110 -0.505 -0.170 1.00 . A A . 1 SER HB2 1 1 3 887 1 1 1 SER HB3 H -11.895 -2.000 0.361 1.00 . A A . 1 SER HB3 1 1 3 888 1 1 1 SER HG H -12.262 -1.040 2.378 1.00 . A A . 1 SER HG 1 1 3 889 1 1 1 SER N N -10.154 -2.452 2.470 1.00 . A A . 1 SER N 1 1 3 890 1 1 1 SER O O -7.775 -0.688 1.091 1.00 . A A . 1 SER O 1 1 3 891 1 1 1 SER OG O -12.023 -0.438 1.669 1.00 . A A . 1 SER OG 1 1 3 892 1 1 2 GLN C C -9.198 2.540 3.507 1.00 . A A . 2 GLN C 1 1 3 893 1 1 2 GLN CA C -8.537 1.712 2.403 1.00 . A A . 2 GLN CA 1 1 3 894 1 1 2 GLN CB C -8.221 2.555 1.153 1.00 . A A . 2 GLN CB 1 1 3 895 1 1 2 GLN CD C -10.572 2.599 0.145 1.00 . A A . 2 GLN CD 1 1 3 896 1 1 2 GLN CG C -9.376 3.418 0.620 1.00 . A A . 2 GLN CG 1 1 3 897 1 1 2 GLN H H -10.354 0.624 2.324 1.00 . A A . 2 GLN H 1 1 3 898 1 1 2 GLN HA H -7.594 1.327 2.794 1.00 . A A . 2 GLN HA 1 1 3 899 1 1 2 GLN HB2 H -7.405 3.229 1.407 1.00 . A A . 2 GLN HB2 1 1 3 900 1 1 2 GLN HB3 H -7.869 1.904 0.351 1.00 . A A . 2 GLN HB3 1 1 3 901 1 1 2 GLN HE21 H -11.502 2.815 1.943 1.00 . A A . 2 GLN HE21 1 1 3 902 1 1 2 GLN HE22 H -12.378 1.881 0.745 1.00 . A A . 2 GLN HE22 1 1 3 903 1 1 2 GLN HG2 H -9.698 4.131 1.379 1.00 . A A . 2 GLN HG2 1 1 3 904 1 1 2 GLN HG3 H -9.001 3.989 -0.231 1.00 . A A . 2 GLN HG3 1 1 3 905 1 1 2 GLN N N -9.375 0.568 2.069 1.00 . A A . 2 GLN N 1 1 3 906 1 1 2 GLN NE2 N -11.577 2.438 1.006 1.00 . A A . 2 GLN NE2 1 1 3 907 1 1 2 GLN O O -10.417 2.500 3.669 1.00 . A A . 2 GLN O 1 1 3 908 1 1 2 GLN OE1 O -10.590 2.120 -0.987 1.00 . A A . 2 GLN OE1 1 1 3 909 1 1 3 GLY C C -9.362 5.481 4.830 1.00 . A A . 3 GLY C 1 1 3 910 1 1 3 GLY CA C -8.855 4.136 5.352 1.00 . A A . 3 GLY CA 1 1 3 911 1 1 3 GLY H H -7.393 3.265 4.080 1.00 . A A . 3 GLY H 1 1 3 912 1 1 3 GLY HA2 H -9.653 3.640 5.906 1.00 . A A . 3 GLY HA2 1 1 3 913 1 1 3 GLY HA3 H -8.018 4.303 6.030 1.00 . A A . 3 GLY HA3 1 1 3 914 1 1 3 GLY N N -8.387 3.289 4.264 1.00 . A A . 3 GLY N 1 1 3 915 1 1 3 GLY O O -9.920 5.561 3.737 1.00 . A A . 3 GLY O 1 1 3 916 1 1 4 THR C C -8.461 8.358 4.125 1.00 . A A . 4 THR C 1 1 3 917 1 1 4 THR CA C -9.453 7.911 5.202 1.00 . A A . 4 THR CA 1 1 3 918 1 1 4 THR CB C -9.387 8.853 6.415 1.00 . A A . 4 THR CB 1 1 3 919 1 1 4 THR CG2 C -10.371 8.436 7.513 1.00 . A A . 4 THR CG2 1 1 3 920 1 1 4 THR H H -8.688 6.422 6.501 1.00 . A A . 4 THR H 1 1 3 921 1 1 4 THR HA H -10.463 7.945 4.789 1.00 . A A . 4 THR HA 1 1 3 922 1 1 4 THR HB H -9.649 9.862 6.093 1.00 . A A . 4 THR HB 1 1 3 923 1 1 4 THR HG1 H -8.063 9.450 7.712 1.00 . A A . 4 THR HG1 1 1 3 924 1 1 4 THR HG21 H -10.353 9.174 8.316 1.00 . A A . 4 THR HG21 1 1 3 925 1 1 4 THR HG22 H -11.380 8.385 7.103 1.00 . A A . 4 THR HG22 1 1 3 926 1 1 4 THR HG23 H -10.101 7.463 7.925 1.00 . A A . 4 THR HG23 1 1 3 927 1 1 4 THR N N -9.148 6.547 5.611 1.00 . A A . 4 THR N 1 1 3 928 1 1 4 THR O O -7.445 7.702 3.908 1.00 . A A . 4 THR O 1 1 3 929 1 1 4 THR OG1 O -8.074 8.880 6.938 1.00 . A A . 4 THR OG1 1 1 3 930 1 1 5 THR C C -6.453 10.277 3.063 1.00 . A A . 5 THR C 1 1 3 931 1 1 5 THR CA C -7.845 10.053 2.467 1.00 . A A . 5 THR CA 1 1 3 932 1 1 5 THR CB C -8.461 11.302 1.813 1.00 . A A . 5 THR CB 1 1 3 933 1 1 5 THR CG2 C -8.702 12.472 2.774 1.00 . A A . 5 THR CG2 1 1 3 934 1 1 5 THR H H -9.603 9.977 3.664 1.00 . A A . 5 THR H 1 1 3 935 1 1 5 THR HA H -7.731 9.318 1.676 1.00 . A A . 5 THR HA 1 1 3 936 1 1 5 THR HB H -9.423 11.016 1.384 1.00 . A A . 5 THR HB 1 1 3 937 1 1 5 THR HG1 H -7.536 11.022 0.124 1.00 . A A . 5 THR HG1 1 1 3 938 1 1 5 THR HG21 H -9.257 13.251 2.251 1.00 . A A . 5 THR HG21 1 1 3 939 1 1 5 THR HG22 H -9.284 12.148 3.636 1.00 . A A . 5 THR HG22 1 1 3 940 1 1 5 THR HG23 H -7.755 12.895 3.110 1.00 . A A . 5 THR HG23 1 1 3 941 1 1 5 THR N N -8.745 9.486 3.461 1.00 . A A . 5 THR N 1 1 3 942 1 1 5 THR O O -5.463 9.818 2.496 1.00 . A A . 5 THR O 1 1 3 943 1 1 5 THR OG1 O -7.632 11.738 0.756 1.00 . A A . 5 THR OG1 1 1 3 944 1 1 6 SER C C -4.422 9.904 5.282 1.00 . A A . 6 SER C 1 1 3 945 1 1 6 SER CA C -5.151 11.206 4.943 1.00 . A A . 6 SER CA 1 1 3 946 1 1 6 SER CB C -5.466 12.011 6.209 1.00 . A A . 6 SER CB 1 1 3 947 1 1 6 SER H H -7.248 11.273 4.634 1.00 . A A . 6 SER H 1 1 3 948 1 1 6 SER HA H -4.506 11.813 4.305 1.00 . A A . 6 SER HA 1 1 3 949 1 1 6 SER HB2 H -5.979 12.935 5.937 1.00 . A A . 6 SER HB2 1 1 3 950 1 1 6 SER HB3 H -6.109 11.430 6.871 1.00 . A A . 6 SER HB3 1 1 3 951 1 1 6 SER HG H -3.711 12.848 6.309 1.00 . A A . 6 SER HG 1 1 3 952 1 1 6 SER N N -6.387 10.944 4.222 1.00 . A A . 6 SER N 1 1 3 953 1 1 6 SER O O -3.207 9.824 5.115 1.00 . A A . 6 SER O 1 1 3 954 1 1 6 SER OG O -4.276 12.338 6.895 1.00 . A A . 6 SER OG 1 1 3 955 1 1 7 GLU C C -3.952 6.922 4.911 1.00 . A A . 7 GLU C 1 1 3 956 1 1 7 GLU CA C -4.593 7.603 6.122 1.00 . A A . 7 GLU CA 1 1 3 957 1 1 7 GLU CB C -5.678 6.733 6.774 1.00 . A A . 7 GLU CB 1 1 3 958 1 1 7 GLU CD C -3.978 5.366 8.074 1.00 . A A . 7 GLU CD 1 1 3 959 1 1 7 GLU CG C -5.191 5.329 7.148 1.00 . A A . 7 GLU CG 1 1 3 960 1 1 7 GLU H H -6.159 9.011 5.861 1.00 . A A . 7 GLU H 1 1 3 961 1 1 7 GLU HA H -3.815 7.788 6.864 1.00 . A A . 7 GLU HA 1 1 3 962 1 1 7 GLU HB2 H -6.032 7.231 7.678 1.00 . A A . 7 GLU HB2 1 1 3 963 1 1 7 GLU HB3 H -6.514 6.625 6.086 1.00 . A A . 7 GLU HB3 1 1 3 964 1 1 7 GLU HG2 H -6.001 4.803 7.655 1.00 . A A . 7 GLU HG2 1 1 3 965 1 1 7 GLU HG3 H -4.951 4.778 6.240 1.00 . A A . 7 GLU HG3 1 1 3 966 1 1 7 GLU N N -5.161 8.890 5.751 1.00 . A A . 7 GLU N 1 1 3 967 1 1 7 GLU O O -2.759 6.624 4.942 1.00 . A A . 7 GLU O 1 1 3 968 1 1 7 GLU OE1 O -4.182 5.693 9.263 1.00 . A A . 7 GLU OE1 1 1 3 969 1 1 7 GLU OE2 O -2.869 5.070 7.578 1.00 . A A . 7 GLU OE2 1 1 3 970 1 1 8 TYR C C -3.138 6.653 1.936 1.00 . A A . 8 TYR C 1 1 3 971 1 1 8 TYR CA C -4.226 5.916 2.707 1.00 . A A . 8 TYR CA 1 1 3 972 1 1 8 TYR CB C -5.347 5.378 1.810 1.00 . A A . 8 TYR CB 1 1 3 973 1 1 8 TYR CD1 C -5.562 7.076 -0.074 1.00 . A A . 8 TYR CD1 1 1 3 974 1 1 8 TYR CD2 C -7.549 6.421 1.161 1.00 . A A . 8 TYR CD2 1 1 3 975 1 1 8 TYR CE1 C -6.349 7.887 -0.910 1.00 . A A . 8 TYR CE1 1 1 3 976 1 1 8 TYR CE2 C -8.344 7.189 0.294 1.00 . A A . 8 TYR CE2 1 1 3 977 1 1 8 TYR CG C -6.152 6.381 1.001 1.00 . A A . 8 TYR CG 1 1 3 978 1 1 8 TYR CZ C -7.741 7.945 -0.724 1.00 . A A . 8 TYR CZ 1 1 3 979 1 1 8 TYR H H -5.697 6.956 3.852 1.00 . A A . 8 TYR H 1 1 3 980 1 1 8 TYR HA H -3.737 5.036 3.118 1.00 . A A . 8 TYR HA 1 1 3 981 1 1 8 TYR HB2 H -4.901 4.679 1.102 1.00 . A A . 8 TYR HB2 1 1 3 982 1 1 8 TYR HB3 H -6.019 4.807 2.451 1.00 . A A . 8 TYR HB3 1 1 3 983 1 1 8 TYR HD1 H -4.507 6.983 -0.285 1.00 . A A . 8 TYR HD1 1 1 3 984 1 1 8 TYR HD2 H -8.013 5.852 1.950 1.00 . A A . 8 TYR HD2 1 1 3 985 1 1 8 TYR HE1 H -5.882 8.450 -1.704 1.00 . A A . 8 TYR HE1 1 1 3 986 1 1 8 TYR HE2 H -9.417 7.210 0.424 1.00 . A A . 8 TYR HE2 1 1 3 987 1 1 8 TYR HH H -8.004 9.188 -2.208 1.00 . A A . 8 TYR HH 1 1 3 988 1 1 8 TYR N N -4.729 6.666 3.849 1.00 . A A . 8 TYR N 1 1 3 989 1 1 8 TYR O O -2.293 5.986 1.345 1.00 . A A . 8 TYR O 1 1 3 990 1 1 8 TYR OH O -8.508 8.737 -1.528 1.00 . A A . 8 TYR OH 1 1 3 991 1 1 9 SER C C -0.685 8.316 1.765 1.00 . A A . 9 SER C 1 1 3 992 1 1 9 SER CA C -2.076 8.797 1.338 1.00 . A A . 9 SER CA 1 1 3 993 1 1 9 SER CB C -2.255 10.283 1.663 1.00 . A A . 9 SER CB 1 1 3 994 1 1 9 SER H H -3.883 8.488 2.421 1.00 . A A . 9 SER H 1 1 3 995 1 1 9 SER HA H -2.154 8.699 0.257 1.00 . A A . 9 SER HA 1 1 3 996 1 1 9 SER HB2 H -2.386 10.428 2.734 1.00 . A A . 9 SER HB2 1 1 3 997 1 1 9 SER HB3 H -1.369 10.831 1.339 1.00 . A A . 9 SER HB3 1 1 3 998 1 1 9 SER HG H -4.157 10.353 1.264 1.00 . A A . 9 SER HG 1 1 3 999 1 1 9 SER N N -3.135 7.996 1.948 1.00 . A A . 9 SER N 1 1 3 1000 1 1 9 SER O O 0.252 8.373 0.971 1.00 . A A . 9 SER O 1 1 3 1001 1 1 9 SER OG O -3.364 10.807 0.966 1.00 . A A . 9 SER OG 1 1 3 1002 1 1 10 LYS C C 1.120 6.059 2.757 1.00 . A A . 10 LYS C 1 1 3 1003 1 1 10 LYS CA C 0.707 7.317 3.520 1.00 . A A . 10 LYS CA 1 1 3 1004 1 1 10 LYS CB C 0.607 7.079 5.029 1.00 . A A . 10 LYS CB 1 1 3 1005 1 1 10 LYS CD C 0.913 9.584 5.669 1.00 . A A . 10 LYS CD 1 1 3 1006 1 1 10 LYS CE C 0.490 10.474 4.487 1.00 . A A . 10 LYS CE 1 1 3 1007 1 1 10 LYS CG C 0.090 8.292 5.821 1.00 . A A . 10 LYS CG 1 1 3 1008 1 1 10 LYS H H -1.360 7.782 3.609 1.00 . A A . 10 LYS H 1 1 3 1009 1 1 10 LYS HA H 1.496 8.048 3.354 1.00 . A A . 10 LYS HA 1 1 3 1010 1 1 10 LYS HB2 H -0.064 6.238 5.216 1.00 . A A . 10 LYS HB2 1 1 3 1011 1 1 10 LYS HB3 H 1.595 6.813 5.405 1.00 . A A . 10 LYS HB3 1 1 3 1012 1 1 10 LYS HD2 H 0.751 10.165 6.579 1.00 . A A . 10 LYS HD2 1 1 3 1013 1 1 10 LYS HD3 H 1.976 9.348 5.603 1.00 . A A . 10 LYS HD3 1 1 3 1014 1 1 10 LYS HE2 H 0.837 10.075 3.537 1.00 . A A . 10 LYS HE2 1 1 3 1015 1 1 10 LYS HE3 H -0.596 10.558 4.453 1.00 . A A . 10 LYS HE3 1 1 3 1016 1 1 10 LYS HG2 H -0.953 8.493 5.578 1.00 . A A . 10 LYS HG2 1 1 3 1017 1 1 10 LYS HG3 H 0.124 8.006 6.873 1.00 . A A . 10 LYS HG3 1 1 3 1018 1 1 10 LYS HZ1 H 0.757 12.391 3.830 1.00 . A A . 10 LYS HZ1 1 1 3 1019 1 1 10 LYS HZ2 H 0.727 12.250 5.472 1.00 . A A . 10 LYS HZ2 1 1 3 1020 1 1 10 LYS HZ3 H 2.061 11.774 4.629 1.00 . A A . 10 LYS HZ3 1 1 3 1021 1 1 10 LYS N N -0.550 7.831 3.005 1.00 . A A . 10 LYS N 1 1 3 1022 1 1 10 LYS NZ N 1.053 11.828 4.615 1.00 . A A . 10 LYS NZ 1 1 3 1023 1 1 10 LYS O O 2.207 6.032 2.188 1.00 . A A . 10 LYS O 1 1 3 1024 1 1 11 TYR C C 0.162 3.826 0.542 1.00 . A A . 11 TYR C 1 1 3 1025 1 1 11 TYR CA C 0.550 3.780 2.018 1.00 . A A . 11 TYR CA 1 1 3 1026 1 1 11 TYR CB C -0.051 2.608 2.789 1.00 . A A . 11 TYR CB 1 1 3 1027 1 1 11 TYR CD1 C -2.516 2.359 2.217 1.00 . A A . 11 TYR CD1 1 1 3 1028 1 1 11 TYR CD2 C -1.888 2.940 4.494 1.00 . A A . 11 TYR CD2 1 1 3 1029 1 1 11 TYR CE1 C -3.866 2.286 2.609 1.00 . A A . 11 TYR CE1 1 1 3 1030 1 1 11 TYR CE2 C -3.231 2.832 4.892 1.00 . A A . 11 TYR CE2 1 1 3 1031 1 1 11 TYR CG C -1.523 2.698 3.156 1.00 . A A . 11 TYR CG 1 1 3 1032 1 1 11 TYR CZ C -4.225 2.530 3.946 1.00 . A A . 11 TYR CZ 1 1 3 1033 1 1 11 TYR H H -0.679 5.153 3.051 1.00 . A A . 11 TYR H 1 1 3 1034 1 1 11 TYR HA H 1.624 3.609 2.009 1.00 . A A . 11 TYR HA 1 1 3 1035 1 1 11 TYR HB2 H 0.123 1.705 2.209 1.00 . A A . 11 TYR HB2 1 1 3 1036 1 1 11 TYR HB3 H 0.530 2.537 3.709 1.00 . A A . 11 TYR HB3 1 1 3 1037 1 1 11 TYR HD1 H -2.251 2.135 1.196 1.00 . A A . 11 TYR HD1 1 1 3 1038 1 1 11 TYR HD2 H -1.136 3.188 5.230 1.00 . A A . 11 TYR HD2 1 1 3 1039 1 1 11 TYR HE1 H -4.625 2.039 1.882 1.00 . A A . 11 TYR HE1 1 1 3 1040 1 1 11 TYR HE2 H -3.491 2.975 5.930 1.00 . A A . 11 TYR HE2 1 1 3 1041 1 1 11 TYR HH H -5.657 2.620 5.265 1.00 . A A . 11 TYR HH 1 1 3 1042 1 1 11 TYR N N 0.259 5.034 2.704 1.00 . A A . 11 TYR N 1 1 3 1043 1 1 11 TYR O O -0.092 2.799 -0.083 1.00 . A A . 11 TYR O 1 1 3 1044 1 1 11 TYR OH O -5.535 2.480 4.323 1.00 . A A . 11 TYR OH 1 1 3 1045 1 1 12 LEU C C 1.293 6.103 -1.841 1.00 . A A . 12 LEU C 1 1 3 1046 1 1 12 LEU CA C 0.020 5.370 -1.400 1.00 . A A . 12 LEU CA 1 1 3 1047 1 1 12 LEU CB C -1.253 6.208 -1.536 1.00 . A A . 12 LEU CB 1 1 3 1048 1 1 12 LEU CD1 C -1.478 5.907 -4.050 1.00 . A A . 12 LEU CD1 1 1 3 1049 1 1 12 LEU CD2 C -2.755 7.699 -2.872 1.00 . A A . 12 LEU CD2 1 1 3 1050 1 1 12 LEU CG C -1.442 6.907 -2.888 1.00 . A A . 12 LEU CG 1 1 3 1051 1 1 12 LEU H H 0.351 5.826 0.600 1.00 . A A . 12 LEU H 1 1 3 1052 1 1 12 LEU HA H -0.094 4.451 -1.968 1.00 . A A . 12 LEU HA 1 1 3 1053 1 1 12 LEU HB2 H -2.103 5.554 -1.326 1.00 . A A . 12 LEU HB2 1 1 3 1054 1 1 12 LEU HB3 H -1.212 6.975 -0.769 1.00 . A A . 12 LEU HB3 1 1 3 1055 1 1 12 LEU HD11 H -0.533 5.373 -4.131 1.00 . A A . 12 LEU HD11 1 1 3 1056 1 1 12 LEU HD12 H -2.281 5.186 -3.894 1.00 . A A . 12 LEU HD12 1 1 3 1057 1 1 12 LEU HD13 H -1.655 6.438 -4.985 1.00 . A A . 12 LEU HD13 1 1 3 1058 1 1 12 LEU HD21 H -3.598 7.023 -2.727 1.00 . A A . 12 LEU HD21 1 1 3 1059 1 1 12 LEU HD22 H -2.739 8.431 -2.065 1.00 . A A . 12 LEU HD22 1 1 3 1060 1 1 12 LEU HD23 H -2.879 8.226 -3.819 1.00 . A A . 12 LEU HD23 1 1 3 1061 1 1 12 LEU HG H -0.626 7.619 -3.026 1.00 . A A . 12 LEU HG 1 1 3 1062 1 1 12 LEU N N 0.178 5.041 -0.005 1.00 . A A . 12 LEU N 1 1 3 1063 1 1 12 LEU O O 1.749 5.924 -2.968 1.00 . A A . 12 LEU O 1 1 3 1064 1 1 13 ASP C C 4.274 6.498 -1.316 1.00 . A A . 13 ASP C 1 1 3 1065 1 1 13 ASP CA C 3.170 7.547 -1.132 1.00 . A A . 13 ASP CA 1 1 3 1066 1 1 13 ASP CB C 3.433 8.482 0.055 1.00 . A A . 13 ASP CB 1 1 3 1067 1 1 13 ASP CG C 4.686 9.331 -0.143 1.00 . A A . 13 ASP CG 1 1 3 1068 1 1 13 ASP H H 1.454 7.033 -0.030 1.00 . A A . 13 ASP H 1 1 3 1069 1 1 13 ASP HA H 3.106 8.149 -2.041 1.00 . A A . 13 ASP HA 1 1 3 1070 1 1 13 ASP HB2 H 2.578 9.152 0.168 1.00 . A A . 13 ASP HB2 1 1 3 1071 1 1 13 ASP HB3 H 3.525 7.893 0.967 1.00 . A A . 13 ASP HB3 1 1 3 1072 1 1 13 ASP N N 1.885 6.898 -0.936 1.00 . A A . 13 ASP N 1 1 3 1073 1 1 13 ASP O O 4.111 5.331 -0.956 1.00 . A A . 13 ASP O 1 1 3 1074 1 1 13 ASP OD1 O 4.562 10.381 -0.810 1.00 . A A . 13 ASP OD1 1 1 3 1075 1 1 13 ASP OD2 O 5.747 8.914 0.370 1.00 . A A . 13 ASP OD2 1 1 3 1076 1 1 14 SER C C 7.473 5.813 -1.265 1.00 . A A . 14 SER C 1 1 3 1077 1 1 14 SER CA C 6.448 6.032 -2.369 1.00 . A A . 14 SER CA 1 1 3 1078 1 1 14 SER CB C 7.095 6.601 -3.627 1.00 . A A . 14 SER CB 1 1 3 1079 1 1 14 SER H H 5.485 7.893 -2.152 1.00 . A A . 14 SER H 1 1 3 1080 1 1 14 SER HA H 6.021 5.070 -2.651 1.00 . A A . 14 SER HA 1 1 3 1081 1 1 14 SER HB2 H 7.942 5.969 -3.894 1.00 . A A . 14 SER HB2 1 1 3 1082 1 1 14 SER HB3 H 6.357 6.585 -4.427 1.00 . A A . 14 SER HB3 1 1 3 1083 1 1 14 SER HG H 8.137 7.927 -2.666 1.00 . A A . 14 SER HG 1 1 3 1084 1 1 14 SER N N 5.385 6.915 -1.933 1.00 . A A . 14 SER N 1 1 3 1085 1 1 14 SER O O 8.482 6.508 -1.163 1.00 . A A . 14 SER O 1 1 3 1086 1 1 14 SER OG O 7.527 7.929 -3.411 1.00 . A A . 14 SER OG 1 1 3 1087 1 1 15 ARG C C 7.263 3.136 1.232 1.00 . A A . 15 ARG C 1 1 3 1088 1 1 15 ARG CA C 8.026 4.292 0.600 1.00 . A A . 15 ARG CA 1 1 3 1089 1 1 15 ARG CB C 8.324 5.423 1.593 1.00 . A A . 15 ARG CB 1 1 3 1090 1 1 15 ARG CD C 10.046 4.056 2.904 1.00 . A A . 15 ARG CD 1 1 3 1091 1 1 15 ARG CG C 8.793 4.935 2.967 1.00 . A A . 15 ARG CG 1 1 3 1092 1 1 15 ARG CZ C 11.167 4.422 5.111 1.00 . A A . 15 ARG CZ 1 1 3 1093 1 1 15 ARG H H 6.298 4.329 -0.609 1.00 . A A . 15 ARG H 1 1 3 1094 1 1 15 ARG HA H 8.959 3.920 0.173 1.00 . A A . 15 ARG HA 1 1 3 1095 1 1 15 ARG HB2 H 9.081 6.079 1.163 1.00 . A A . 15 ARG HB2 1 1 3 1096 1 1 15 ARG HB3 H 7.417 6.009 1.750 1.00 . A A . 15 ARG HB3 1 1 3 1097 1 1 15 ARG HD2 H 9.831 3.143 2.350 1.00 . A A . 15 ARG HD2 1 1 3 1098 1 1 15 ARG HD3 H 10.847 4.585 2.388 1.00 . A A . 15 ARG HD3 1 1 3 1099 1 1 15 ARG HE H 10.229 2.719 4.540 1.00 . A A . 15 ARG HE 1 1 3 1100 1 1 15 ARG HG2 H 9.001 5.819 3.567 1.00 . A A . 15 ARG HG2 1 1 3 1101 1 1 15 ARG HG3 H 7.991 4.378 3.449 1.00 . A A . 15 ARG HG3 1 1 3 1102 1 1 15 ARG HH11 H 11.287 6.061 3.892 1.00 . A A . 15 ARG HH11 1 1 3 1103 1 1 15 ARG HH12 H 12.051 6.231 5.454 1.00 . A A . 15 ARG HH12 1 1 3 1104 1 1 15 ARG HH21 H 11.230 2.987 6.563 1.00 . A A . 15 ARG HH21 1 1 3 1105 1 1 15 ARG HH22 H 12.017 4.495 6.966 1.00 . A A . 15 ARG HH22 1 1 3 1106 1 1 15 ARG N N 7.177 4.802 -0.454 1.00 . A A . 15 ARG N 1 1 3 1107 1 1 15 ARG NE N 10.477 3.654 4.249 1.00 . A A . 15 ARG NE 1 1 3 1108 1 1 15 ARG NH1 N 11.532 5.673 4.791 1.00 . A A . 15 ARG NH1 1 1 3 1109 1 1 15 ARG NH2 N 11.498 3.927 6.311 1.00 . A A . 15 ARG NH2 1 1 3 1110 1 1 15 ARG O O 7.749 2.010 1.302 1.00 . A A . 15 ARG O 1 1 3 1111 1 1 16 ARG C C 4.550 1.574 1.320 1.00 . A A . 16 ARG C 1 1 3 1112 1 1 16 ARG CA C 5.172 2.497 2.352 1.00 . A A . 16 ARG CA 1 1 3 1113 1 1 16 ARG CB C 4.109 3.265 3.128 1.00 . A A . 16 ARG CB 1 1 3 1114 1 1 16 ARG CD C 4.049 5.096 4.860 1.00 . A A . 16 ARG CD 1 1 3 1115 1 1 16 ARG CG C 4.719 3.794 4.425 1.00 . A A . 16 ARG CG 1 1 3 1116 1 1 16 ARG CZ C 5.554 6.914 4.029 1.00 . A A . 16 ARG CZ 1 1 3 1117 1 1 16 ARG H H 5.699 4.376 1.469 1.00 . A A . 16 ARG H 1 1 3 1118 1 1 16 ARG HA H 5.748 1.888 3.052 1.00 . A A . 16 ARG HA 1 1 3 1119 1 1 16 ARG HB2 H 3.759 4.083 2.502 1.00 . A A . 16 ARG HB2 1 1 3 1120 1 1 16 ARG HB3 H 3.271 2.612 3.377 1.00 . A A . 16 ARG HB3 1 1 3 1121 1 1 16 ARG HD2 H 2.969 4.954 4.837 1.00 . A A . 16 ARG HD2 1 1 3 1122 1 1 16 ARG HD3 H 4.343 5.332 5.883 1.00 . A A . 16 ARG HD3 1 1 3 1123 1 1 16 ARG HE H 3.748 6.433 3.235 1.00 . A A . 16 ARG HE 1 1 3 1124 1 1 16 ARG HG2 H 4.586 3.027 5.188 1.00 . A A . 16 ARG HG2 1 1 3 1125 1 1 16 ARG HG3 H 5.784 3.972 4.286 1.00 . A A . 16 ARG HG3 1 1 3 1126 1 1 16 ARG HH11 H 6.360 5.888 5.605 1.00 . A A . 16 ARG HH11 1 1 3 1127 1 1 16 ARG HH12 H 7.342 7.188 4.975 1.00 . A A . 16 ARG HH12 1 1 3 1128 1 1 16 ARG HH21 H 5.068 8.124 2.455 1.00 . A A . 16 ARG HH21 1 1 3 1129 1 1 16 ARG HH22 H 6.614 8.448 3.200 1.00 . A A . 16 ARG HH22 1 1 3 1130 1 1 16 ARG N N 6.045 3.444 1.677 1.00 . A A . 16 ARG N 1 1 3 1131 1 1 16 ARG NE N 4.413 6.206 3.965 1.00 . A A . 16 ARG NE 1 1 3 1132 1 1 16 ARG NH1 N 6.493 6.642 4.946 1.00 . A A . 16 ARG NH1 1 1 3 1133 1 1 16 ARG NH2 N 5.760 7.911 3.159 1.00 . A A . 16 ARG NH2 1 1 3 1134 1 1 16 ARG O O 4.589 0.357 1.478 1.00 . A A . 16 ARG O 1 1 3 1135 1 1 17 ALA C C 4.645 0.507 -1.455 1.00 . A A . 17 ALA C 1 1 3 1136 1 1 17 ALA CA C 3.534 1.400 -0.893 1.00 . A A . 17 ALA CA 1 1 3 1137 1 1 17 ALA CB C 3.012 2.366 -1.955 1.00 . A A . 17 ALA CB 1 1 3 1138 1 1 17 ALA H H 4.000 3.167 0.182 1.00 . A A . 17 ALA H 1 1 3 1139 1 1 17 ALA HA H 2.704 0.771 -0.568 1.00 . A A . 17 ALA HA 1 1 3 1140 1 1 17 ALA HB1 H 2.199 2.960 -1.539 1.00 . A A . 17 ALA HB1 1 1 3 1141 1 1 17 ALA HB2 H 3.810 3.034 -2.272 1.00 . A A . 17 ALA HB2 1 1 3 1142 1 1 17 ALA HB3 H 2.646 1.802 -2.813 1.00 . A A . 17 ALA HB3 1 1 3 1143 1 1 17 ALA N N 4.017 2.158 0.244 1.00 . A A . 17 ALA N 1 1 3 1144 1 1 17 ALA O O 4.372 -0.622 -1.853 1.00 . A A . 17 ALA O 1 1 3 1145 1 1 18 GLN C C 7.364 -0.939 -1.118 1.00 . A A . 18 GLN C 1 1 3 1146 1 1 18 GLN CA C 7.008 0.228 -2.033 1.00 . A A . 18 GLN CA 1 1 3 1147 1 1 18 GLN CB C 8.256 1.096 -2.262 1.00 . A A . 18 GLN CB 1 1 3 1148 1 1 18 GLN CD C 7.097 2.253 -4.221 1.00 . A A . 18 GLN CD 1 1 3 1149 1 1 18 GLN CG C 8.008 2.409 -3.010 1.00 . A A . 18 GLN CG 1 1 3 1150 1 1 18 GLN H H 6.085 1.889 -1.047 1.00 . A A . 18 GLN H 1 1 3 1151 1 1 18 GLN HA H 6.691 -0.192 -2.989 1.00 . A A . 18 GLN HA 1 1 3 1152 1 1 18 GLN HB2 H 8.713 1.341 -1.302 1.00 . A A . 18 GLN HB2 1 1 3 1153 1 1 18 GLN HB3 H 8.971 0.505 -2.836 1.00 . A A . 18 GLN HB3 1 1 3 1154 1 1 18 GLN HE21 H 5.591 3.156 -3.213 1.00 . A A . 18 GLN HE21 1 1 3 1155 1 1 18 GLN HE22 H 5.206 2.671 -4.858 1.00 . A A . 18 GLN HE22 1 1 3 1156 1 1 18 GLN HG2 H 7.556 3.113 -2.318 1.00 . A A . 18 GLN HG2 1 1 3 1157 1 1 18 GLN HG3 H 8.965 2.820 -3.332 1.00 . A A . 18 GLN HG3 1 1 3 1158 1 1 18 GLN N N 5.896 0.993 -1.476 1.00 . A A . 18 GLN N 1 1 3 1159 1 1 18 GLN NE2 N 5.860 2.735 -4.092 1.00 . A A . 18 GLN NE2 1 1 3 1160 1 1 18 GLN O O 7.633 -2.036 -1.598 1.00 . A A . 18 GLN O 1 1 3 1161 1 1 18 GLN OE1 O 7.500 1.715 -5.249 1.00 . A A . 18 GLN OE1 1 1 3 1162 1 1 19 ASP C C 6.611 -2.809 1.140 1.00 . A A . 19 ASP C 1 1 3 1163 1 1 19 ASP CA C 7.661 -1.702 1.200 1.00 . A A . 19 ASP CA 1 1 3 1164 1 1 19 ASP CB C 7.707 -1.046 2.585 1.00 . A A . 19 ASP CB 1 1 3 1165 1 1 19 ASP CG C 8.010 -2.067 3.679 1.00 . A A . 19 ASP CG 1 1 3 1166 1 1 19 ASP H H 7.096 0.230 0.511 1.00 . A A . 19 ASP H 1 1 3 1167 1 1 19 ASP HA H 8.642 -2.130 0.988 1.00 . A A . 19 ASP HA 1 1 3 1168 1 1 19 ASP HB2 H 8.485 -0.282 2.594 1.00 . A A . 19 ASP HB2 1 1 3 1169 1 1 19 ASP HB3 H 6.751 -0.566 2.798 1.00 . A A . 19 ASP HB3 1 1 3 1170 1 1 19 ASP N N 7.364 -0.693 0.195 1.00 . A A . 19 ASP N 1 1 3 1171 1 1 19 ASP O O 6.946 -3.991 1.165 1.00 . A A . 19 ASP O 1 1 3 1172 1 1 19 ASP OD1 O 9.191 -2.465 3.774 1.00 . A A . 19 ASP OD1 1 1 3 1173 1 1 19 ASP OD2 O 7.055 -2.434 4.399 1.00 . A A . 19 ASP OD2 1 1 3 1174 1 1 20 PHE C C 4.255 -4.138 -0.311 1.00 . A A . 20 PHE C 1 1 3 1175 1 1 20 PHE CA C 4.211 -3.326 0.984 1.00 . A A . 20 PHE CA 1 1 3 1176 1 1 20 PHE CB C 2.897 -2.546 1.122 1.00 . A A . 20 PHE CB 1 1 3 1177 1 1 20 PHE CD1 C 3.546 -1.894 3.528 1.00 . A A . 20 PHE CD1 1 1 3 1178 1 1 20 PHE CD2 C 1.446 -1.102 2.592 1.00 . A A . 20 PHE CD2 1 1 3 1179 1 1 20 PHE CE1 C 3.257 -1.230 4.733 1.00 . A A . 20 PHE CE1 1 1 3 1180 1 1 20 PHE CE2 C 1.134 -0.486 3.816 1.00 . A A . 20 PHE CE2 1 1 3 1181 1 1 20 PHE CG C 2.641 -1.831 2.445 1.00 . A A . 20 PHE CG 1 1 3 1182 1 1 20 PHE CZ C 2.048 -0.532 4.881 1.00 . A A . 20 PHE CZ 1 1 3 1183 1 1 20 PHE H H 5.136 -1.423 1.047 1.00 . A A . 20 PHE H 1 1 3 1184 1 1 20 PHE HA H 4.273 -4.032 1.814 1.00 . A A . 20 PHE HA 1 1 3 1185 1 1 20 PHE HB2 H 2.848 -1.808 0.320 1.00 . A A . 20 PHE HB2 1 1 3 1186 1 1 20 PHE HB3 H 2.078 -3.253 0.976 1.00 . A A . 20 PHE HB3 1 1 3 1187 1 1 20 PHE HD1 H 4.474 -2.439 3.466 1.00 . A A . 20 PHE HD1 1 1 3 1188 1 1 20 PHE HD2 H 0.759 -1.020 1.763 1.00 . A A . 20 PHE HD2 1 1 3 1189 1 1 20 PHE HE1 H 3.963 -1.267 5.550 1.00 . A A . 20 PHE HE1 1 1 3 1190 1 1 20 PHE HE2 H 0.188 0.020 3.943 1.00 . A A . 20 PHE HE2 1 1 3 1191 1 1 20 PHE HZ H 1.819 -0.037 5.814 1.00 . A A . 20 PHE HZ 1 1 3 1192 1 1 20 PHE N N 5.338 -2.414 1.051 1.00 . A A . 20 PHE N 1 1 3 1193 1 1 20 PHE O O 3.953 -5.329 -0.286 1.00 . A A . 20 PHE O 1 1 3 1194 1 1 21 VAL C C 5.922 -5.269 -2.578 1.00 . A A . 21 VAL C 1 1 3 1195 1 1 21 VAL CA C 4.781 -4.261 -2.690 1.00 . A A . 21 VAL CA 1 1 3 1196 1 1 21 VAL CB C 4.935 -3.295 -3.879 1.00 . A A . 21 VAL CB 1 1 3 1197 1 1 21 VAL CG1 C 5.445 -4.004 -5.142 1.00 . A A . 21 VAL CG1 1 1 3 1198 1 1 21 VAL CG2 C 3.576 -2.660 -4.207 1.00 . A A . 21 VAL CG2 1 1 3 1199 1 1 21 VAL H H 4.889 -2.539 -1.429 1.00 . A A . 21 VAL H 1 1 3 1200 1 1 21 VAL HA H 3.875 -4.848 -2.837 1.00 . A A . 21 VAL HA 1 1 3 1201 1 1 21 VAL HB H 5.646 -2.510 -3.618 1.00 . A A . 21 VAL HB 1 1 3 1202 1 1 21 VAL HG11 H 6.469 -4.349 -5.003 1.00 . A A . 21 VAL HG11 1 1 3 1203 1 1 21 VAL HG12 H 4.806 -4.856 -5.378 1.00 . A A . 21 VAL HG12 1 1 3 1204 1 1 21 VAL HG13 H 5.433 -3.308 -5.982 1.00 . A A . 21 VAL HG13 1 1 3 1205 1 1 21 VAL HG21 H 3.123 -2.229 -3.317 1.00 . A A . 21 VAL HG21 1 1 3 1206 1 1 21 VAL HG22 H 3.708 -1.875 -4.952 1.00 . A A . 21 VAL HG22 1 1 3 1207 1 1 21 VAL HG23 H 2.900 -3.417 -4.606 1.00 . A A . 21 VAL HG23 1 1 3 1208 1 1 21 VAL N N 4.642 -3.525 -1.439 1.00 . A A . 21 VAL N 1 1 3 1209 1 1 21 VAL O O 5.729 -6.443 -2.881 1.00 . A A . 21 VAL O 1 1 3 1210 1 1 22 GLN C C 7.896 -6.863 -1.002 1.00 . A A . 22 GLN C 1 1 3 1211 1 1 22 GLN CA C 8.252 -5.683 -1.912 1.00 . A A . 22 GLN CA 1 1 3 1212 1 1 22 GLN CB C 9.402 -4.846 -1.331 1.00 . A A . 22 GLN CB 1 1 3 1213 1 1 22 GLN CD C 11.251 -6.281 -2.339 1.00 . A A . 22 GLN CD 1 1 3 1214 1 1 22 GLN CG C 10.687 -5.644 -1.070 1.00 . A A . 22 GLN CG 1 1 3 1215 1 1 22 GLN H H 7.194 -3.844 -1.898 1.00 . A A . 22 GLN H 1 1 3 1216 1 1 22 GLN HA H 8.556 -6.070 -2.885 1.00 . A A . 22 GLN HA 1 1 3 1217 1 1 22 GLN HB2 H 9.634 -4.038 -2.027 1.00 . A A . 22 GLN HB2 1 1 3 1218 1 1 22 GLN HB3 H 9.082 -4.405 -0.387 1.00 . A A . 22 GLN HB3 1 1 3 1219 1 1 22 GLN HE21 H 10.214 -8.000 -2.006 1.00 . A A . 22 GLN HE21 1 1 3 1220 1 1 22 GLN HE22 H 11.211 -7.984 -3.451 1.00 . A A . 22 GLN HE22 1 1 3 1221 1 1 22 GLN HG2 H 11.436 -4.958 -0.672 1.00 . A A . 22 GLN HG2 1 1 3 1222 1 1 22 GLN HG3 H 10.507 -6.411 -0.316 1.00 . A A . 22 GLN HG3 1 1 3 1223 1 1 22 GLN N N 7.099 -4.823 -2.129 1.00 . A A . 22 GLN N 1 1 3 1224 1 1 22 GLN NE2 N 10.864 -7.526 -2.622 1.00 . A A . 22 GLN NE2 1 1 3 1225 1 1 22 GLN O O 8.369 -7.975 -1.225 1.00 . A A . 22 GLN O 1 1 3 1226 1 1 22 GLN OE1 O 12.030 -5.657 -3.055 1.00 . A A . 22 GLN OE1 1 1 3 1227 1 1 23 TRP C C 5.801 -8.683 0.278 1.00 . A A . 23 TRP C 1 1 3 1228 1 1 23 TRP CA C 6.680 -7.648 0.971 1.00 . A A . 23 TRP CA 1 1 3 1229 1 1 23 TRP CB C 5.946 -6.983 2.135 1.00 . A A . 23 TRP CB 1 1 3 1230 1 1 23 TRP CD1 C 5.647 -8.850 3.798 1.00 . A A . 23 TRP CD1 1 1 3 1231 1 1 23 TRP CD2 C 3.716 -8.185 2.891 1.00 . A A . 23 TRP CD2 1 1 3 1232 1 1 23 TRP CE2 C 3.407 -9.256 3.776 1.00 . A A . 23 TRP CE2 1 1 3 1233 1 1 23 TRP CE3 C 2.661 -7.645 2.130 1.00 . A A . 23 TRP CE3 1 1 3 1234 1 1 23 TRP CG C 5.143 -7.930 2.956 1.00 . A A . 23 TRP CG 1 1 3 1235 1 1 23 TRP CH2 C 1.068 -9.174 3.170 1.00 . A A . 23 TRP CH2 1 1 3 1236 1 1 23 TRP CZ2 C 2.103 -9.747 3.925 1.00 . A A . 23 TRP CZ2 1 1 3 1237 1 1 23 TRP CZ3 C 1.347 -8.129 2.269 1.00 . A A . 23 TRP CZ3 1 1 3 1238 1 1 23 TRP H H 6.571 -5.744 0.086 1.00 . A A . 23 TRP H 1 1 3 1239 1 1 23 TRP HA H 7.575 -8.140 1.357 1.00 . A A . 23 TRP HA 1 1 3 1240 1 1 23 TRP HB2 H 6.665 -6.470 2.773 1.00 . A A . 23 TRP HB2 1 1 3 1241 1 1 23 TRP HB3 H 5.254 -6.237 1.748 1.00 . A A . 23 TRP HB3 1 1 3 1242 1 1 23 TRP HD1 H 6.704 -8.964 3.972 1.00 . A A . 23 TRP HD1 1 1 3 1243 1 1 23 TRP HE1 H 4.722 -10.367 4.988 1.00 . A A . 23 TRP HE1 1 1 3 1244 1 1 23 TRP HE3 H 2.899 -6.865 1.419 1.00 . A A . 23 TRP HE3 1 1 3 1245 1 1 23 TRP HH2 H 0.061 -9.545 3.279 1.00 . A A . 23 TRP HH2 1 1 3 1246 1 1 23 TRP HZ2 H 1.899 -10.562 4.605 1.00 . A A . 23 TRP HZ2 1 1 3 1247 1 1 23 TRP HZ3 H 0.551 -7.700 1.679 1.00 . A A . 23 TRP HZ3 1 1 3 1248 1 1 23 TRP N N 7.052 -6.632 0.010 1.00 . A A . 23 TRP N 1 1 3 1249 1 1 23 TRP NE1 N 4.623 -9.613 4.325 1.00 . A A . 23 TRP NE1 1 1 3 1250 1 1 23 TRP O O 6.127 -9.867 0.269 1.00 . A A . 23 TRP O 1 1 3 1251 1 1 24 LEU C C 4.453 -9.874 -2.101 1.00 . A A . 24 LEU C 1 1 3 1252 1 1 24 LEU CA C 3.739 -8.998 -1.068 1.00 . A A . 24 LEU CA 1 1 3 1253 1 1 24 LEU CB C 2.753 -8.035 -1.740 1.00 . A A . 24 LEU CB 1 1 3 1254 1 1 24 LEU CD1 C 0.782 -9.647 -1.694 1.00 . A A . 24 LEU CD1 1 1 3 1255 1 1 24 LEU CD2 C 0.768 -7.654 -3.207 1.00 . A A . 24 LEU CD2 1 1 3 1256 1 1 24 LEU CG C 1.651 -8.727 -2.560 1.00 . A A . 24 LEU CG 1 1 3 1257 1 1 24 LEU H H 4.510 -7.220 -0.214 1.00 . A A . 24 LEU H 1 1 3 1258 1 1 24 LEU HA H 3.199 -9.627 -0.362 1.00 . A A . 24 LEU HA 1 1 3 1259 1 1 24 LEU HB2 H 2.287 -7.423 -0.968 1.00 . A A . 24 LEU HB2 1 1 3 1260 1 1 24 LEU HB3 H 3.316 -7.376 -2.402 1.00 . A A . 24 LEU HB3 1 1 3 1261 1 1 24 LEU HD11 H 0.386 -9.095 -0.841 1.00 . A A . 24 LEU HD11 1 1 3 1262 1 1 24 LEU HD12 H -0.050 -10.029 -2.287 1.00 . A A . 24 LEU HD12 1 1 3 1263 1 1 24 LEU HD13 H 1.362 -10.497 -1.337 1.00 . A A . 24 LEU HD13 1 1 3 1264 1 1 24 LEU HD21 H 0.288 -7.050 -2.437 1.00 . A A . 24 LEU HD21 1 1 3 1265 1 1 24 LEU HD22 H 1.376 -7.008 -3.842 1.00 . A A . 24 LEU HD22 1 1 3 1266 1 1 24 LEU HD23 H 0.001 -8.127 -3.821 1.00 . A A . 24 LEU HD23 1 1 3 1267 1 1 24 LEU HG H 2.101 -9.316 -3.360 1.00 . A A . 24 LEU HG 1 1 3 1268 1 1 24 LEU N N 4.695 -8.210 -0.305 1.00 . A A . 24 LEU N 1 1 3 1269 1 1 24 LEU O O 4.074 -11.024 -2.315 1.00 . A A . 24 LEU O 1 1 3 1270 1 1 25 MET C C 7.106 -11.145 -3.058 1.00 . A A . 25 MET C 1 1 3 1271 1 1 25 MET CA C 6.314 -10.012 -3.710 1.00 . A A . 25 MET CA 1 1 3 1272 1 1 25 MET CB C 7.262 -9.024 -4.396 1.00 . A A . 25 MET CB 1 1 3 1273 1 1 25 MET CE C 5.260 -7.672 -7.836 1.00 . A A . 25 MET CE 1 1 3 1274 1 1 25 MET CG C 6.546 -8.160 -5.440 1.00 . A A . 25 MET CG 1 1 3 1275 1 1 25 MET H H 5.741 -8.370 -2.473 1.00 . A A . 25 MET H 1 1 3 1276 1 1 25 MET HA H 5.655 -10.450 -4.461 1.00 . A A . 25 MET HA 1 1 3 1277 1 1 25 MET HB2 H 7.714 -8.386 -3.639 1.00 . A A . 25 MET HB2 1 1 3 1278 1 1 25 MET HB3 H 8.057 -9.583 -4.890 1.00 . A A . 25 MET HB3 1 1 3 1279 1 1 25 MET HE1 H 4.891 -8.033 -8.796 1.00 . A A . 25 MET HE1 1 1 3 1280 1 1 25 MET HE2 H 4.426 -7.284 -7.252 1.00 . A A . 25 MET HE2 1 1 3 1281 1 1 25 MET HE3 H 5.988 -6.878 -8.004 1.00 . A A . 25 MET HE3 1 1 3 1282 1 1 25 MET HG2 H 5.653 -7.719 -5.000 1.00 . A A . 25 MET HG2 1 1 3 1283 1 1 25 MET HG3 H 7.220 -7.354 -5.733 1.00 . A A . 25 MET HG3 1 1 3 1284 1 1 25 MET N N 5.495 -9.319 -2.728 1.00 . A A . 25 MET N 1 1 3 1285 1 1 25 MET O O 7.035 -12.279 -3.528 1.00 . A A . 25 MET O 1 1 3 1286 1 1 25 MET SD S 6.045 -9.039 -6.943 1.00 . A A . 25 MET SD 1 1 3 1287 1 1 26 ASN C C 7.782 -13.007 -0.796 1.00 . A A . 26 ASN C 1 1 3 1288 1 1 26 ASN CA C 8.653 -11.846 -1.280 1.00 . A A . 26 ASN CA 1 1 3 1289 1 1 26 ASN CB C 9.404 -11.224 -0.091 1.00 . A A . 26 ASN CB 1 1 3 1290 1 1 26 ASN CG C 10.470 -10.201 -0.486 1.00 . A A . 26 ASN CG 1 1 3 1291 1 1 26 ASN H H 7.872 -9.895 -1.644 1.00 . A A . 26 ASN H 1 1 3 1292 1 1 26 ASN HA H 9.379 -12.262 -1.980 1.00 . A A . 26 ASN HA 1 1 3 1293 1 1 26 ASN HB2 H 8.686 -10.751 0.582 1.00 . A A . 26 ASN HB2 1 1 3 1294 1 1 26 ASN HB3 H 9.906 -12.022 0.457 1.00 . A A . 26 ASN HB3 1 1 3 1295 1 1 26 ASN HD21 H 11.240 -11.418 -1.933 1.00 . A A . 26 ASN HD21 1 1 3 1296 1 1 26 ASN HD22 H 12.023 -9.863 -1.748 1.00 . A A . 26 ASN HD22 1 1 3 1297 1 1 26 ASN N N 7.858 -10.847 -1.988 1.00 . A A . 26 ASN N 1 1 3 1298 1 1 26 ASN ND2 N 11.309 -10.523 -1.472 1.00 . A A . 26 ASN ND2 1 1 3 1299 1 1 26 ASN O O 8.184 -14.163 -0.908 1.00 . A A . 26 ASN O 1 1 3 1300 1 1 26 ASN OD1 O 10.546 -9.126 0.105 1.00 . A A . 26 ASN OD1 1 1 3 1301 1 1 27 THR C C 5.059 -14.513 -0.930 1.00 . A A . 27 THR C 1 1 3 1302 1 1 27 THR CA C 5.661 -13.707 0.226 1.00 . A A . 27 THR CA 1 1 3 1303 1 1 27 THR CB C 4.583 -13.038 1.090 1.00 . A A . 27 THR CB 1 1 3 1304 1 1 27 THR CG2 C 5.210 -12.435 2.349 1.00 . A A . 27 THR CG2 1 1 3 1305 1 1 27 THR H H 6.312 -11.733 -0.196 1.00 . A A . 27 THR H 1 1 3 1306 1 1 27 THR HA H 6.206 -14.406 0.864 1.00 . A A . 27 THR HA 1 1 3 1307 1 1 27 THR HB H 3.848 -13.787 1.388 1.00 . A A . 27 THR HB 1 1 3 1308 1 1 27 THR HG1 H 3.576 -12.349 -0.436 1.00 . A A . 27 THR HG1 1 1 3 1309 1 1 27 THR HG21 H 5.732 -13.208 2.911 1.00 . A A . 27 THR HG21 1 1 3 1310 1 1 27 THR HG22 H 5.917 -11.648 2.090 1.00 . A A . 27 THR HG22 1 1 3 1311 1 1 27 THR HG23 H 4.420 -12.010 2.966 1.00 . A A . 27 THR HG23 1 1 3 1312 1 1 27 THR N N 6.593 -12.704 -0.263 1.00 . A A . 27 THR N 1 1 3 1313 1 1 27 THR O O 4.945 -15.732 -0.837 1.00 . A A . 27 THR O 1 1 3 1314 1 1 27 THR OG1 O 3.929 -12.003 0.388 1.00 . A A . 27 THR OG1 1 1 3 1315 1 1 28 NH2 HN1 H 4.781 -12.841 -2.070 1.00 . A A . 28 NH2 HN1 1 1 3 1316 1 1 28 NH2 HN2 H 4.281 -14.351 -2.801 1.00 . A A . 28 NH2 HN2 1 1 3 1317 1 1 28 NH2 N N 4.673 -13.846 -2.020 1.00 . A A . 28 NH2 N 1 1 4 1318 1 1 1 SER C C -10.549 -4.523 7.074 1.00 . A A . 1 SER C 1 1 4 1319 1 1 1 SER CA C -9.413 -4.415 8.093 1.00 . A A . 1 SER CA 1 1 4 1320 1 1 1 SER CB C -9.837 -3.618 9.333 1.00 . A A . 1 SER CB 1 1 4 1321 1 1 1 SER H1 H -7.926 -4.390 6.687 1.00 . A A . 1 SER H1 1 1 4 1322 1 1 1 SER H2 H -8.390 -2.891 7.202 1.00 . A A . 1 SER H2 1 1 4 1323 1 1 1 SER H3 H -7.451 -3.841 8.169 1.00 . A A . 1 SER H3 1 1 4 1324 1 1 1 SER HA H -9.165 -5.425 8.422 1.00 . A A . 1 SER HA 1 1 4 1325 1 1 1 SER HB2 H -10.768 -4.025 9.730 1.00 . A A . 1 SER HB2 1 1 4 1326 1 1 1 SER HB3 H -9.063 -3.703 10.096 1.00 . A A . 1 SER HB3 1 1 4 1327 1 1 1 SER HG H -10.269 -1.782 9.821 1.00 . A A . 1 SER HG 1 1 4 1328 1 1 1 SER N N -8.199 -3.841 7.490 1.00 . A A . 1 SER N 1 1 4 1329 1 1 1 SER O O -10.993 -5.625 6.755 1.00 . A A . 1 SER O 1 1 4 1330 1 1 1 SER OG O -10.015 -2.250 9.021 1.00 . A A . 1 SER OG 1 1 4 1331 1 1 2 GLN C C -11.680 -3.795 4.234 1.00 . A A . 2 GLN C 1 1 4 1332 1 1 2 GLN CA C -12.112 -3.288 5.613 1.00 . A A . 2 GLN CA 1 1 4 1333 1 1 2 GLN CB C -12.592 -1.835 5.503 1.00 . A A . 2 GLN CB 1 1 4 1334 1 1 2 GLN CD C -13.292 0.261 6.699 1.00 . A A . 2 GLN CD 1 1 4 1335 1 1 2 GLN CG C -13.059 -1.240 6.836 1.00 . A A . 2 GLN CG 1 1 4 1336 1 1 2 GLN H H -10.597 -2.511 6.890 1.00 . A A . 2 GLN H 1 1 4 1337 1 1 2 GLN HA H -12.945 -3.896 5.971 1.00 . A A . 2 GLN HA 1 1 4 1338 1 1 2 GLN HB2 H -11.779 -1.230 5.112 1.00 . A A . 2 GLN HB2 1 1 4 1339 1 1 2 GLN HB3 H -13.422 -1.788 4.797 1.00 . A A . 2 GLN HB3 1 1 4 1340 1 1 2 GLN HE21 H -11.288 0.612 6.688 1.00 . A A . 2 GLN HE21 1 1 4 1341 1 1 2 GLN HE22 H -12.301 2.035 6.543 1.00 . A A . 2 GLN HE22 1 1 4 1342 1 1 2 GLN HG2 H -13.983 -1.731 7.144 1.00 . A A . 2 GLN HG2 1 1 4 1343 1 1 2 GLN HG3 H -12.311 -1.395 7.613 1.00 . A A . 2 GLN HG3 1 1 4 1344 1 1 2 GLN N N -11.013 -3.375 6.567 1.00 . A A . 2 GLN N 1 1 4 1345 1 1 2 GLN NE2 N -12.205 1.034 6.640 1.00 . A A . 2 GLN NE2 1 1 4 1346 1 1 2 GLN O O -12.457 -4.458 3.550 1.00 . A A . 2 GLN O 1 1 4 1347 1 1 2 GLN OE1 O -14.432 0.717 6.644 1.00 . A A . 2 GLN OE1 1 1 4 1348 1 1 3 GLY C C -10.520 -2.760 1.486 1.00 . A A . 3 GLY C 1 1 4 1349 1 1 3 GLY CA C -9.934 -3.748 2.493 1.00 . A A . 3 GLY CA 1 1 4 1350 1 1 3 GLY H H -9.863 -2.929 4.446 1.00 . A A . 3 GLY H 1 1 4 1351 1 1 3 GLY HA2 H -8.849 -3.640 2.505 1.00 . A A . 3 GLY HA2 1 1 4 1352 1 1 3 GLY HA3 H -10.180 -4.771 2.204 1.00 . A A . 3 GLY HA3 1 1 4 1353 1 1 3 GLY N N -10.450 -3.462 3.822 1.00 . A A . 3 GLY N 1 1 4 1354 1 1 3 GLY O O -11.036 -3.160 0.444 1.00 . A A . 3 GLY O 1 1 4 1355 1 1 4 THR C C -9.960 0.788 1.057 1.00 . A A . 4 THR C 1 1 4 1356 1 1 4 THR CA C -10.987 -0.351 1.064 1.00 . A A . 4 THR CA 1 1 4 1357 1 1 4 THR CB C -12.326 0.084 1.691 1.00 . A A . 4 THR CB 1 1 4 1358 1 1 4 THR CG2 C -13.360 -1.048 1.692 1.00 . A A . 4 THR CG2 1 1 4 1359 1 1 4 THR H H -9.990 -1.230 2.694 1.00 . A A . 4 THR H 1 1 4 1360 1 1 4 THR HA H -11.161 -0.646 0.028 1.00 . A A . 4 THR HA 1 1 4 1361 1 1 4 THR HB H -12.754 0.901 1.110 1.00 . A A . 4 THR HB 1 1 4 1362 1 1 4 THR HG1 H -12.971 0.763 3.399 1.00 . A A . 4 THR HG1 1 1 4 1363 1 1 4 THR HG21 H -13.044 -1.863 2.342 1.00 . A A . 4 THR HG21 1 1 4 1364 1 1 4 THR HG22 H -14.315 -0.667 2.053 1.00 . A A . 4 THR HG22 1 1 4 1365 1 1 4 THR HG23 H -13.491 -1.428 0.679 1.00 . A A . 4 THR HG23 1 1 4 1366 1 1 4 THR N N -10.442 -1.468 1.822 1.00 . A A . 4 THR N 1 1 4 1367 1 1 4 THR O O -8.805 0.585 1.434 1.00 . A A . 4 THR O 1 1 4 1368 1 1 4 THR OG1 O -12.121 0.535 3.015 1.00 . A A . 4 THR OG1 1 1 4 1369 1 1 5 THR C C -8.765 3.416 1.835 1.00 . A A . 5 THR C 1 1 4 1370 1 1 5 THR CA C -9.593 3.204 0.569 1.00 . A A . 5 THR CA 1 1 4 1371 1 1 5 THR CB C -10.527 4.387 0.279 1.00 . A A . 5 THR CB 1 1 4 1372 1 1 5 THR CG2 C -9.746 5.667 -0.032 1.00 . A A . 5 THR CG2 1 1 4 1373 1 1 5 THR H H -11.337 2.068 0.299 1.00 . A A . 5 THR H 1 1 4 1374 1 1 5 THR HA H -8.896 3.117 -0.260 1.00 . A A . 5 THR HA 1 1 4 1375 1 1 5 THR HB H -11.174 4.564 1.140 1.00 . A A . 5 THR HB 1 1 4 1376 1 1 5 THR HG1 H -11.920 4.813 -1.014 1.00 . A A . 5 THR HG1 1 1 4 1377 1 1 5 THR HG21 H -9.146 5.963 0.828 1.00 . A A . 5 THR HG21 1 1 4 1378 1 1 5 THR HG22 H -9.094 5.505 -0.891 1.00 . A A . 5 THR HG22 1 1 4 1379 1 1 5 THR HG23 H -10.443 6.473 -0.264 1.00 . A A . 5 THR HG23 1 1 4 1380 1 1 5 THR N N -10.388 1.984 0.631 1.00 . A A . 5 THR N 1 1 4 1381 1 1 5 THR O O -7.565 3.659 1.737 1.00 . A A . 5 THR O 1 1 4 1382 1 1 5 THR OG1 O -11.342 4.068 -0.832 1.00 . A A . 5 THR OG1 1 1 4 1383 1 1 6 SER C C -7.454 2.661 4.412 1.00 . A A . 6 SER C 1 1 4 1384 1 1 6 SER CA C -8.757 3.463 4.310 1.00 . A A . 6 SER CA 1 1 4 1385 1 1 6 SER CB C -9.728 3.034 5.415 1.00 . A A . 6 SER CB 1 1 4 1386 1 1 6 SER H H -10.383 3.079 3.002 1.00 . A A . 6 SER H 1 1 4 1387 1 1 6 SER HA H -8.526 4.520 4.449 1.00 . A A . 6 SER HA 1 1 4 1388 1 1 6 SER HB2 H -9.962 1.976 5.307 1.00 . A A . 6 SER HB2 1 1 4 1389 1 1 6 SER HB3 H -9.262 3.195 6.388 1.00 . A A . 6 SER HB3 1 1 4 1390 1 1 6 SER HG H -11.381 3.576 4.533 1.00 . A A . 6 SER HG 1 1 4 1391 1 1 6 SER N N -9.399 3.304 3.009 1.00 . A A . 6 SER N 1 1 4 1392 1 1 6 SER O O -6.464 3.162 4.942 1.00 . A A . 6 SER O 1 1 4 1393 1 1 6 SER OG O -10.929 3.776 5.356 1.00 . A A . 6 SER OG 1 1 4 1394 1 1 7 GLU C C -5.360 0.817 2.811 1.00 . A A . 7 GLU C 1 1 4 1395 1 1 7 GLU CA C -6.332 0.514 3.949 1.00 . A A . 7 GLU CA 1 1 4 1396 1 1 7 GLU CB C -6.804 -0.948 3.869 1.00 . A A . 7 GLU CB 1 1 4 1397 1 1 7 GLU CD C -8.907 -0.787 5.339 1.00 . A A . 7 GLU CD 1 1 4 1398 1 1 7 GLU CG C -7.541 -1.435 5.124 1.00 . A A . 7 GLU CG 1 1 4 1399 1 1 7 GLU H H -8.304 1.087 3.453 1.00 . A A . 7 GLU H 1 1 4 1400 1 1 7 GLU HA H -5.803 0.641 4.896 1.00 . A A . 7 GLU HA 1 1 4 1401 1 1 7 GLU HB2 H -7.425 -1.105 2.986 1.00 . A A . 7 GLU HB2 1 1 4 1402 1 1 7 GLU HB3 H -5.918 -1.573 3.765 1.00 . A A . 7 GLU HB3 1 1 4 1403 1 1 7 GLU HG2 H -7.696 -2.509 5.022 1.00 . A A . 7 GLU HG2 1 1 4 1404 1 1 7 GLU HG3 H -6.912 -1.257 5.997 1.00 . A A . 7 GLU HG3 1 1 4 1405 1 1 7 GLU N N -7.462 1.424 3.903 1.00 . A A . 7 GLU N 1 1 4 1406 1 1 7 GLU O O -4.206 1.153 3.070 1.00 . A A . 7 GLU O 1 1 4 1407 1 1 7 GLU OE1 O -9.549 -0.449 4.322 1.00 . A A . 7 GLU OE1 1 1 4 1408 1 1 7 GLU OE2 O -9.295 -0.646 6.519 1.00 . A A . 7 GLU OE2 1 1 4 1409 1 1 8 TYR C C -4.217 2.072 0.260 1.00 . A A . 8 TYR C 1 1 4 1410 1 1 8 TYR CA C -4.903 0.721 0.414 1.00 . A A . 8 TYR CA 1 1 4 1411 1 1 8 TYR CB C -5.545 0.229 -0.889 1.00 . A A . 8 TYR CB 1 1 4 1412 1 1 8 TYR CD1 C -6.220 2.309 -2.187 1.00 . A A . 8 TYR CD1 1 1 4 1413 1 1 8 TYR CD2 C -7.923 0.672 -1.609 1.00 . A A . 8 TYR CD2 1 1 4 1414 1 1 8 TYR CE1 C -7.189 3.082 -2.848 1.00 . A A . 8 TYR CE1 1 1 4 1415 1 1 8 TYR CE2 C -8.884 1.421 -2.309 1.00 . A A . 8 TYR CE2 1 1 4 1416 1 1 8 TYR CG C -6.595 1.125 -1.519 1.00 . A A . 8 TYR CG 1 1 4 1417 1 1 8 TYR CZ C -8.523 2.642 -2.906 1.00 . A A . 8 TYR CZ 1 1 4 1418 1 1 8 TYR H H -6.774 0.408 1.397 1.00 . A A . 8 TYR H 1 1 4 1419 1 1 8 TYR HA H -4.103 0.011 0.619 1.00 . A A . 8 TYR HA 1 1 4 1420 1 1 8 TYR HB2 H -4.747 0.101 -1.622 1.00 . A A . 8 TYR HB2 1 1 4 1421 1 1 8 TYR HB3 H -5.969 -0.759 -0.703 1.00 . A A . 8 TYR HB3 1 1 4 1422 1 1 8 TYR HD1 H -5.187 2.633 -2.202 1.00 . A A . 8 TYR HD1 1 1 4 1423 1 1 8 TYR HD2 H -8.201 -0.259 -1.141 1.00 . A A . 8 TYR HD2 1 1 4 1424 1 1 8 TYR HE1 H -6.905 4.012 -3.318 1.00 . A A . 8 TYR HE1 1 1 4 1425 1 1 8 TYR HE2 H -9.902 1.064 -2.366 1.00 . A A . 8 TYR HE2 1 1 4 1426 1 1 8 TYR HH H -10.350 3.043 -3.464 1.00 . A A . 8 TYR HH 1 1 4 1427 1 1 8 TYR N N -5.803 0.645 1.557 1.00 . A A . 8 TYR N 1 1 4 1428 1 1 8 TYR O O -3.055 2.088 -0.131 1.00 . A A . 8 TYR O 1 1 4 1429 1 1 8 TYR OH O -9.463 3.403 -3.536 1.00 . A A . 8 TYR OH 1 1 4 1430 1 1 9 SER C C -2.990 4.666 1.141 1.00 . A A . 9 SER C 1 1 4 1431 1 1 9 SER CA C -4.333 4.527 0.419 1.00 . A A . 9 SER CA 1 1 4 1432 1 1 9 SER CB C -5.317 5.593 0.904 1.00 . A A . 9 SER CB 1 1 4 1433 1 1 9 SER H H -5.852 3.111 0.895 1.00 . A A . 9 SER H 1 1 4 1434 1 1 9 SER HA H -4.170 4.709 -0.643 1.00 . A A . 9 SER HA 1 1 4 1435 1 1 9 SER HB2 H -5.589 5.417 1.945 1.00 . A A . 9 SER HB2 1 1 4 1436 1 1 9 SER HB3 H -4.851 6.576 0.822 1.00 . A A . 9 SER HB3 1 1 4 1437 1 1 9 SER HG H -6.953 4.768 0.264 1.00 . A A . 9 SER HG 1 1 4 1438 1 1 9 SER N N -4.900 3.187 0.562 1.00 . A A . 9 SER N 1 1 4 1439 1 1 9 SER O O -2.148 5.458 0.720 1.00 . A A . 9 SER O 1 1 4 1440 1 1 9 SER OG O -6.472 5.582 0.092 1.00 . A A . 9 SER OG 1 1 4 1441 1 1 10 LYS C C -0.489 3.172 1.975 1.00 . A A . 10 LYS C 1 1 4 1442 1 1 10 LYS CA C -1.512 3.829 2.900 1.00 . A A . 10 LYS CA 1 1 4 1443 1 1 10 LYS CB C -1.672 3.102 4.241 1.00 . A A . 10 LYS CB 1 1 4 1444 1 1 10 LYS CD C -2.806 5.089 5.484 1.00 . A A . 10 LYS CD 1 1 4 1445 1 1 10 LYS CE C -3.458 6.027 4.455 1.00 . A A . 10 LYS CE 1 1 4 1446 1 1 10 LYS CG C -2.848 3.601 5.098 1.00 . A A . 10 LYS CG 1 1 4 1447 1 1 10 LYS H H -3.487 3.239 2.518 1.00 . A A . 10 LYS H 1 1 4 1448 1 1 10 LYS HA H -1.171 4.841 3.105 1.00 . A A . 10 LYS HA 1 1 4 1449 1 1 10 LYS HB2 H -1.825 2.038 4.059 1.00 . A A . 10 LYS HB2 1 1 4 1450 1 1 10 LYS HB3 H -0.753 3.217 4.815 1.00 . A A . 10 LYS HB3 1 1 4 1451 1 1 10 LYS HD2 H -3.372 5.189 6.411 1.00 . A A . 10 LYS HD2 1 1 4 1452 1 1 10 LYS HD3 H -1.779 5.398 5.680 1.00 . A A . 10 LYS HD3 1 1 4 1453 1 1 10 LYS HE2 H -2.828 6.157 3.579 1.00 . A A . 10 LYS HE2 1 1 4 1454 1 1 10 LYS HE3 H -4.419 5.619 4.138 1.00 . A A . 10 LYS HE3 1 1 4 1455 1 1 10 LYS HG2 H -3.798 3.374 4.615 1.00 . A A . 10 LYS HG2 1 1 4 1456 1 1 10 LYS HG3 H -2.815 3.025 6.025 1.00 . A A . 10 LYS HG3 1 1 4 1457 1 1 10 LYS HZ1 H -2.801 7.764 5.307 1.00 . A A . 10 LYS HZ1 1 1 4 1458 1 1 10 LYS HZ2 H -4.116 7.958 4.330 1.00 . A A . 10 LYS HZ2 1 1 4 1459 1 1 10 LYS HZ3 H -4.293 7.291 5.828 1.00 . A A . 10 LYS HZ3 1 1 4 1460 1 1 10 LYS N N -2.779 3.887 2.209 1.00 . A A . 10 LYS N 1 1 4 1461 1 1 10 LYS NZ N -3.685 7.364 5.025 1.00 . A A . 10 LYS NZ 1 1 4 1462 1 1 10 LYS O O 0.467 3.827 1.570 1.00 . A A . 10 LYS O 1 1 4 1463 1 1 11 TYR C C -0.065 1.412 -0.724 1.00 . A A . 11 TYR C 1 1 4 1464 1 1 11 TYR CA C 0.225 1.154 0.755 1.00 . A A . 11 TYR CA 1 1 4 1465 1 1 11 TYR CB C 0.216 -0.327 1.142 1.00 . A A . 11 TYR CB 1 1 4 1466 1 1 11 TYR CD1 C -1.776 -1.062 2.518 1.00 . A A . 11 TYR CD1 1 1 4 1467 1 1 11 TYR CD2 C -1.684 -1.710 0.175 1.00 . A A . 11 TYR CD2 1 1 4 1468 1 1 11 TYR CE1 C -2.953 -1.811 2.681 1.00 . A A . 11 TYR CE1 1 1 4 1469 1 1 11 TYR CE2 C -2.869 -2.451 0.335 1.00 . A A . 11 TYR CE2 1 1 4 1470 1 1 11 TYR CG C -1.139 -1.003 1.264 1.00 . A A . 11 TYR CG 1 1 4 1471 1 1 11 TYR CZ C -3.503 -2.503 1.588 1.00 . A A . 11 TYR CZ 1 1 4 1472 1 1 11 TYR H H -1.592 1.478 1.757 1.00 . A A . 11 TYR H 1 1 4 1473 1 1 11 TYR HA H 1.235 1.513 0.950 1.00 . A A . 11 TYR HA 1 1 4 1474 1 1 11 TYR HB2 H 0.822 -0.860 0.413 1.00 . A A . 11 TYR HB2 1 1 4 1475 1 1 11 TYR HB3 H 0.717 -0.398 2.108 1.00 . A A . 11 TYR HB3 1 1 4 1476 1 1 11 TYR HD1 H -1.356 -0.540 3.366 1.00 . A A . 11 TYR HD1 1 1 4 1477 1 1 11 TYR HD2 H -1.188 -1.710 -0.783 1.00 . A A . 11 TYR HD2 1 1 4 1478 1 1 11 TYR HE1 H -3.431 -1.852 3.649 1.00 . A A . 11 TYR HE1 1 1 4 1479 1 1 11 TYR HE2 H -3.285 -2.986 -0.506 1.00 . A A . 11 TYR HE2 1 1 4 1480 1 1 11 TYR HH H -4.982 -3.227 2.639 1.00 . A A . 11 TYR HH 1 1 4 1481 1 1 11 TYR N N -0.698 1.905 1.590 1.00 . A A . 11 TYR N 1 1 4 1482 1 1 11 TYR O O -0.134 0.499 -1.544 1.00 . A A . 11 TYR O 1 1 4 1483 1 1 11 TYR OH O -4.651 -3.224 1.738 1.00 . A A . 11 TYR OH 1 1 4 1484 1 1 12 LEU C C 0.513 4.472 -2.464 1.00 . A A . 12 LEU C 1 1 4 1485 1 1 12 LEU CA C -0.426 3.270 -2.346 1.00 . A A . 12 LEU CA 1 1 4 1486 1 1 12 LEU CB C -1.910 3.641 -2.446 1.00 . A A . 12 LEU CB 1 1 4 1487 1 1 12 LEU CD1 C -1.980 5.905 -3.684 1.00 . A A . 12 LEU CD1 1 1 4 1488 1 1 12 LEU CD2 C -2.058 3.737 -4.978 1.00 . A A . 12 LEU CD2 1 1 4 1489 1 1 12 LEU CG C -2.414 4.434 -3.661 1.00 . A A . 12 LEU CG 1 1 4 1490 1 1 12 LEU H H -0.155 3.356 -0.274 1.00 . A A . 12 LEU H 1 1 4 1491 1 1 12 LEU HA H -0.189 2.513 -3.085 1.00 . A A . 12 LEU HA 1 1 4 1492 1 1 12 LEU HB2 H -2.459 2.699 -2.437 1.00 . A A . 12 LEU HB2 1 1 4 1493 1 1 12 LEU HB3 H -2.172 4.198 -1.551 1.00 . A A . 12 LEU HB3 1 1 4 1494 1 1 12 LEU HD11 H -2.110 6.349 -2.697 1.00 . A A . 12 LEU HD11 1 1 4 1495 1 1 12 LEU HD12 H -0.944 6.011 -3.999 1.00 . A A . 12 LEU HD12 1 1 4 1496 1 1 12 LEU HD13 H -2.604 6.447 -4.395 1.00 . A A . 12 LEU HD13 1 1 4 1497 1 1 12 LEU HD21 H -2.420 2.708 -4.961 1.00 . A A . 12 LEU HD21 1 1 4 1498 1 1 12 LEU HD22 H -2.528 4.263 -5.809 1.00 . A A . 12 LEU HD22 1 1 4 1499 1 1 12 LEU HD23 H -0.978 3.734 -5.125 1.00 . A A . 12 LEU HD23 1 1 4 1500 1 1 12 LEU HG H -3.500 4.445 -3.556 1.00 . A A . 12 LEU HG 1 1 4 1501 1 1 12 LEU N N -0.212 2.699 -1.035 1.00 . A A . 12 LEU N 1 1 4 1502 1 1 12 LEU O O 1.210 4.617 -3.465 1.00 . A A . 12 LEU O 1 1 4 1503 1 1 13 ASP C C 2.709 6.507 -1.761 1.00 . A A . 13 ASP C 1 1 4 1504 1 1 13 ASP CA C 1.275 6.531 -1.217 1.00 . A A . 13 ASP CA 1 1 4 1505 1 1 13 ASP CB C 1.181 6.890 0.276 1.00 . A A . 13 ASP CB 1 1 4 1506 1 1 13 ASP CG C 1.896 8.191 0.631 1.00 . A A . 13 ASP CG 1 1 4 1507 1 1 13 ASP H H -0.119 5.081 -0.659 1.00 . A A . 13 ASP H 1 1 4 1508 1 1 13 ASP HA H 0.778 7.321 -1.762 1.00 . A A . 13 ASP HA 1 1 4 1509 1 1 13 ASP HB2 H 0.128 6.991 0.543 1.00 . A A . 13 ASP HB2 1 1 4 1510 1 1 13 ASP HB3 H 1.593 6.072 0.866 1.00 . A A . 13 ASP HB3 1 1 4 1511 1 1 13 ASP N N 0.516 5.305 -1.413 1.00 . A A . 13 ASP N 1 1 4 1512 1 1 13 ASP O O 2.926 6.830 -2.928 1.00 . A A . 13 ASP O 1 1 4 1513 1 1 13 ASP OD1 O 1.532 9.226 0.033 1.00 . A A . 13 ASP OD1 1 1 4 1514 1 1 13 ASP OD2 O 2.796 8.126 1.497 1.00 . A A . 13 ASP OD2 1 1 4 1515 1 1 14 SER C C 5.895 5.144 -0.600 1.00 . A A . 14 SER C 1 1 4 1516 1 1 14 SER CA C 5.107 6.319 -1.191 1.00 . A A . 14 SER CA 1 1 4 1517 1 1 14 SER CB C 5.603 7.694 -0.716 1.00 . A A . 14 SER CB 1 1 4 1518 1 1 14 SER H H 3.390 5.980 0.039 1.00 . A A . 14 SER H 1 1 4 1519 1 1 14 SER HA H 5.263 6.272 -2.270 1.00 . A A . 14 SER HA 1 1 4 1520 1 1 14 SER HB2 H 5.451 7.800 0.359 1.00 . A A . 14 SER HB2 1 1 4 1521 1 1 14 SER HB3 H 6.663 7.806 -0.948 1.00 . A A . 14 SER HB3 1 1 4 1522 1 1 14 SER HG H 5.207 9.573 -1.042 1.00 . A A . 14 SER HG 1 1 4 1523 1 1 14 SER N N 3.681 6.198 -0.898 1.00 . A A . 14 SER N 1 1 4 1524 1 1 14 SER O O 5.705 4.018 -1.050 1.00 . A A . 14 SER O 1 1 4 1525 1 1 14 SER OG O 4.894 8.726 -1.368 1.00 . A A . 14 SER OG 1 1 4 1526 1 1 15 ARG C C 6.972 3.129 1.334 1.00 . A A . 15 ARG C 1 1 4 1527 1 1 15 ARG CA C 7.707 4.406 0.939 1.00 . A A . 15 ARG CA 1 1 4 1528 1 1 15 ARG CB C 8.452 5.025 2.135 1.00 . A A . 15 ARG CB 1 1 4 1529 1 1 15 ARG CD C 9.186 2.897 3.423 1.00 . A A . 15 ARG CD 1 1 4 1530 1 1 15 ARG CG C 9.613 4.179 2.688 1.00 . A A . 15 ARG CG 1 1 4 1531 1 1 15 ARG CZ C 10.598 2.803 5.486 1.00 . A A . 15 ARG CZ 1 1 4 1532 1 1 15 ARG H H 6.880 6.337 0.717 1.00 . A A . 15 ARG H 1 1 4 1533 1 1 15 ARG HA H 8.443 4.161 0.172 1.00 . A A . 15 ARG HA 1 1 4 1534 1 1 15 ARG HB2 H 8.883 5.970 1.799 1.00 . A A . 15 ARG HB2 1 1 4 1535 1 1 15 ARG HB3 H 7.752 5.247 2.941 1.00 . A A . 15 ARG HB3 1 1 4 1536 1 1 15 ARG HD2 H 8.301 3.077 4.035 1.00 . A A . 15 ARG HD2 1 1 4 1537 1 1 15 ARG HD3 H 8.950 2.117 2.701 1.00 . A A . 15 ARG HD3 1 1 4 1538 1 1 15 ARG HE H 10.807 1.601 3.867 1.00 . A A . 15 ARG HE 1 1 4 1539 1 1 15 ARG HG2 H 10.298 3.921 1.880 1.00 . A A . 15 ARG HG2 1 1 4 1540 1 1 15 ARG HG3 H 10.150 4.813 3.394 1.00 . A A . 15 ARG HG3 1 1 4 1541 1 1 15 ARG HH11 H 9.181 4.275 5.572 1.00 . A A . 15 ARG HH11 1 1 4 1542 1 1 15 ARG HH12 H 10.196 4.128 6.987 1.00 . A A . 15 ARG HH12 1 1 4 1543 1 1 15 ARG HH21 H 12.110 1.450 5.725 1.00 . A A . 15 ARG HH21 1 1 4 1544 1 1 15 ARG HH22 H 11.857 2.535 7.072 1.00 . A A . 15 ARG HH22 1 1 4 1545 1 1 15 ARG N N 6.787 5.393 0.374 1.00 . A A . 15 ARG N 1 1 4 1546 1 1 15 ARG NE N 10.273 2.366 4.257 1.00 . A A . 15 ARG NE 1 1 4 1547 1 1 15 ARG NH1 N 9.936 3.817 6.062 1.00 . A A . 15 ARG NH1 1 1 4 1548 1 1 15 ARG NH2 N 11.604 2.214 6.148 1.00 . A A . 15 ARG NH2 1 1 4 1549 1 1 15 ARG O O 7.295 2.055 0.833 1.00 . A A . 15 ARG O 1 1 4 1550 1 1 16 ARG C C 4.563 1.332 1.604 1.00 . A A . 16 ARG C 1 1 4 1551 1 1 16 ARG CA C 5.201 2.143 2.736 1.00 . A A . 16 ARG CA 1 1 4 1552 1 1 16 ARG CB C 4.169 2.640 3.759 1.00 . A A . 16 ARG CB 1 1 4 1553 1 1 16 ARG CD C 2.195 4.152 4.220 1.00 . A A . 16 ARG CD 1 1 4 1554 1 1 16 ARG CG C 3.215 3.688 3.176 1.00 . A A . 16 ARG CG 1 1 4 1555 1 1 16 ARG CZ C 0.908 6.303 4.444 1.00 . A A . 16 ARG CZ 1 1 4 1556 1 1 16 ARG H H 5.769 4.182 2.575 1.00 . A A . 16 ARG H 1 1 4 1557 1 1 16 ARG HA H 5.882 1.479 3.270 1.00 . A A . 16 ARG HA 1 1 4 1558 1 1 16 ARG HB2 H 3.589 1.788 4.119 1.00 . A A . 16 ARG HB2 1 1 4 1559 1 1 16 ARG HB3 H 4.700 3.078 4.605 1.00 . A A . 16 ARG HB3 1 1 4 1560 1 1 16 ARG HD2 H 1.507 3.333 4.433 1.00 . A A . 16 ARG HD2 1 1 4 1561 1 1 16 ARG HD3 H 2.720 4.423 5.134 1.00 . A A . 16 ARG HD3 1 1 4 1562 1 1 16 ARG HE H 1.245 5.293 2.722 1.00 . A A . 16 ARG HE 1 1 4 1563 1 1 16 ARG HG2 H 3.778 4.556 2.835 1.00 . A A . 16 ARG HG2 1 1 4 1564 1 1 16 ARG HG3 H 2.694 3.251 2.328 1.00 . A A . 16 ARG HG3 1 1 4 1565 1 1 16 ARG HH11 H 1.533 5.614 6.268 1.00 . A A . 16 ARG HH11 1 1 4 1566 1 1 16 ARG HH12 H 0.640 7.114 6.297 1.00 . A A . 16 ARG HH12 1 1 4 1567 1 1 16 ARG HH21 H 0.127 7.256 2.815 1.00 . A A . 16 ARG HH21 1 1 4 1568 1 1 16 ARG HH22 H -0.165 8.039 4.352 1.00 . A A . 16 ARG HH22 1 1 4 1569 1 1 16 ARG N N 5.986 3.259 2.229 1.00 . A A . 16 ARG N 1 1 4 1570 1 1 16 ARG NE N 1.429 5.300 3.717 1.00 . A A . 16 ARG NE 1 1 4 1571 1 1 16 ARG NH1 N 1.041 6.346 5.778 1.00 . A A . 16 ARG NH1 1 1 4 1572 1 1 16 ARG NH2 N 0.235 7.279 3.819 1.00 . A A . 16 ARG NH2 1 1 4 1573 1 1 16 ARG O O 4.411 0.122 1.741 1.00 . A A . 16 ARG O 1 1 4 1574 1 1 17 ALA C C 4.727 0.464 -1.375 1.00 . A A . 17 ALA C 1 1 4 1575 1 1 17 ALA CA C 3.661 1.310 -0.682 1.00 . A A . 17 ALA CA 1 1 4 1576 1 1 17 ALA CB C 3.038 2.334 -1.632 1.00 . A A . 17 ALA CB 1 1 4 1577 1 1 17 ALA H H 4.383 2.973 0.414 1.00 . A A . 17 ALA H 1 1 4 1578 1 1 17 ALA HA H 2.865 0.640 -0.356 1.00 . A A . 17 ALA HA 1 1 4 1579 1 1 17 ALA HB1 H 3.802 2.902 -2.154 1.00 . A A . 17 ALA HB1 1 1 4 1580 1 1 17 ALA HB2 H 2.424 1.819 -2.372 1.00 . A A . 17 ALA HB2 1 1 4 1581 1 1 17 ALA HB3 H 2.422 3.024 -1.059 1.00 . A A . 17 ALA HB3 1 1 4 1582 1 1 17 ALA N N 4.209 1.980 0.486 1.00 . A A . 17 ALA N 1 1 4 1583 1 1 17 ALA O O 4.463 -0.689 -1.702 1.00 . A A . 17 ALA O 1 1 4 1584 1 1 18 GLN C C 7.421 -0.926 -1.371 1.00 . A A . 18 GLN C 1 1 4 1585 1 1 18 GLN CA C 7.012 0.272 -2.229 1.00 . A A . 18 GLN CA 1 1 4 1586 1 1 18 GLN CB C 8.240 1.157 -2.505 1.00 . A A . 18 GLN CB 1 1 4 1587 1 1 18 GLN CD C 6.871 2.532 -4.180 1.00 . A A . 18 GLN CD 1 1 4 1588 1 1 18 GLN CG C 7.954 2.540 -3.103 1.00 . A A . 18 GLN CG 1 1 4 1589 1 1 18 GLN H H 6.103 1.964 -1.285 1.00 . A A . 18 GLN H 1 1 4 1590 1 1 18 GLN HA H 6.636 -0.116 -3.178 1.00 . A A . 18 GLN HA 1 1 4 1591 1 1 18 GLN HB2 H 8.793 1.311 -1.578 1.00 . A A . 18 GLN HB2 1 1 4 1592 1 1 18 GLN HB3 H 8.887 0.612 -3.195 1.00 . A A . 18 GLN HB3 1 1 4 1593 1 1 18 GLN HE21 H 5.672 3.722 -3.044 1.00 . A A . 18 GLN HE21 1 1 4 1594 1 1 18 GLN HE22 H 5.022 3.275 -4.609 1.00 . A A . 18 GLN HE22 1 1 4 1595 1 1 18 GLN HG2 H 7.675 3.216 -2.298 1.00 . A A . 18 GLN HG2 1 1 4 1596 1 1 18 GLN HG3 H 8.876 2.923 -3.542 1.00 . A A . 18 GLN HG3 1 1 4 1597 1 1 18 GLN N N 5.930 1.015 -1.591 1.00 . A A . 18 GLN N 1 1 4 1598 1 1 18 GLN NE2 N 5.767 3.239 -3.929 1.00 . A A . 18 GLN NE2 1 1 4 1599 1 1 18 GLN O O 7.636 -2.017 -1.893 1.00 . A A . 18 GLN O 1 1 4 1600 1 1 18 GLN OE1 O 7.031 1.903 -5.222 1.00 . A A . 18 GLN OE1 1 1 4 1601 1 1 19 ASP C C 6.792 -2.838 0.912 1.00 . A A . 19 ASP C 1 1 4 1602 1 1 19 ASP CA C 7.856 -1.742 0.919 1.00 . A A . 19 ASP CA 1 1 4 1603 1 1 19 ASP CB C 7.992 -1.099 2.303 1.00 . A A . 19 ASP CB 1 1 4 1604 1 1 19 ASP CG C 8.354 -2.129 3.369 1.00 . A A . 19 ASP CG 1 1 4 1605 1 1 19 ASP H H 7.310 0.208 0.297 1.00 . A A . 19 ASP H 1 1 4 1606 1 1 19 ASP HA H 8.818 -2.180 0.645 1.00 . A A . 19 ASP HA 1 1 4 1607 1 1 19 ASP HB2 H 8.774 -0.340 2.267 1.00 . A A . 19 ASP HB2 1 1 4 1608 1 1 19 ASP HB3 H 7.054 -0.614 2.576 1.00 . A A . 19 ASP HB3 1 1 4 1609 1 1 19 ASP N N 7.520 -0.715 -0.054 1.00 . A A . 19 ASP N 1 1 4 1610 1 1 19 ASP O O 7.121 -4.021 0.869 1.00 . A A . 19 ASP O 1 1 4 1611 1 1 19 ASP OD1 O 9.560 -2.443 3.471 1.00 . A A . 19 ASP OD1 1 1 4 1612 1 1 19 ASP OD2 O 7.418 -2.588 4.060 1.00 . A A . 19 ASP OD2 1 1 4 1613 1 1 20 PHE C C 4.439 -4.167 -0.435 1.00 . A A . 20 PHE C 1 1 4 1614 1 1 20 PHE CA C 4.387 -3.352 0.859 1.00 . A A . 20 PHE CA 1 1 4 1615 1 1 20 PHE CB C 3.079 -2.566 0.975 1.00 . A A . 20 PHE CB 1 1 4 1616 1 1 20 PHE CD1 C 1.227 -3.745 -0.284 1.00 . A A . 20 PHE CD1 1 1 4 1617 1 1 20 PHE CD2 C 1.259 -3.876 2.148 1.00 . A A . 20 PHE CD2 1 1 4 1618 1 1 20 PHE CE1 C 0.060 -4.527 -0.310 1.00 . A A . 20 PHE CE1 1 1 4 1619 1 1 20 PHE CE2 C 0.082 -4.643 2.122 1.00 . A A . 20 PHE CE2 1 1 4 1620 1 1 20 PHE CG C 1.832 -3.424 0.945 1.00 . A A . 20 PHE CG 1 1 4 1621 1 1 20 PHE CZ C -0.517 -4.971 0.893 1.00 . A A . 20 PHE CZ 1 1 4 1622 1 1 20 PHE H H 5.313 -1.450 1.004 1.00 . A A . 20 PHE H 1 1 4 1623 1 1 20 PHE HA H 4.439 -4.037 1.707 1.00 . A A . 20 PHE HA 1 1 4 1624 1 1 20 PHE HB2 H 3.086 -2.018 1.917 1.00 . A A . 20 PHE HB2 1 1 4 1625 1 1 20 PHE HB3 H 3.026 -1.842 0.163 1.00 . A A . 20 PHE HB3 1 1 4 1626 1 1 20 PHE HD1 H 1.659 -3.385 -1.207 1.00 . A A . 20 PHE HD1 1 1 4 1627 1 1 20 PHE HD2 H 1.722 -3.628 3.094 1.00 . A A . 20 PHE HD2 1 1 4 1628 1 1 20 PHE HE1 H -0.403 -4.776 -1.254 1.00 . A A . 20 PHE HE1 1 1 4 1629 1 1 20 PHE HE2 H -0.361 -4.984 3.046 1.00 . A A . 20 PHE HE2 1 1 4 1630 1 1 20 PHE HZ H -1.421 -5.562 0.873 1.00 . A A . 20 PHE HZ 1 1 4 1631 1 1 20 PHE N N 5.515 -2.439 0.942 1.00 . A A . 20 PHE N 1 1 4 1632 1 1 20 PHE O O 4.165 -5.362 -0.409 1.00 . A A . 20 PHE O 1 1 4 1633 1 1 21 VAL C C 6.027 -5.280 -2.777 1.00 . A A . 21 VAL C 1 1 4 1634 1 1 21 VAL CA C 4.885 -4.266 -2.830 1.00 . A A . 21 VAL CA 1 1 4 1635 1 1 21 VAL CB C 4.991 -3.276 -4.005 1.00 . A A . 21 VAL CB 1 1 4 1636 1 1 21 VAL CG1 C 5.438 -3.960 -5.303 1.00 . A A . 21 VAL CG1 1 1 4 1637 1 1 21 VAL CG2 C 3.626 -2.620 -4.253 1.00 . A A . 21 VAL CG2 1 1 4 1638 1 1 21 VAL H H 5.027 -2.558 -1.555 1.00 . A A . 21 VAL H 1 1 4 1639 1 1 21 VAL HA H 3.973 -4.850 -2.949 1.00 . A A . 21 VAL HA 1 1 4 1640 1 1 21 VAL HB H 5.719 -2.501 -3.762 1.00 . A A . 21 VAL HB 1 1 4 1641 1 1 21 VAL HG11 H 6.470 -4.299 -5.214 1.00 . A A . 21 VAL HG11 1 1 4 1642 1 1 21 VAL HG12 H 4.792 -4.812 -5.522 1.00 . A A . 21 VAL HG12 1 1 4 1643 1 1 21 VAL HG13 H 5.384 -3.251 -6.129 1.00 . A A . 21 VAL HG13 1 1 4 1644 1 1 21 VAL HG21 H 2.914 -3.366 -4.608 1.00 . A A . 21 VAL HG21 1 1 4 1645 1 1 21 VAL HG22 H 3.236 -2.177 -3.338 1.00 . A A . 21 VAL HG22 1 1 4 1646 1 1 21 VAL HG23 H 3.725 -1.838 -5.006 1.00 . A A . 21 VAL HG23 1 1 4 1647 1 1 21 VAL N N 4.792 -3.546 -1.567 1.00 . A A . 21 VAL N 1 1 4 1648 1 1 21 VAL O O 5.838 -6.437 -3.144 1.00 . A A . 21 VAL O 1 1 4 1649 1 1 22 GLN C C 8.010 -6.919 -1.211 1.00 . A A . 22 GLN C 1 1 4 1650 1 1 22 GLN CA C 8.352 -5.729 -2.118 1.00 . A A . 22 GLN CA 1 1 4 1651 1 1 22 GLN CB C 9.508 -4.903 -1.540 1.00 . A A . 22 GLN CB 1 1 4 1652 1 1 22 GLN CD C 11.351 -5.905 -2.964 1.00 . A A . 22 GLN CD 1 1 4 1653 1 1 22 GLN CG C 10.833 -5.672 -1.545 1.00 . A A . 22 GLN CG 1 1 4 1654 1 1 22 GLN H H 7.294 -3.891 -2.019 1.00 . A A . 22 GLN H 1 1 4 1655 1 1 22 GLN HA H 8.638 -6.106 -3.101 1.00 . A A . 22 GLN HA 1 1 4 1656 1 1 22 GLN HB2 H 9.631 -3.989 -2.124 1.00 . A A . 22 GLN HB2 1 1 4 1657 1 1 22 GLN HB3 H 9.273 -4.624 -0.513 1.00 . A A . 22 GLN HB3 1 1 4 1658 1 1 22 GLN HE21 H 11.882 -3.947 -3.155 1.00 . A A . 22 GLN HE21 1 1 4 1659 1 1 22 GLN HE22 H 12.207 -4.960 -4.546 1.00 . A A . 22 GLN HE22 1 1 4 1660 1 1 22 GLN HG2 H 11.567 -5.085 -0.992 1.00 . A A . 22 GLN HG2 1 1 4 1661 1 1 22 GLN HG3 H 10.708 -6.625 -1.032 1.00 . A A . 22 GLN HG3 1 1 4 1662 1 1 22 GLN N N 7.201 -4.859 -2.299 1.00 . A A . 22 GLN N 1 1 4 1663 1 1 22 GLN NE2 N 11.854 -4.849 -3.606 1.00 . A A . 22 GLN NE2 1 1 4 1664 1 1 22 GLN O O 8.490 -8.028 -1.437 1.00 . A A . 22 GLN O 1 1 4 1665 1 1 22 GLN OE1 O 11.297 -7.019 -3.478 1.00 . A A . 22 GLN OE1 1 1 4 1666 1 1 23 TRP C C 5.857 -8.716 0.081 1.00 . A A . 23 TRP C 1 1 4 1667 1 1 23 TRP CA C 6.786 -7.715 0.762 1.00 . A A . 23 TRP CA 1 1 4 1668 1 1 23 TRP CB C 6.090 -7.051 1.951 1.00 . A A . 23 TRP CB 1 1 4 1669 1 1 23 TRP CD1 C 5.727 -8.962 3.551 1.00 . A A . 23 TRP CD1 1 1 4 1670 1 1 23 TRP CD2 C 3.816 -8.182 2.694 1.00 . A A . 23 TRP CD2 1 1 4 1671 1 1 23 TRP CE2 C 3.471 -9.264 3.552 1.00 . A A . 23 TRP CE2 1 1 4 1672 1 1 23 TRP CE3 C 2.779 -7.583 1.954 1.00 . A A . 23 TRP CE3 1 1 4 1673 1 1 23 TRP CG C 5.254 -7.988 2.752 1.00 . A A . 23 TRP CG 1 1 4 1674 1 1 23 TRP CH2 C 1.132 -9.068 2.973 1.00 . A A . 23 TRP CH2 1 1 4 1675 1 1 23 TRP CZ2 C 2.148 -9.703 3.703 1.00 . A A . 23 TRP CZ2 1 1 4 1676 1 1 23 TRP CZ3 C 1.448 -8.019 2.090 1.00 . A A . 23 TRP CZ3 1 1 4 1677 1 1 23 TRP H H 6.736 -5.789 -0.094 1.00 . A A . 23 TRP H 1 1 4 1678 1 1 23 TRP HA H 7.670 -8.242 1.125 1.00 . A A . 23 TRP HA 1 1 4 1679 1 1 23 TRP HB2 H 6.836 -6.587 2.597 1.00 . A A . 23 TRP HB2 1 1 4 1680 1 1 23 TRP HB3 H 5.427 -6.266 1.593 1.00 . A A . 23 TRP HB3 1 1 4 1681 1 1 23 TRP HD1 H 6.779 -9.131 3.701 1.00 . A A . 23 TRP HD1 1 1 4 1682 1 1 23 TRP HE1 H 4.752 -10.479 4.700 1.00 . A A . 23 TRP HE1 1 1 4 1683 1 1 23 TRP HE3 H 3.044 -6.802 1.255 1.00 . A A . 23 TRP HE3 1 1 4 1684 1 1 23 TRP HH2 H 0.111 -9.399 3.082 1.00 . A A . 23 TRP HH2 1 1 4 1685 1 1 23 TRP HZ2 H 1.917 -10.527 4.362 1.00 . A A . 23 TRP HZ2 1 1 4 1686 1 1 23 TRP HZ3 H 0.668 -7.554 1.506 1.00 . A A . 23 TRP HZ3 1 1 4 1687 1 1 23 TRP N N 7.177 -6.694 -0.190 1.00 . A A . 23 TRP N 1 1 4 1688 1 1 23 TRP NE1 N 4.677 -9.698 4.066 1.00 . A A . 23 TRP NE1 1 1 4 1689 1 1 23 TRP O O 6.116 -9.915 0.103 1.00 . A A . 23 TRP O 1 1 4 1690 1 1 24 LEU C C 4.435 -9.853 -2.286 1.00 . A A . 24 LEU C 1 1 4 1691 1 1 24 LEU CA C 3.772 -8.936 -1.258 1.00 . A A . 24 LEU CA 1 1 4 1692 1 1 24 LEU CB C 2.835 -7.928 -1.936 1.00 . A A . 24 LEU CB 1 1 4 1693 1 1 24 LEU CD1 C 0.759 -9.399 -1.818 1.00 . A A . 24 LEU CD1 1 1 4 1694 1 1 24 LEU CD2 C 0.861 -7.454 -3.388 1.00 . A A . 24 LEU CD2 1 1 4 1695 1 1 24 LEU CG C 1.678 -8.567 -2.722 1.00 . A A . 24 LEU CG 1 1 4 1696 1 1 24 LEU H H 4.648 -7.197 -0.433 1.00 . A A . 24 LEU H 1 1 4 1697 1 1 24 LEU HA H 3.202 -9.528 -0.544 1.00 . A A . 24 LEU HA 1 1 4 1698 1 1 24 LEU HB2 H 2.420 -7.272 -1.171 1.00 . A A . 24 LEU HB2 1 1 4 1699 1 1 24 LEU HB3 H 3.426 -7.322 -2.622 1.00 . A A . 24 LEU HB3 1 1 4 1700 1 1 24 LEU HD11 H 0.415 -8.796 -0.977 1.00 . A A . 24 LEU HD11 1 1 4 1701 1 1 24 LEU HD12 H -0.105 -9.738 -2.389 1.00 . A A . 24 LEU HD12 1 1 4 1702 1 1 24 LEU HD13 H 1.284 -10.277 -1.444 1.00 . A A . 24 LEU HD13 1 1 4 1703 1 1 24 LEU HD21 H 0.432 -6.799 -2.629 1.00 . A A . 24 LEU HD21 1 1 4 1704 1 1 24 LEU HD22 H 1.502 -6.867 -4.046 1.00 . A A . 24 LEU HD22 1 1 4 1705 1 1 24 LEU HD23 H 0.056 -7.890 -3.980 1.00 . A A . 24 LEU HD23 1 1 4 1706 1 1 24 LEU HG H 2.076 -9.209 -3.509 1.00 . A A . 24 LEU HG 1 1 4 1707 1 1 24 LEU N N 4.778 -8.195 -0.512 1.00 . A A . 24 LEU N 1 1 4 1708 1 1 24 LEU O O 4.023 -10.999 -2.463 1.00 . A A . 24 LEU O 1 1 4 1709 1 1 25 MET C C 6.981 -11.245 -3.137 1.00 . A A . 25 MET C 1 1 4 1710 1 1 25 MET CA C 6.290 -10.101 -3.879 1.00 . A A . 25 MET CA 1 1 4 1711 1 1 25 MET CB C 7.319 -9.193 -4.565 1.00 . A A . 25 MET CB 1 1 4 1712 1 1 25 MET CE C 9.196 -7.774 -6.724 1.00 . A A . 25 MET CE 1 1 4 1713 1 1 25 MET CG C 6.680 -8.303 -5.634 1.00 . A A . 25 MET CG 1 1 4 1714 1 1 25 MET H H 5.750 -8.387 -2.719 1.00 . A A . 25 MET H 1 1 4 1715 1 1 25 MET HA H 5.634 -10.523 -4.641 1.00 . A A . 25 MET HA 1 1 4 1716 1 1 25 MET HB2 H 7.811 -8.568 -3.822 1.00 . A A . 25 MET HB2 1 1 4 1717 1 1 25 MET HB3 H 8.074 -9.817 -5.046 1.00 . A A . 25 MET HB3 1 1 4 1718 1 1 25 MET HE1 H 9.687 -8.258 -5.881 1.00 . A A . 25 MET HE1 1 1 4 1719 1 1 25 MET HE2 H 8.925 -8.520 -7.471 1.00 . A A . 25 MET HE2 1 1 4 1720 1 1 25 MET HE3 H 9.883 -7.054 -7.168 1.00 . A A . 25 MET HE3 1 1 4 1721 1 1 25 MET HG2 H 6.448 -8.914 -6.506 1.00 . A A . 25 MET HG2 1 1 4 1722 1 1 25 MET HG3 H 5.745 -7.893 -5.255 1.00 . A A . 25 MET HG3 1 1 4 1723 1 1 25 MET N N 5.478 -9.336 -2.945 1.00 . A A . 25 MET N 1 1 4 1724 1 1 25 MET O O 6.766 -12.410 -3.467 1.00 . A A . 25 MET O 1 1 4 1725 1 1 25 MET SD S 7.710 -6.905 -6.159 1.00 . A A . 25 MET SD 1 1 4 1726 1 1 26 ASN C C 7.725 -12.514 -0.240 1.00 . A A . 26 ASN C 1 1 4 1727 1 1 26 ASN CA C 8.567 -11.894 -1.364 1.00 . A A . 26 ASN CA 1 1 4 1728 1 1 26 ASN CB C 9.856 -11.249 -0.834 1.00 . A A . 26 ASN CB 1 1 4 1729 1 1 26 ASN CG C 10.802 -10.853 -1.966 1.00 . A A . 26 ASN CG 1 1 4 1730 1 1 26 ASN H H 7.906 -9.940 -1.883 1.00 . A A . 26 ASN H 1 1 4 1731 1 1 26 ASN HA H 8.869 -12.709 -2.024 1.00 . A A . 26 ASN HA 1 1 4 1732 1 1 26 ASN HB2 H 9.614 -10.377 -0.225 1.00 . A A . 26 ASN HB2 1 1 4 1733 1 1 26 ASN HB3 H 10.384 -11.970 -0.207 1.00 . A A . 26 ASN HB3 1 1 4 1734 1 1 26 ASN HD21 H 9.926 -9.025 -2.141 1.00 . A A . 26 ASN HD21 1 1 4 1735 1 1 26 ASN HD22 H 11.258 -9.319 -3.232 1.00 . A A . 26 ASN HD22 1 1 4 1736 1 1 26 ASN N N 7.799 -10.917 -2.129 1.00 . A A . 26 ASN N 1 1 4 1737 1 1 26 ASN ND2 N 10.647 -9.639 -2.493 1.00 . A A . 26 ASN ND2 1 1 4 1738 1 1 26 ASN O O 8.153 -12.549 0.912 1.00 . A A . 26 ASN O 1 1 4 1739 1 1 26 ASN OD1 O 11.666 -11.634 -2.358 1.00 . A A . 26 ASN OD1 1 1 4 1740 1 1 27 THR C C 4.654 -14.587 -0.526 1.00 . A A . 27 THR C 1 1 4 1741 1 1 27 THR CA C 5.683 -13.812 0.300 1.00 . A A . 27 THR CA 1 1 4 1742 1 1 27 THR CB C 5.033 -12.940 1.393 1.00 . A A . 27 THR CB 1 1 4 1743 1 1 27 THR CG2 C 3.845 -12.104 0.914 1.00 . A A . 27 THR CG2 1 1 4 1744 1 1 27 THR H H 6.268 -12.972 -1.561 1.00 . A A . 27 THR H 1 1 4 1745 1 1 27 THR HA H 6.318 -14.545 0.802 1.00 . A A . 27 THR HA 1 1 4 1746 1 1 27 THR HB H 5.779 -12.259 1.794 1.00 . A A . 27 THR HB 1 1 4 1747 1 1 27 THR HG1 H 4.242 -13.209 3.150 1.00 . A A . 27 THR HG1 1 1 4 1748 1 1 27 THR HG21 H 4.132 -11.547 0.029 1.00 . A A . 27 THR HG21 1 1 4 1749 1 1 27 THR HG22 H 2.990 -12.740 0.683 1.00 . A A . 27 THR HG22 1 1 4 1750 1 1 27 THR HG23 H 3.555 -11.403 1.695 1.00 . A A . 27 THR HG23 1 1 4 1751 1 1 27 THR N N 6.545 -13.041 -0.591 1.00 . A A . 27 THR N 1 1 4 1752 1 1 27 THR O O 4.420 -15.768 -0.279 1.00 . A A . 27 THR O 1 1 4 1753 1 1 27 THR OG1 O 4.595 -13.765 2.452 1.00 . A A . 27 THR OG1 1 1 4 1754 1 1 28 NH2 HN1 H 4.245 -12.960 -1.702 1.00 . A A . 28 NH2 HN1 1 1 4 1755 1 1 28 NH2 HN2 H 3.349 -14.415 -2.069 1.00 . A A . 28 NH2 HN2 1 1 4 1756 1 1 28 NH2 N N 4.040 -13.934 -1.517 1.00 . A A . 28 NH2 N 1 1 5 1757 1 1 1 SER C C -11.816 -0.215 -0.317 1.00 . A A . 1 SER C 1 1 5 1758 1 1 1 SER CA C -12.710 0.685 -1.168 1.00 . A A . 1 SER CA 1 1 5 1759 1 1 1 SER CB C -14.190 0.398 -0.888 1.00 . A A . 1 SER CB 1 1 5 1760 1 1 1 SER H1 H -11.427 0.786 -2.757 1.00 . A A . 1 SER H1 1 1 5 1761 1 1 1 SER H2 H -12.578 -0.385 -2.909 1.00 . A A . 1 SER H2 1 1 5 1762 1 1 1 SER H3 H -12.980 1.200 -3.128 1.00 . A A . 1 SER H3 1 1 5 1763 1 1 1 SER HA H -12.517 1.718 -0.881 1.00 . A A . 1 SER HA 1 1 5 1764 1 1 1 SER HB2 H -14.448 -0.613 -1.205 1.00 . A A . 1 SER HB2 1 1 5 1765 1 1 1 SER HB3 H -14.379 0.492 0.183 1.00 . A A . 1 SER HB3 1 1 5 1766 1 1 1 SER HG H -14.896 1.198 -2.518 1.00 . A A . 1 SER HG 1 1 5 1767 1 1 1 SER N N -12.399 0.561 -2.603 1.00 . A A . 1 SER N 1 1 5 1768 1 1 1 SER O O -11.140 0.274 0.585 1.00 . A A . 1 SER O 1 1 5 1769 1 1 1 SER OG O -15.007 1.324 -1.572 1.00 . A A . 1 SER OG 1 1 5 1770 1 1 2 GLN C C -11.505 -2.493 1.625 1.00 . A A . 2 GLN C 1 1 5 1771 1 1 2 GLN CA C -11.100 -2.543 0.147 1.00 . A A . 2 GLN CA 1 1 5 1772 1 1 2 GLN CB C -9.586 -2.375 -0.056 1.00 . A A . 2 GLN CB 1 1 5 1773 1 1 2 GLN CD C -7.384 -3.334 0.712 1.00 . A A . 2 GLN CD 1 1 5 1774 1 1 2 GLN CG C -8.827 -3.649 0.337 1.00 . A A . 2 GLN CG 1 1 5 1775 1 1 2 GLN H H -12.393 -1.844 -1.375 1.00 . A A . 2 GLN H 1 1 5 1776 1 1 2 GLN HA H -11.392 -3.513 -0.257 1.00 . A A . 2 GLN HA 1 1 5 1777 1 1 2 GLN HB2 H -9.372 -2.162 -1.105 1.00 . A A . 2 GLN HB2 1 1 5 1778 1 1 2 GLN HB3 H -9.232 -1.535 0.542 1.00 . A A . 2 GLN HB3 1 1 5 1779 1 1 2 GLN HE21 H -7.957 -2.746 2.580 1.00 . A A . 2 GLN HE21 1 1 5 1780 1 1 2 GLN HE22 H -6.234 -2.665 2.246 1.00 . A A . 2 GLN HE22 1 1 5 1781 1 1 2 GLN HG2 H -9.301 -4.130 1.193 1.00 . A A . 2 GLN HG2 1 1 5 1782 1 1 2 GLN HG3 H -8.847 -4.350 -0.498 1.00 . A A . 2 GLN HG3 1 1 5 1783 1 1 2 GLN N N -11.825 -1.524 -0.604 1.00 . A A . 2 GLN N 1 1 5 1784 1 1 2 GLN NE2 N -7.178 -2.869 1.945 1.00 . A A . 2 GLN NE2 1 1 5 1785 1 1 2 GLN O O -10.661 -2.335 2.505 1.00 . A A . 2 GLN O 1 1 5 1786 1 1 2 GLN OE1 O -6.467 -3.508 -0.088 1.00 . A A . 2 GLN OE1 1 1 5 1787 1 1 3 GLY C C -13.469 -0.957 3.566 1.00 . A A . 3 GLY C 1 1 5 1788 1 1 3 GLY CA C -13.378 -2.441 3.219 1.00 . A A . 3 GLY CA 1 1 5 1789 1 1 3 GLY H H -13.453 -2.738 1.121 1.00 . A A . 3 GLY H 1 1 5 1790 1 1 3 GLY HA2 H -14.378 -2.876 3.227 1.00 . A A . 3 GLY HA2 1 1 5 1791 1 1 3 GLY HA3 H -12.769 -2.961 3.961 1.00 . A A . 3 GLY HA3 1 1 5 1792 1 1 3 GLY N N -12.813 -2.602 1.889 1.00 . A A . 3 GLY N 1 1 5 1793 1 1 3 GLY O O -14.561 -0.393 3.584 1.00 . A A . 3 GLY O 1 1 5 1794 1 1 4 THR C C -10.995 1.628 3.344 1.00 . A A . 4 THR C 1 1 5 1795 1 1 4 THR CA C -12.177 1.080 4.140 1.00 . A A . 4 THR CA 1 1 5 1796 1 1 4 THR CB C -11.961 1.263 5.650 1.00 . A A . 4 THR CB 1 1 5 1797 1 1 4 THR CG2 C -11.972 2.743 6.046 1.00 . A A . 4 THR CG2 1 1 5 1798 1 1 4 THR H H -11.459 -0.878 3.780 1.00 . A A . 4 THR H 1 1 5 1799 1 1 4 THR HA H -13.084 1.612 3.847 1.00 . A A . 4 THR HA 1 1 5 1800 1 1 4 THR HB H -11.000 0.831 5.927 1.00 . A A . 4 THR HB 1 1 5 1801 1 1 4 THR HG1 H -12.803 0.678 7.305 1.00 . A A . 4 THR HG1 1 1 5 1802 1 1 4 THR HG21 H -12.922 3.198 5.763 1.00 . A A . 4 THR HG21 1 1 5 1803 1 1 4 THR HG22 H -11.842 2.833 7.125 1.00 . A A . 4 THR HG22 1 1 5 1804 1 1 4 THR HG23 H -11.159 3.275 5.554 1.00 . A A . 4 THR HG23 1 1 5 1805 1 1 4 THR N N -12.313 -0.335 3.828 1.00 . A A . 4 THR N 1 1 5 1806 1 1 4 THR O O -9.930 1.011 3.322 1.00 . A A . 4 THR O 1 1 5 1807 1 1 4 THR OG1 O -12.982 0.598 6.365 1.00 . A A . 4 THR OG1 1 1 5 1808 1 1 5 THR C C -8.849 3.588 2.523 1.00 . A A . 5 THR C 1 1 5 1809 1 1 5 THR CA C -10.194 3.400 1.819 1.00 . A A . 5 THR CA 1 1 5 1810 1 1 5 THR CB C -10.719 4.737 1.274 1.00 . A A . 5 THR CB 1 1 5 1811 1 1 5 THR CG2 C -11.919 4.540 0.342 1.00 . A A . 5 THR CG2 1 1 5 1812 1 1 5 THR H H -12.085 3.233 2.766 1.00 . A A . 5 THR H 1 1 5 1813 1 1 5 THR HA H -10.033 2.724 0.985 1.00 . A A . 5 THR HA 1 1 5 1814 1 1 5 THR HB H -9.922 5.216 0.702 1.00 . A A . 5 THR HB 1 1 5 1815 1 1 5 THR HG1 H -11.851 5.229 2.784 1.00 . A A . 5 THR HG1 1 1 5 1816 1 1 5 THR HG21 H -12.747 4.067 0.869 1.00 . A A . 5 THR HG21 1 1 5 1817 1 1 5 THR HG22 H -12.247 5.510 -0.034 1.00 . A A . 5 THR HG22 1 1 5 1818 1 1 5 THR HG23 H -11.629 3.918 -0.504 1.00 . A A . 5 THR HG23 1 1 5 1819 1 1 5 THR N N -11.187 2.779 2.689 1.00 . A A . 5 THR N 1 1 5 1820 1 1 5 THR O O -7.801 3.319 1.935 1.00 . A A . 5 THR O 1 1 5 1821 1 1 5 THR OG1 O -11.086 5.595 2.335 1.00 . A A . 5 THR OG1 1 1 5 1822 1 1 6 SER C C -6.741 3.125 4.637 1.00 . A A . 6 SER C 1 1 5 1823 1 1 6 SER CA C -7.764 4.264 4.665 1.00 . A A . 6 SER CA 1 1 5 1824 1 1 6 SER CB C -8.282 4.473 6.091 1.00 . A A . 6 SER CB 1 1 5 1825 1 1 6 SER H H -9.806 4.266 4.164 1.00 . A A . 6 SER H 1 1 5 1826 1 1 6 SER HA H -7.274 5.185 4.348 1.00 . A A . 6 SER HA 1 1 5 1827 1 1 6 SER HB2 H -8.699 3.541 6.475 1.00 . A A . 6 SER HB2 1 1 5 1828 1 1 6 SER HB3 H -7.461 4.786 6.738 1.00 . A A . 6 SER HB3 1 1 5 1829 1 1 6 SER HG H -8.925 6.281 5.762 1.00 . A A . 6 SER HG 1 1 5 1830 1 1 6 SER N N -8.899 4.039 3.783 1.00 . A A . 6 SER N 1 1 5 1831 1 1 6 SER O O -5.545 3.387 4.742 1.00 . A A . 6 SER O 1 1 5 1832 1 1 6 SER OG O -9.292 5.461 6.102 1.00 . A A . 6 SER OG 1 1 5 1833 1 1 7 GLU C C -5.325 0.819 3.328 1.00 . A A . 7 GLU C 1 1 5 1834 1 1 7 GLU CA C -6.346 0.698 4.459 1.00 . A A . 7 GLU CA 1 1 5 1835 1 1 7 GLU CB C -7.191 -0.569 4.287 1.00 . A A . 7 GLU CB 1 1 5 1836 1 1 7 GLU CD C -9.071 -1.986 5.203 1.00 . A A . 7 GLU CD 1 1 5 1837 1 1 7 GLU CG C -8.121 -0.822 5.478 1.00 . A A . 7 GLU CG 1 1 5 1838 1 1 7 GLU H H -8.198 1.729 4.387 1.00 . A A . 7 GLU H 1 1 5 1839 1 1 7 GLU HA H -5.810 0.626 5.407 1.00 . A A . 7 GLU HA 1 1 5 1840 1 1 7 GLU HB2 H -7.787 -0.490 3.376 1.00 . A A . 7 GLU HB2 1 1 5 1841 1 1 7 GLU HB3 H -6.514 -1.419 4.192 1.00 . A A . 7 GLU HB3 1 1 5 1842 1 1 7 GLU HG2 H -7.523 -1.052 6.360 1.00 . A A . 7 GLU HG2 1 1 5 1843 1 1 7 GLU HG3 H -8.712 0.070 5.684 1.00 . A A . 7 GLU HG3 1 1 5 1844 1 1 7 GLU N N -7.203 1.875 4.498 1.00 . A A . 7 GLU N 1 1 5 1845 1 1 7 GLU O O -4.124 0.882 3.591 1.00 . A A . 7 GLU O 1 1 5 1846 1 1 7 GLU OE1 O -8.579 -3.024 4.709 1.00 . A A . 7 GLU OE1 1 1 5 1847 1 1 7 GLU OE2 O -10.276 -1.819 5.491 1.00 . A A . 7 GLU OE2 1 1 5 1848 1 1 8 TYR C C -4.173 2.279 0.879 1.00 . A A . 8 TYR C 1 1 5 1849 1 1 8 TYR CA C -4.914 0.946 0.922 1.00 . A A . 8 TYR CA 1 1 5 1850 1 1 8 TYR CB C -5.651 0.658 -0.392 1.00 . A A . 8 TYR CB 1 1 5 1851 1 1 8 TYR CD1 C -6.231 2.919 -1.403 1.00 . A A . 8 TYR CD1 1 1 5 1852 1 1 8 TYR CD2 C -8.033 1.401 -0.802 1.00 . A A . 8 TYR CD2 1 1 5 1853 1 1 8 TYR CE1 C -7.174 3.866 -1.838 1.00 . A A . 8 TYR CE1 1 1 5 1854 1 1 8 TYR CE2 C -8.969 2.309 -1.325 1.00 . A A . 8 TYR CE2 1 1 5 1855 1 1 8 TYR CG C -6.660 1.700 -0.839 1.00 . A A . 8 TYR CG 1 1 5 1856 1 1 8 TYR CZ C -8.544 3.558 -1.805 1.00 . A A . 8 TYR CZ 1 1 5 1857 1 1 8 TYR H H -6.794 0.834 1.915 1.00 . A A . 8 TYR H 1 1 5 1858 1 1 8 TYR HA H -4.162 0.168 1.028 1.00 . A A . 8 TYR HA 1 1 5 1859 1 1 8 TYR HB2 H -4.901 0.567 -1.180 1.00 . A A . 8 TYR HB2 1 1 5 1860 1 1 8 TYR HB3 H -6.141 -0.313 -0.302 1.00 . A A . 8 TYR HB3 1 1 5 1861 1 1 8 TYR HD1 H -5.178 3.143 -1.497 1.00 . A A . 8 TYR HD1 1 1 5 1862 1 1 8 TYR HD2 H -8.367 0.468 -0.378 1.00 . A A . 8 TYR HD2 1 1 5 1863 1 1 8 TYR HE1 H -6.839 4.825 -2.205 1.00 . A A . 8 TYR HE1 1 1 5 1864 1 1 8 TYR HE2 H -10.018 2.055 -1.333 1.00 . A A . 8 TYR HE2 1 1 5 1865 1 1 8 TYR HH H -9.070 5.288 -2.545 1.00 . A A . 8 TYR HH 1 1 5 1866 1 1 8 TYR N N -5.797 0.857 2.075 1.00 . A A . 8 TYR N 1 1 5 1867 1 1 8 TYR O O -3.033 2.302 0.425 1.00 . A A . 8 TYR O 1 1 5 1868 1 1 8 TYR OH O -9.464 4.468 -2.239 1.00 . A A . 8 TYR OH 1 1 5 1869 1 1 9 SER C C -2.840 4.824 1.819 1.00 . A A . 9 SER C 1 1 5 1870 1 1 9 SER CA C -4.268 4.726 1.275 1.00 . A A . 9 SER CA 1 1 5 1871 1 1 9 SER CB C -5.188 5.703 2.010 1.00 . A A . 9 SER CB 1 1 5 1872 1 1 9 SER H H -5.749 3.262 1.695 1.00 . A A . 9 SER H 1 1 5 1873 1 1 9 SER HA H -4.252 5.029 0.228 1.00 . A A . 9 SER HA 1 1 5 1874 1 1 9 SER HB2 H -5.291 5.406 3.053 1.00 . A A . 9 SER HB2 1 1 5 1875 1 1 9 SER HB3 H -4.755 6.703 1.972 1.00 . A A . 9 SER HB3 1 1 5 1876 1 1 9 SER HG H -6.842 4.866 1.409 1.00 . A A . 9 SER HG 1 1 5 1877 1 1 9 SER N N -4.809 3.370 1.337 1.00 . A A . 9 SER N 1 1 5 1878 1 1 9 SER O O -2.076 5.676 1.369 1.00 . A A . 9 SER O 1 1 5 1879 1 1 9 SER OG O -6.457 5.747 1.391 1.00 . A A . 9 SER OG 1 1 5 1880 1 1 10 LYS C C -0.209 3.321 2.142 1.00 . A A . 10 LYS C 1 1 5 1881 1 1 10 LYS CA C -1.107 3.866 3.253 1.00 . A A . 10 LYS CA 1 1 5 1882 1 1 10 LYS CB C -1.042 3.012 4.525 1.00 . A A . 10 LYS CB 1 1 5 1883 1 1 10 LYS CD C -1.911 4.884 6.114 1.00 . A A . 10 LYS CD 1 1 5 1884 1 1 10 LYS CE C -2.769 5.886 5.325 1.00 . A A . 10 LYS CE 1 1 5 1885 1 1 10 LYS CG C -2.031 3.430 5.625 1.00 . A A . 10 LYS CG 1 1 5 1886 1 1 10 LYS H H -3.135 3.276 3.110 1.00 . A A . 10 LYS H 1 1 5 1887 1 1 10 LYS HA H -0.743 4.863 3.503 1.00 . A A . 10 LYS HA 1 1 5 1888 1 1 10 LYS HB2 H -1.256 1.973 4.273 1.00 . A A . 10 LYS HB2 1 1 5 1889 1 1 10 LYS HB3 H -0.029 3.064 4.926 1.00 . A A . 10 LYS HB3 1 1 5 1890 1 1 10 LYS HD2 H -2.268 4.900 7.146 1.00 . A A . 10 LYS HD2 1 1 5 1891 1 1 10 LYS HD3 H -0.866 5.197 6.113 1.00 . A A . 10 LYS HD3 1 1 5 1892 1 1 10 LYS HE2 H -2.344 6.085 4.344 1.00 . A A . 10 LYS HE2 1 1 5 1893 1 1 10 LYS HE3 H -3.777 5.493 5.196 1.00 . A A . 10 LYS HE3 1 1 5 1894 1 1 10 LYS HG2 H -3.052 3.230 5.307 1.00 . A A . 10 LYS HG2 1 1 5 1895 1 1 10 LYS HG3 H -1.828 2.782 6.479 1.00 . A A . 10 LYS HG3 1 1 5 1896 1 1 10 LYS HZ1 H -1.936 7.566 6.141 1.00 . A A . 10 LYS HZ1 1 1 5 1897 1 1 10 LYS HZ2 H -3.431 7.813 5.490 1.00 . A A . 10 LYS HZ2 1 1 5 1898 1 1 10 LYS HZ3 H -3.280 7.036 6.937 1.00 . A A . 10 LYS HZ3 1 1 5 1899 1 1 10 LYS N N -2.469 3.951 2.764 1.00 . A A . 10 LYS N 1 1 5 1900 1 1 10 LYS NZ N -2.861 7.176 6.028 1.00 . A A . 10 LYS NZ 1 1 5 1901 1 1 10 LYS O O 0.674 4.035 1.670 1.00 . A A . 10 LYS O 1 1 5 1902 1 1 11 TYR C C -0.064 1.768 -0.721 1.00 . A A . 11 TYR C 1 1 5 1903 1 1 11 TYR CA C 0.377 1.400 0.696 1.00 . A A . 11 TYR CA 1 1 5 1904 1 1 11 TYR CB C 0.391 -0.110 0.955 1.00 . A A . 11 TYR CB 1 1 5 1905 1 1 11 TYR CD1 C -1.633 -1.366 0.074 1.00 . A A . 11 TYR CD1 1 1 5 1906 1 1 11 TYR CD2 C -1.448 -0.961 2.467 1.00 . A A . 11 TYR CD2 1 1 5 1907 1 1 11 TYR CE1 C -2.787 -2.137 0.294 1.00 . A A . 11 TYR CE1 1 1 5 1908 1 1 11 TYR CE2 C -2.591 -1.746 2.688 1.00 . A A . 11 TYR CE2 1 1 5 1909 1 1 11 TYR CG C -0.955 -0.780 1.161 1.00 . A A . 11 TYR CG 1 1 5 1910 1 1 11 TYR CZ C -3.251 -2.347 1.604 1.00 . A A . 11 TYR CZ 1 1 5 1911 1 1 11 TYR H H -1.297 1.620 1.955 1.00 . A A . 11 TYR H 1 1 5 1912 1 1 11 TYR HA H 1.404 1.745 0.810 1.00 . A A . 11 TYR HA 1 1 5 1913 1 1 11 TYR HB2 H 0.902 -0.594 0.126 1.00 . A A . 11 TYR HB2 1 1 5 1914 1 1 11 TYR HB3 H 0.987 -0.273 1.852 1.00 . A A . 11 TYR HB3 1 1 5 1915 1 1 11 TYR HD1 H -1.258 -1.249 -0.931 1.00 . A A . 11 TYR HD1 1 1 5 1916 1 1 11 TYR HD2 H -0.940 -0.507 3.306 1.00 . A A . 11 TYR HD2 1 1 5 1917 1 1 11 TYR HE1 H -3.307 -2.577 -0.544 1.00 . A A . 11 TYR HE1 1 1 5 1918 1 1 11 TYR HE2 H -2.964 -1.885 3.693 1.00 . A A . 11 TYR HE2 1 1 5 1919 1 1 11 TYR HH H -4.754 -3.450 1.017 1.00 . A A . 11 TYR HH 1 1 5 1920 1 1 11 TYR N N -0.441 2.079 1.694 1.00 . A A . 11 TYR N 1 1 5 1921 1 1 11 TYR O O -0.130 0.935 -1.622 1.00 . A A . 11 TYR O 1 1 5 1922 1 1 11 TYR OH O -4.343 -3.131 1.827 1.00 . A A . 11 TYR OH 1 1 5 1923 1 1 12 LEU C C 0.224 4.927 -2.289 1.00 . A A . 12 LEU C 1 1 5 1924 1 1 12 LEU CA C -0.730 3.743 -2.098 1.00 . A A . 12 LEU CA 1 1 5 1925 1 1 12 LEU CB C -2.199 4.146 -1.913 1.00 . A A . 12 LEU CB 1 1 5 1926 1 1 12 LEU CD1 C -2.513 6.527 -2.851 1.00 . A A . 12 LEU CD1 1 1 5 1927 1 1 12 LEU CD2 C -2.745 4.510 -4.372 1.00 . A A . 12 LEU CD2 1 1 5 1928 1 1 12 LEU CG C -2.897 5.045 -2.945 1.00 . A A . 12 LEU CG 1 1 5 1929 1 1 12 LEU H H -0.268 3.642 -0.070 1.00 . A A . 12 LEU H 1 1 5 1930 1 1 12 LEU HA H -0.642 3.047 -2.927 1.00 . A A . 12 LEU HA 1 1 5 1931 1 1 12 LEU HB2 H -2.758 3.210 -1.885 1.00 . A A . 12 LEU HB2 1 1 5 1932 1 1 12 LEU HB3 H -2.291 4.621 -0.941 1.00 . A A . 12 LEU HB3 1 1 5 1933 1 1 12 LEU HD11 H -1.529 6.719 -3.269 1.00 . A A . 12 LEU HD11 1 1 5 1934 1 1 12 LEU HD12 H -3.238 7.117 -3.413 1.00 . A A . 12 LEU HD12 1 1 5 1935 1 1 12 LEU HD13 H -2.534 6.853 -1.810 1.00 . A A . 12 LEU HD13 1 1 5 1936 1 1 12 LEU HD21 H -3.353 5.107 -5.052 1.00 . A A . 12 LEU HD21 1 1 5 1937 1 1 12 LEU HD22 H -1.705 4.561 -4.692 1.00 . A A . 12 LEU HD22 1 1 5 1938 1 1 12 LEU HD23 H -3.082 3.474 -4.414 1.00 . A A . 12 LEU HD23 1 1 5 1939 1 1 12 LEU HG H -3.955 5.005 -2.682 1.00 . A A . 12 LEU HG 1 1 5 1940 1 1 12 LEU N N -0.343 3.058 -0.886 1.00 . A A . 12 LEU N 1 1 5 1941 1 1 12 LEU O O 0.500 5.321 -3.420 1.00 . A A . 12 LEU O 1 1 5 1942 1 1 13 ASP C C 3.041 6.239 -1.559 1.00 . A A . 13 ASP C 1 1 5 1943 1 1 13 ASP CA C 1.620 6.620 -1.096 1.00 . A A . 13 ASP CA 1 1 5 1944 1 1 13 ASP CB C 1.511 7.130 0.351 1.00 . A A . 13 ASP CB 1 1 5 1945 1 1 13 ASP CG C 2.149 8.499 0.573 1.00 . A A . 13 ASP CG 1 1 5 1946 1 1 13 ASP H H 0.489 5.080 -0.277 1.00 . A A . 13 ASP H 1 1 5 1947 1 1 13 ASP HA H 1.244 7.394 -1.767 1.00 . A A . 13 ASP HA 1 1 5 1948 1 1 13 ASP HB2 H 0.449 7.216 0.600 1.00 . A A . 13 ASP HB2 1 1 5 1949 1 1 13 ASP HB3 H 1.941 6.387 1.023 1.00 . A A . 13 ASP HB3 1 1 5 1950 1 1 13 ASP N N 0.734 5.475 -1.174 1.00 . A A . 13 ASP N 1 1 5 1951 1 1 13 ASP O O 3.185 5.535 -2.557 1.00 . A A . 13 ASP O 1 1 5 1952 1 1 13 ASP OD1 O 1.596 9.482 0.033 1.00 . A A . 13 ASP OD1 1 1 5 1953 1 1 13 ASP OD2 O 3.181 8.535 1.277 1.00 . A A . 13 ASP OD2 1 1 5 1954 1 1 14 SER C C 6.118 5.308 -0.680 1.00 . A A . 14 SER C 1 1 5 1955 1 1 14 SER CA C 5.474 6.539 -1.323 1.00 . A A . 14 SER CA 1 1 5 1956 1 1 14 SER CB C 6.246 7.844 -1.081 1.00 . A A . 14 SER CB 1 1 5 1957 1 1 14 SER H H 3.958 7.269 -0.052 1.00 . A A . 14 SER H 1 1 5 1958 1 1 14 SER HA H 5.497 6.380 -2.402 1.00 . A A . 14 SER HA 1 1 5 1959 1 1 14 SER HB2 H 7.293 7.717 -1.360 1.00 . A A . 14 SER HB2 1 1 5 1960 1 1 14 SER HB3 H 5.814 8.630 -1.703 1.00 . A A . 14 SER HB3 1 1 5 1961 1 1 14 SER HG H 6.587 9.096 0.370 1.00 . A A . 14 SER HG 1 1 5 1962 1 1 14 SER N N 4.096 6.712 -0.882 1.00 . A A . 14 SER N 1 1 5 1963 1 1 14 SER O O 5.887 4.195 -1.149 1.00 . A A . 14 SER O 1 1 5 1964 1 1 14 SER OG O 6.153 8.245 0.271 1.00 . A A . 14 SER OG 1 1 5 1965 1 1 15 ARG C C 6.999 3.220 1.280 1.00 . A A . 15 ARG C 1 1 5 1966 1 1 15 ARG CA C 7.780 4.496 0.992 1.00 . A A . 15 ARG CA 1 1 5 1967 1 1 15 ARG CB C 8.416 5.080 2.267 1.00 . A A . 15 ARG CB 1 1 5 1968 1 1 15 ARG CD C 8.824 2.976 3.714 1.00 . A A . 15 ARG CD 1 1 5 1969 1 1 15 ARG CG C 9.441 4.170 2.968 1.00 . A A . 15 ARG CG 1 1 5 1970 1 1 15 ARG CZ C 9.524 1.290 5.403 1.00 . A A . 15 ARG CZ 1 1 5 1971 1 1 15 ARG H H 7.039 6.462 0.691 1.00 . A A . 15 ARG H 1 1 5 1972 1 1 15 ARG HA H 8.588 4.253 0.300 1.00 . A A . 15 ARG HA 1 1 5 1973 1 1 15 ARG HB2 H 8.943 5.992 1.980 1.00 . A A . 15 ARG HB2 1 1 5 1974 1 1 15 ARG HB3 H 7.642 5.355 2.982 1.00 . A A . 15 ARG HB3 1 1 5 1975 1 1 15 ARG HD2 H 7.934 3.297 4.257 1.00 . A A . 15 ARG HD2 1 1 5 1976 1 1 15 ARG HD3 H 8.558 2.190 3.009 1.00 . A A . 15 ARG HD3 1 1 5 1977 1 1 15 ARG HE H 10.672 2.836 4.757 1.00 . A A . 15 ARG HE 1 1 5 1978 1 1 15 ARG HG2 H 10.176 3.812 2.246 1.00 . A A . 15 ARG HG2 1 1 5 1979 1 1 15 ARG HG3 H 9.958 4.788 3.704 1.00 . A A . 15 ARG HG3 1 1 5 1980 1 1 15 ARG HH11 H 7.619 1.005 4.712 1.00 . A A . 15 ARG HH11 1 1 5 1981 1 1 15 ARG HH12 H 8.174 -0.166 5.884 1.00 . A A . 15 ARG HH12 1 1 5 1982 1 1 15 ARG HH21 H 11.365 1.285 6.288 1.00 . A A . 15 ARG HH21 1 1 5 1983 1 1 15 ARG HH22 H 10.293 -0.007 6.779 1.00 . A A . 15 ARG HH22 1 1 5 1984 1 1 15 ARG N N 6.949 5.513 0.353 1.00 . A A . 15 ARG N 1 1 5 1985 1 1 15 ARG NE N 9.771 2.388 4.667 1.00 . A A . 15 ARG NE 1 1 5 1986 1 1 15 ARG NH1 N 8.342 0.660 5.328 1.00 . A A . 15 ARG NH1 1 1 5 1987 1 1 15 ARG NH2 N 10.471 0.818 6.224 1.00 . A A . 15 ARG NH2 1 1 5 1988 1 1 15 ARG O O 7.344 2.160 0.758 1.00 . A A . 15 ARG O 1 1 5 1989 1 1 16 ARG C C 4.574 1.368 1.474 1.00 . A A . 16 ARG C 1 1 5 1990 1 1 16 ARG CA C 5.243 2.154 2.607 1.00 . A A . 16 ARG CA 1 1 5 1991 1 1 16 ARG CB C 4.282 2.528 3.739 1.00 . A A . 16 ARG CB 1 1 5 1992 1 1 16 ARG CD C 2.956 4.706 3.876 1.00 . A A . 16 ARG CD 1 1 5 1993 1 1 16 ARG CG C 3.047 3.305 3.272 1.00 . A A . 16 ARG CG 1 1 5 1994 1 1 16 ARG CZ C 4.948 6.226 3.651 1.00 . A A . 16 ARG CZ 1 1 5 1995 1 1 16 ARG H H 5.728 4.219 2.508 1.00 . A A . 16 ARG H 1 1 5 1996 1 1 16 ARG HA H 5.975 1.498 3.073 1.00 . A A . 16 ARG HA 1 1 5 1997 1 1 16 ARG HB2 H 3.939 1.601 4.201 1.00 . A A . 16 ARG HB2 1 1 5 1998 1 1 16 ARG HB3 H 4.826 3.091 4.498 1.00 . A A . 16 ARG HB3 1 1 5 1999 1 1 16 ARG HD2 H 1.934 5.058 3.741 1.00 . A A . 16 ARG HD2 1 1 5 2000 1 1 16 ARG HD3 H 3.149 4.661 4.947 1.00 . A A . 16 ARG HD3 1 1 5 2001 1 1 16 ARG HE H 3.521 5.924 2.246 1.00 . A A . 16 ARG HE 1 1 5 2002 1 1 16 ARG HG2 H 3.031 3.394 2.188 1.00 . A A . 16 ARG HG2 1 1 5 2003 1 1 16 ARG HG3 H 2.170 2.739 3.587 1.00 . A A . 16 ARG HG3 1 1 5 2004 1 1 16 ARG HH11 H 4.994 5.209 5.429 1.00 . A A . 16 ARG HH11 1 1 5 2005 1 1 16 ARG HH12 H 6.290 6.352 5.183 1.00 . A A . 16 ARG HH12 1 1 5 2006 1 1 16 ARG HH21 H 5.233 7.393 1.994 1.00 . A A . 16 ARG HH21 1 1 5 2007 1 1 16 ARG HH22 H 6.427 7.575 3.257 1.00 . A A . 16 ARG HH22 1 1 5 2008 1 1 16 ARG N N 5.973 3.316 2.132 1.00 . A A . 16 ARG N 1 1 5 2009 1 1 16 ARG NE N 3.829 5.656 3.172 1.00 . A A . 16 ARG NE 1 1 5 2010 1 1 16 ARG NH1 N 5.448 5.902 4.853 1.00 . A A . 16 ARG NH1 1 1 5 2011 1 1 16 ARG NH2 N 5.586 7.139 2.907 1.00 . A A . 16 ARG NH2 1 1 5 2012 1 1 16 ARG O O 4.354 0.171 1.625 1.00 . A A . 16 ARG O 1 1 5 2013 1 1 17 ALA C C 4.803 0.483 -1.482 1.00 . A A . 17 ALA C 1 1 5 2014 1 1 17 ALA CA C 3.729 1.350 -0.830 1.00 . A A . 17 ALA CA 1 1 5 2015 1 1 17 ALA CB C 3.151 2.374 -1.808 1.00 . A A . 17 ALA CB 1 1 5 2016 1 1 17 ALA H H 4.482 3.003 0.262 1.00 . A A . 17 ALA H 1 1 5 2017 1 1 17 ALA HA H 2.914 0.696 -0.523 1.00 . A A . 17 ALA HA 1 1 5 2018 1 1 17 ALA HB1 H 2.453 3.028 -1.287 1.00 . A A . 17 ALA HB1 1 1 5 2019 1 1 17 ALA HB2 H 3.944 2.978 -2.239 1.00 . A A . 17 ALA HB2 1 1 5 2020 1 1 17 ALA HB3 H 2.626 1.857 -2.612 1.00 . A A . 17 ALA HB3 1 1 5 2021 1 1 17 ALA N N 4.268 2.019 0.343 1.00 . A A . 17 ALA N 1 1 5 2022 1 1 17 ALA O O 4.530 -0.664 -1.825 1.00 . A A . 17 ALA O 1 1 5 2023 1 1 18 GLN C C 7.466 -0.945 -1.297 1.00 . A A . 18 GLN C 1 1 5 2024 1 1 18 GLN CA C 7.127 0.240 -2.202 1.00 . A A . 18 GLN CA 1 1 5 2025 1 1 18 GLN CB C 8.381 1.103 -2.428 1.00 . A A . 18 GLN CB 1 1 5 2026 1 1 18 GLN CD C 7.113 2.484 -4.173 1.00 . A A . 18 GLN CD 1 1 5 2027 1 1 18 GLN CG C 8.139 2.487 -3.042 1.00 . A A . 18 GLN CG 1 1 5 2028 1 1 18 GLN H H 6.207 1.951 -1.315 1.00 . A A . 18 GLN H 1 1 5 2029 1 1 18 GLN HA H 6.799 -0.159 -3.164 1.00 . A A . 18 GLN HA 1 1 5 2030 1 1 18 GLN HB2 H 8.895 1.253 -1.477 1.00 . A A . 18 GLN HB2 1 1 5 2031 1 1 18 GLN HB3 H 9.049 0.545 -3.085 1.00 . A A . 18 GLN HB3 1 1 5 2032 1 1 18 GLN HE21 H 5.840 3.656 -3.094 1.00 . A A . 18 GLN HE21 1 1 5 2033 1 1 18 GLN HE22 H 5.283 3.209 -4.695 1.00 . A A . 18 GLN HE22 1 1 5 2034 1 1 18 GLN HG2 H 7.825 3.166 -2.254 1.00 . A A . 18 GLN HG2 1 1 5 2035 1 1 18 GLN HG3 H 9.086 2.861 -3.434 1.00 . A A . 18 GLN HG3 1 1 5 2036 1 1 18 GLN N N 6.026 1.009 -1.636 1.00 . A A . 18 GLN N 1 1 5 2037 1 1 18 GLN NE2 N 5.989 3.177 -3.974 1.00 . A A . 18 GLN NE2 1 1 5 2038 1 1 18 GLN O O 7.706 -2.047 -1.786 1.00 . A A . 18 GLN O 1 1 5 2039 1 1 18 GLN OE1 O 7.332 1.867 -5.212 1.00 . A A . 18 GLN OE1 1 1 5 2040 1 1 19 ASP C C 6.669 -2.811 0.989 1.00 . A A . 19 ASP C 1 1 5 2041 1 1 19 ASP CA C 7.751 -1.730 1.023 1.00 . A A . 19 ASP CA 1 1 5 2042 1 1 19 ASP CB C 7.844 -1.077 2.405 1.00 . A A . 19 ASP CB 1 1 5 2043 1 1 19 ASP CG C 8.201 -2.098 3.481 1.00 . A A . 19 ASP CG 1 1 5 2044 1 1 19 ASP H H 7.244 0.217 0.345 1.00 . A A . 19 ASP H 1 1 5 2045 1 1 19 ASP HA H 8.717 -2.184 0.797 1.00 . A A . 19 ASP HA 1 1 5 2046 1 1 19 ASP HB2 H 8.612 -0.303 2.385 1.00 . A A . 19 ASP HB2 1 1 5 2047 1 1 19 ASP HB3 H 6.889 -0.613 2.652 1.00 . A A . 19 ASP HB3 1 1 5 2048 1 1 19 ASP N N 7.476 -0.712 0.021 1.00 . A A . 19 ASP N 1 1 5 2049 1 1 19 ASP O O 6.980 -3.998 1.043 1.00 . A A . 19 ASP O 1 1 5 2050 1 1 19 ASP OD1 O 9.398 -2.451 3.555 1.00 . A A . 19 ASP OD1 1 1 5 2051 1 1 19 ASP OD2 O 7.272 -2.508 4.210 1.00 . A A . 19 ASP OD2 1 1 5 2052 1 1 20 PHE C C 4.366 -4.131 -0.506 1.00 . A A . 20 PHE C 1 1 5 2053 1 1 20 PHE CA C 4.265 -3.290 0.767 1.00 . A A . 20 PHE CA 1 1 5 2054 1 1 20 PHE CB C 2.966 -2.481 0.800 1.00 . A A . 20 PHE CB 1 1 5 2055 1 1 20 PHE CD1 C 1.097 -3.762 1.927 1.00 . A A . 20 PHE CD1 1 1 5 2056 1 1 20 PHE CD2 C 1.112 -3.610 -0.504 1.00 . A A . 20 PHE CD2 1 1 5 2057 1 1 20 PHE CE1 C -0.099 -4.499 1.873 1.00 . A A . 20 PHE CE1 1 1 5 2058 1 1 20 PHE CE2 C -0.077 -4.358 -0.557 1.00 . A A . 20 PHE CE2 1 1 5 2059 1 1 20 PHE CG C 1.703 -3.315 0.739 1.00 . A A . 20 PHE CG 1 1 5 2060 1 1 20 PHE CZ C -0.683 -4.802 0.631 1.00 . A A . 20 PHE CZ 1 1 5 2061 1 1 20 PHE H H 5.215 -1.400 0.878 1.00 . A A . 20 PHE H 1 1 5 2062 1 1 20 PHE HA H 4.261 -3.957 1.630 1.00 . A A . 20 PHE HA 1 1 5 2063 1 1 20 PHE HB2 H 2.942 -1.910 1.728 1.00 . A A . 20 PHE HB2 1 1 5 2064 1 1 20 PHE HB3 H 2.966 -1.778 -0.032 1.00 . A A . 20 PHE HB3 1 1 5 2065 1 1 20 PHE HD1 H 1.546 -3.535 2.884 1.00 . A A . 20 PHE HD1 1 1 5 2066 1 1 20 PHE HD2 H 1.569 -3.259 -1.418 1.00 . A A . 20 PHE HD2 1 1 5 2067 1 1 20 PHE HE1 H -0.567 -4.836 2.787 1.00 . A A . 20 PHE HE1 1 1 5 2068 1 1 20 PHE HE2 H -0.530 -4.583 -1.511 1.00 . A A . 20 PHE HE2 1 1 5 2069 1 1 20 PHE HZ H -1.599 -5.372 0.590 1.00 . A A . 20 PHE HZ 1 1 5 2070 1 1 20 PHE N N 5.402 -2.394 0.888 1.00 . A A . 20 PHE N 1 1 5 2071 1 1 20 PHE O O 4.051 -5.316 -0.471 1.00 . A A . 20 PHE O 1 1 5 2072 1 1 21 VAL C C 6.062 -5.341 -2.705 1.00 . A A . 21 VAL C 1 1 5 2073 1 1 21 VAL CA C 4.959 -4.300 -2.867 1.00 . A A . 21 VAL CA 1 1 5 2074 1 1 21 VAL CB C 5.195 -3.353 -4.055 1.00 . A A . 21 VAL CB 1 1 5 2075 1 1 21 VAL CG1 C 5.701 -4.106 -5.294 1.00 . A A . 21 VAL CG1 1 1 5 2076 1 1 21 VAL CG2 C 3.881 -2.648 -4.413 1.00 . A A . 21 VAL CG2 1 1 5 2077 1 1 21 VAL H H 5.068 -2.564 -1.622 1.00 . A A . 21 VAL H 1 1 5 2078 1 1 21 VAL HA H 4.040 -4.857 -3.037 1.00 . A A . 21 VAL HA 1 1 5 2079 1 1 21 VAL HB H 5.939 -2.603 -3.784 1.00 . A A . 21 VAL HB 1 1 5 2080 1 1 21 VAL HG11 H 6.704 -4.496 -5.122 1.00 . A A . 21 VAL HG11 1 1 5 2081 1 1 21 VAL HG12 H 5.029 -4.932 -5.529 1.00 . A A . 21 VAL HG12 1 1 5 2082 1 1 21 VAL HG13 H 5.743 -3.425 -6.144 1.00 . A A . 21 VAL HG13 1 1 5 2083 1 1 21 VAL HG21 H 3.163 -3.376 -4.793 1.00 . A A . 21 VAL HG21 1 1 5 2084 1 1 21 VAL HG22 H 3.453 -2.165 -3.537 1.00 . A A . 21 VAL HG22 1 1 5 2085 1 1 21 VAL HG23 H 4.066 -1.894 -5.177 1.00 . A A . 21 VAL HG23 1 1 5 2086 1 1 21 VAL N N 4.806 -3.545 -1.628 1.00 . A A . 21 VAL N 1 1 5 2087 1 1 21 VAL O O 5.826 -6.523 -2.936 1.00 . A A . 21 VAL O 1 1 5 2088 1 1 22 GLN C C 7.927 -6.931 -1.057 1.00 . A A . 22 GLN C 1 1 5 2089 1 1 22 GLN CA C 8.373 -5.748 -1.918 1.00 . A A . 22 GLN CA 1 1 5 2090 1 1 22 GLN CB C 9.425 -4.858 -1.241 1.00 . A A . 22 GLN CB 1 1 5 2091 1 1 22 GLN CD C 10.174 -6.344 0.713 1.00 . A A . 22 GLN CD 1 1 5 2092 1 1 22 GLN CG C 10.575 -5.612 -0.564 1.00 . A A . 22 GLN CG 1 1 5 2093 1 1 22 GLN H H 7.356 -3.904 -2.126 1.00 . A A . 22 GLN H 1 1 5 2094 1 1 22 GLN HA H 8.826 -6.161 -2.813 1.00 . A A . 22 GLN HA 1 1 5 2095 1 1 22 GLN HB2 H 9.858 -4.224 -2.015 1.00 . A A . 22 GLN HB2 1 1 5 2096 1 1 22 GLN HB3 H 8.949 -4.198 -0.521 1.00 . A A . 22 GLN HB3 1 1 5 2097 1 1 22 GLN HE21 H 9.024 -4.774 1.354 1.00 . A A . 22 GLN HE21 1 1 5 2098 1 1 22 GLN HE22 H 8.936 -6.235 2.295 1.00 . A A . 22 GLN HE22 1 1 5 2099 1 1 22 GLN HG2 H 10.979 -6.330 -1.276 1.00 . A A . 22 GLN HG2 1 1 5 2100 1 1 22 GLN HG3 H 11.338 -4.883 -0.298 1.00 . A A . 22 GLN HG3 1 1 5 2101 1 1 22 GLN N N 7.246 -4.899 -2.275 1.00 . A A . 22 GLN N 1 1 5 2102 1 1 22 GLN NE2 N 9.347 -5.712 1.544 1.00 . A A . 22 GLN NE2 1 1 5 2103 1 1 22 GLN O O 8.379 -8.055 -1.265 1.00 . A A . 22 GLN O 1 1 5 2104 1 1 22 GLN OE1 O 10.582 -7.482 0.933 1.00 . A A . 22 GLN OE1 1 1 5 2105 1 1 23 TRP C C 5.697 -8.655 0.245 1.00 . A A . 23 TRP C 1 1 5 2106 1 1 23 TRP CA C 6.627 -7.640 0.900 1.00 . A A . 23 TRP CA 1 1 5 2107 1 1 23 TRP CB C 5.934 -6.898 2.043 1.00 . A A . 23 TRP CB 1 1 5 2108 1 1 23 TRP CD1 C 5.538 -8.684 3.769 1.00 . A A . 23 TRP CD1 1 1 5 2109 1 1 23 TRP CD2 C 3.645 -7.951 2.835 1.00 . A A . 23 TRP CD2 1 1 5 2110 1 1 23 TRP CE2 C 3.280 -8.973 3.755 1.00 . A A . 23 TRP CE2 1 1 5 2111 1 1 23 TRP CE3 C 2.623 -7.385 2.050 1.00 . A A . 23 TRP CE3 1 1 5 2112 1 1 23 TRP CG C 5.083 -7.770 2.895 1.00 . A A . 23 TRP CG 1 1 5 2113 1 1 23 TRP CH2 C 0.952 -8.800 3.128 1.00 . A A . 23 TRP CH2 1 1 5 2114 1 1 23 TRP CZ2 C 1.952 -9.391 3.916 1.00 . A A . 23 TRP CZ2 1 1 5 2115 1 1 23 TRP CZ3 C 1.289 -7.809 2.188 1.00 . A A . 23 TRP CZ3 1 1 5 2116 1 1 23 TRP H H 6.653 -5.743 -0.026 1.00 . A A . 23 TRP H 1 1 5 2117 1 1 23 TRP HA H 7.495 -8.165 1.303 1.00 . A A . 23 TRP HA 1 1 5 2118 1 1 23 TRP HB2 H 6.681 -6.406 2.665 1.00 . A A . 23 TRP HB2 1 1 5 2119 1 1 23 TRP HB3 H 5.283 -6.129 1.634 1.00 . A A . 23 TRP HB3 1 1 5 2120 1 1 23 TRP HD1 H 6.589 -8.848 3.943 1.00 . A A . 23 TRP HD1 1 1 5 2121 1 1 23 TRP HE1 H 4.533 -10.104 5.013 1.00 . A A . 23 TRP HE1 1 1 5 2122 1 1 23 TRP HE3 H 2.903 -6.638 1.319 1.00 . A A . 23 TRP HE3 1 1 5 2123 1 1 23 TRP HH2 H -0.072 -9.119 3.241 1.00 . A A . 23 TRP HH2 1 1 5 2124 1 1 23 TRP HZ2 H 1.704 -10.167 4.625 1.00 . A A . 23 TRP HZ2 1 1 5 2125 1 1 23 TRP HZ3 H 0.521 -7.381 1.561 1.00 . A A . 23 TRP HZ3 1 1 5 2126 1 1 23 TRP N N 7.054 -6.669 -0.083 1.00 . A A . 23 TRP N 1 1 5 2127 1 1 23 TRP NE1 N 4.475 -9.371 4.322 1.00 . A A . 23 TRP NE1 1 1 5 2128 1 1 23 TRP O O 5.955 -9.854 0.285 1.00 . A A . 23 TRP O 1 1 5 2129 1 1 24 LEU C C 4.285 -9.859 -2.090 1.00 . A A . 24 LEU C 1 1 5 2130 1 1 24 LEU CA C 3.619 -8.916 -1.086 1.00 . A A . 24 LEU CA 1 1 5 2131 1 1 24 LEU CB C 2.694 -7.916 -1.790 1.00 . A A . 24 LEU CB 1 1 5 2132 1 1 24 LEU CD1 C 0.622 -9.389 -1.692 1.00 . A A . 24 LEU CD1 1 1 5 2133 1 1 24 LEU CD2 C 0.741 -7.455 -3.273 1.00 . A A . 24 LEU CD2 1 1 5 2134 1 1 24 LEU CG C 1.551 -8.561 -2.589 1.00 . A A . 24 LEU CG 1 1 5 2135 1 1 24 LEU H H 4.485 -7.152 -0.304 1.00 . A A . 24 LEU H 1 1 5 2136 1 1 24 LEU HA H 3.049 -9.496 -0.360 1.00 . A A . 24 LEU HA 1 1 5 2137 1 1 24 LEU HB2 H 2.270 -7.251 -1.037 1.00 . A A . 24 LEU HB2 1 1 5 2138 1 1 24 LEU HB3 H 3.302 -7.314 -2.468 1.00 . A A . 24 LEU HB3 1 1 5 2139 1 1 24 LEU HD11 H -0.233 -9.736 -2.273 1.00 . A A . 24 LEU HD11 1 1 5 2140 1 1 24 LEU HD12 H 1.146 -10.262 -1.303 1.00 . A A . 24 LEU HD12 1 1 5 2141 1 1 24 LEU HD13 H 0.264 -8.781 -0.861 1.00 . A A . 24 LEU HD13 1 1 5 2142 1 1 24 LEU HD21 H 0.297 -6.799 -2.524 1.00 . A A . 24 LEU HD21 1 1 5 2143 1 1 24 LEU HD22 H 1.391 -6.868 -3.923 1.00 . A A . 24 LEU HD22 1 1 5 2144 1 1 24 LEU HD23 H -0.052 -7.896 -3.877 1.00 . A A . 24 LEU HD23 1 1 5 2145 1 1 24 LEU HG H 1.961 -9.206 -3.366 1.00 . A A . 24 LEU HG 1 1 5 2146 1 1 24 LEU N N 4.617 -8.152 -0.355 1.00 . A A . 24 LEU N 1 1 5 2147 1 1 24 LEU O O 3.862 -11.002 -2.249 1.00 . A A . 24 LEU O 1 1 5 2148 1 1 25 MET C C 6.919 -11.222 -3.021 1.00 . A A . 25 MET C 1 1 5 2149 1 1 25 MET CA C 6.117 -10.125 -3.718 1.00 . A A . 25 MET CA 1 1 5 2150 1 1 25 MET CB C 7.066 -9.183 -4.466 1.00 . A A . 25 MET CB 1 1 5 2151 1 1 25 MET CE C 4.950 -7.863 -7.851 1.00 . A A . 25 MET CE 1 1 5 2152 1 1 25 MET CG C 6.335 -8.323 -5.504 1.00 . A A . 25 MET CG 1 1 5 2153 1 1 25 MET H H 5.630 -8.425 -2.526 1.00 . A A . 25 MET H 1 1 5 2154 1 1 25 MET HA H 5.438 -10.594 -4.430 1.00 . A A . 25 MET HA 1 1 5 2155 1 1 25 MET HB2 H 7.567 -8.540 -3.741 1.00 . A A . 25 MET HB2 1 1 5 2156 1 1 25 MET HB3 H 7.825 -9.779 -4.974 1.00 . A A . 25 MET HB3 1 1 5 2157 1 1 25 MET HE1 H 5.699 -7.106 -8.084 1.00 . A A . 25 MET HE1 1 1 5 2158 1 1 25 MET HE2 H 4.518 -8.241 -8.778 1.00 . A A . 25 MET HE2 1 1 5 2159 1 1 25 MET HE3 H 4.163 -7.421 -7.240 1.00 . A A . 25 MET HE3 1 1 5 2160 1 1 25 MET HG2 H 5.484 -7.830 -5.038 1.00 . A A . 25 MET HG2 1 1 5 2161 1 1 25 MET HG3 H 7.026 -7.557 -5.858 1.00 . A A . 25 MET HG3 1 1 5 2162 1 1 25 MET N N 5.338 -9.369 -2.751 1.00 . A A . 25 MET N 1 1 5 2163 1 1 25 MET O O 6.808 -12.390 -3.387 1.00 . A A . 25 MET O 1 1 5 2164 1 1 25 MET SD S 5.725 -9.230 -6.950 1.00 . A A . 25 MET SD 1 1 5 2165 1 1 26 ASN C C 7.812 -12.912 -0.694 1.00 . A A . 26 ASN C 1 1 5 2166 1 1 26 ASN CA C 8.599 -11.737 -1.280 1.00 . A A . 26 ASN CA 1 1 5 2167 1 1 26 ASN CB C 9.316 -10.946 -0.179 1.00 . A A . 26 ASN CB 1 1 5 2168 1 1 26 ASN CG C 10.230 -11.840 0.653 1.00 . A A . 26 ASN CG 1 1 5 2169 1 1 26 ASN H H 7.764 -9.855 -1.783 1.00 . A A . 26 ASN H 1 1 5 2170 1 1 26 ASN HA H 9.350 -12.130 -1.967 1.00 . A A . 26 ASN HA 1 1 5 2171 1 1 26 ASN HB2 H 9.916 -10.157 -0.631 1.00 . A A . 26 ASN HB2 1 1 5 2172 1 1 26 ASN HB3 H 8.579 -10.486 0.480 1.00 . A A . 26 ASN HB3 1 1 5 2173 1 1 26 ASN HD21 H 11.556 -12.007 -0.885 1.00 . A A . 26 ASN HD21 1 1 5 2174 1 1 26 ASN HD22 H 11.978 -12.872 0.577 1.00 . A A . 26 ASN HD22 1 1 5 2175 1 1 26 ASN N N 7.732 -10.836 -2.029 1.00 . A A . 26 ASN N 1 1 5 2176 1 1 26 ASN ND2 N 11.347 -12.273 0.066 1.00 . A A . 26 ASN ND2 1 1 5 2177 1 1 26 ASN O O 8.261 -14.054 -0.765 1.00 . A A . 26 ASN O 1 1 5 2178 1 1 26 ASN OD1 O 9.931 -12.137 1.807 1.00 . A A . 26 ASN OD1 1 1 5 2179 1 1 27 THR C C 5.099 -14.454 -0.662 1.00 . A A . 27 THR C 1 1 5 2180 1 1 27 THR CA C 5.746 -13.619 0.446 1.00 . A A . 27 THR CA 1 1 5 2181 1 1 27 THR CB C 4.703 -12.929 1.338 1.00 . A A . 27 THR CB 1 1 5 2182 1 1 27 THR CG2 C 5.377 -12.269 2.543 1.00 . A A . 27 THR CG2 1 1 5 2183 1 1 27 THR H H 6.336 -11.661 -0.103 1.00 . A A . 27 THR H 1 1 5 2184 1 1 27 THR HA H 6.329 -14.293 1.076 1.00 . A A . 27 THR HA 1 1 5 2185 1 1 27 THR HB H 4.000 -13.680 1.702 1.00 . A A . 27 THR HB 1 1 5 2186 1 1 27 THR HG1 H 4.580 -11.222 0.406 1.00 . A A . 27 THR HG1 1 1 5 2187 1 1 27 THR HG21 H 4.610 -11.828 3.176 1.00 . A A . 27 THR HG21 1 1 5 2188 1 1 27 THR HG22 H 5.930 -13.015 3.111 1.00 . A A . 27 THR HG22 1 1 5 2189 1 1 27 THR HG23 H 6.066 -11.487 2.224 1.00 . A A . 27 THR HG23 1 1 5 2190 1 1 27 THR N N 6.639 -12.624 -0.124 1.00 . A A . 27 THR N 1 1 5 2191 1 1 27 THR O O 5.179 -15.680 -0.641 1.00 . A A . 27 THR O 1 1 5 2192 1 1 27 THR OG1 O 3.984 -11.943 0.627 1.00 . A A . 27 THR OG1 1 1 5 2193 1 1 28 NH2 HN1 H 4.398 -12.792 -1.614 1.00 . A A . 28 NH2 HN1 1 1 5 2194 1 1 28 NH2 HN2 H 4.031 -14.320 -2.389 1.00 . A A . 28 NH2 HN2 1 1 5 2195 1 1 28 NH2 N N 4.459 -13.802 -1.636 1.00 . A A . 28 NH2 N 1 1 6 2196 1 1 1 SER C C -12.675 14.300 -1.305 1.00 . A A . 1 SER C 1 1 6 2197 1 1 1 SER CA C -13.281 14.771 0.017 1.00 . A A . 1 SER CA 1 1 6 2198 1 1 1 SER CB C -13.304 16.302 0.086 1.00 . A A . 1 SER CB 1 1 6 2199 1 1 1 SER H1 H -13.012 14.517 2.026 1.00 . A A . 1 SER H1 1 1 6 2200 1 1 1 SER H2 H -12.595 13.195 1.130 1.00 . A A . 1 SER H2 1 1 6 2201 1 1 1 SER H3 H -11.607 14.516 1.165 1.00 . A A . 1 SER H3 1 1 6 2202 1 1 1 SER HA H -14.313 14.417 0.063 1.00 . A A . 1 SER HA 1 1 6 2203 1 1 1 SER HB2 H -12.286 16.693 0.064 1.00 . A A . 1 SER HB2 1 1 6 2204 1 1 1 SER HB3 H -13.855 16.699 -0.768 1.00 . A A . 1 SER HB3 1 1 6 2205 1 1 1 SER HG H -14.835 16.398 1.283 1.00 . A A . 1 SER HG 1 1 6 2206 1 1 1 SER N N -12.568 14.204 1.175 1.00 . A A . 1 SER N 1 1 6 2207 1 1 1 SER O O -13.391 13.812 -2.178 1.00 . A A . 1 SER O 1 1 6 2208 1 1 1 SER OG O -13.932 16.726 1.277 1.00 . A A . 1 SER OG 1 1 6 2209 1 1 2 GLN C C -10.193 12.574 -2.469 1.00 . A A . 2 GLN C 1 1 6 2210 1 1 2 GLN CA C -10.585 14.047 -2.608 1.00 . A A . 2 GLN CA 1 1 6 2211 1 1 2 GLN CB C -9.391 14.994 -2.847 1.00 . A A . 2 GLN CB 1 1 6 2212 1 1 2 GLN CD C -9.084 16.273 -0.649 1.00 . A A . 2 GLN CD 1 1 6 2213 1 1 2 GLN CG C -8.478 15.283 -1.641 1.00 . A A . 2 GLN CG 1 1 6 2214 1 1 2 GLN H H -10.839 14.817 -0.649 1.00 . A A . 2 GLN H 1 1 6 2215 1 1 2 GLN HA H -11.214 14.133 -3.496 1.00 . A A . 2 GLN HA 1 1 6 2216 1 1 2 GLN HB2 H -8.779 14.559 -3.639 1.00 . A A . 2 GLN HB2 1 1 6 2217 1 1 2 GLN HB3 H -9.776 15.945 -3.218 1.00 . A A . 2 GLN HB3 1 1 6 2218 1 1 2 GLN HE21 H -8.692 17.849 -1.879 1.00 . A A . 2 GLN HE21 1 1 6 2219 1 1 2 GLN HE22 H -9.474 18.247 -0.364 1.00 . A A . 2 GLN HE22 1 1 6 2220 1 1 2 GLN HG2 H -8.232 14.362 -1.119 1.00 . A A . 2 GLN HG2 1 1 6 2221 1 1 2 GLN HG3 H -7.548 15.716 -2.014 1.00 . A A . 2 GLN HG3 1 1 6 2222 1 1 2 GLN N N -11.351 14.448 -1.437 1.00 . A A . 2 GLN N 1 1 6 2223 1 1 2 GLN NE2 N -9.083 17.562 -0.994 1.00 . A A . 2 GLN NE2 1 1 6 2224 1 1 2 GLN O O -9.055 12.250 -2.131 1.00 . A A . 2 GLN O 1 1 6 2225 1 1 2 GLN OE1 O -9.553 15.877 0.416 1.00 . A A . 2 GLN OE1 1 1 6 2226 1 1 3 GLY C C -10.140 9.534 -3.598 1.00 . A A . 3 GLY C 1 1 6 2227 1 1 3 GLY CA C -11.023 10.236 -2.559 1.00 . A A . 3 GLY CA 1 1 6 2228 1 1 3 GLY H H -12.060 12.028 -3.017 1.00 . A A . 3 GLY H 1 1 6 2229 1 1 3 GLY HA2 H -10.606 10.051 -1.570 1.00 . A A . 3 GLY HA2 1 1 6 2230 1 1 3 GLY HA3 H -12.021 9.797 -2.594 1.00 . A A . 3 GLY HA3 1 1 6 2231 1 1 3 GLY N N -11.155 11.679 -2.737 1.00 . A A . 3 GLY N 1 1 6 2232 1 1 3 GLY O O -10.367 8.366 -3.906 1.00 . A A . 3 GLY O 1 1 6 2233 1 1 4 THR C C -6.726 10.378 -4.565 1.00 . A A . 4 THR C 1 1 6 2234 1 1 4 THR CA C -8.057 9.712 -4.954 1.00 . A A . 4 THR CA 1 1 6 2235 1 1 4 THR CB C -8.435 9.929 -6.430 1.00 . A A . 4 THR CB 1 1 6 2236 1 1 4 THR CG2 C -8.567 11.412 -6.798 1.00 . A A . 4 THR CG2 1 1 6 2237 1 1 4 THR H H -9.010 11.189 -3.808 1.00 . A A . 4 THR H 1 1 6 2238 1 1 4 THR HA H -7.947 8.640 -4.783 1.00 . A A . 4 THR HA 1 1 6 2239 1 1 4 THR HB H -9.394 9.443 -6.618 1.00 . A A . 4 THR HB 1 1 6 2240 1 1 4 THR HG1 H -6.609 9.658 -7.034 1.00 . A A . 4 THR HG1 1 1 6 2241 1 1 4 THR HG21 H -8.858 11.496 -7.845 1.00 . A A . 4 THR HG21 1 1 6 2242 1 1 4 THR HG22 H -9.332 11.889 -6.185 1.00 . A A . 4 THR HG22 1 1 6 2243 1 1 4 THR HG23 H -7.619 11.931 -6.656 1.00 . A A . 4 THR HG23 1 1 6 2244 1 1 4 THR N N -9.113 10.228 -4.096 1.00 . A A . 4 THR N 1 1 6 2245 1 1 4 THR O O -5.770 10.351 -5.339 1.00 . A A . 4 THR O 1 1 6 2246 1 1 4 THR OG1 O -7.477 9.319 -7.270 1.00 . A A . 4 THR OG1 1 1 6 2247 1 1 5 THR C C -5.493 11.475 -1.312 1.00 . A A . 5 THR C 1 1 6 2248 1 1 5 THR CA C -5.503 11.662 -2.829 1.00 . A A . 5 THR CA 1 1 6 2249 1 1 5 THR CB C -5.524 13.144 -3.238 1.00 . A A . 5 THR CB 1 1 6 2250 1 1 5 THR CG2 C -4.240 13.856 -2.802 1.00 . A A . 5 THR CG2 1 1 6 2251 1 1 5 THR H H -7.487 10.974 -2.774 1.00 . A A . 5 THR H 1 1 6 2252 1 1 5 THR HA H -4.599 11.203 -3.230 1.00 . A A . 5 THR HA 1 1 6 2253 1 1 5 THR HB H -6.378 13.643 -2.781 1.00 . A A . 5 THR HB 1 1 6 2254 1 1 5 THR HG1 H -5.050 12.641 -5.058 1.00 . A A . 5 THR HG1 1 1 6 2255 1 1 5 THR HG21 H -4.270 14.894 -3.136 1.00 . A A . 5 THR HG21 1 1 6 2256 1 1 5 THR HG22 H -4.148 13.841 -1.716 1.00 . A A . 5 THR HG22 1 1 6 2257 1 1 5 THR HG23 H -3.372 13.366 -3.243 1.00 . A A . 5 THR HG23 1 1 6 2258 1 1 5 THR N N -6.667 10.977 -3.365 1.00 . A A . 5 THR N 1 1 6 2259 1 1 5 THR O O -4.561 10.880 -0.775 1.00 . A A . 5 THR O 1 1 6 2260 1 1 5 THR OG1 O -5.656 13.259 -4.640 1.00 . A A . 5 THR OG1 1 1 6 2261 1 1 6 SER C C -6.836 10.332 1.169 1.00 . A A . 6 SER C 1 1 6 2262 1 1 6 SER CA C -6.641 11.808 0.825 1.00 . A A . 6 SER CA 1 1 6 2263 1 1 6 SER CB C -7.762 12.694 1.381 1.00 . A A . 6 SER CB 1 1 6 2264 1 1 6 SER H H -7.299 12.404 -1.105 1.00 . A A . 6 SER H 1 1 6 2265 1 1 6 SER HA H -5.709 12.144 1.283 1.00 . A A . 6 SER HA 1 1 6 2266 1 1 6 SER HB2 H -7.849 12.532 2.457 1.00 . A A . 6 SER HB2 1 1 6 2267 1 1 6 SER HB3 H -7.504 13.739 1.207 1.00 . A A . 6 SER HB3 1 1 6 2268 1 1 6 SER HG H -9.335 11.582 1.084 1.00 . A A . 6 SER HG 1 1 6 2269 1 1 6 SER N N -6.530 11.963 -0.618 1.00 . A A . 6 SER N 1 1 6 2270 1 1 6 SER O O -6.071 9.778 1.955 1.00 . A A . 6 SER O 1 1 6 2271 1 1 6 SER OG O -9.006 12.426 0.766 1.00 . A A . 6 SER OG 1 1 6 2272 1 1 7 GLU C C -7.337 7.522 -0.370 1.00 . A A . 7 GLU C 1 1 6 2273 1 1 7 GLU CA C -8.112 8.276 0.713 1.00 . A A . 7 GLU CA 1 1 6 2274 1 1 7 GLU CB C -9.629 8.029 0.653 1.00 . A A . 7 GLU CB 1 1 6 2275 1 1 7 GLU CD C -9.644 6.262 2.490 1.00 . A A . 7 GLU CD 1 1 6 2276 1 1 7 GLU CG C -10.031 6.600 1.052 1.00 . A A . 7 GLU CG 1 1 6 2277 1 1 7 GLU H H -8.404 10.214 -0.106 1.00 . A A . 7 GLU H 1 1 6 2278 1 1 7 GLU HA H -7.760 7.956 1.692 1.00 . A A . 7 GLU HA 1 1 6 2279 1 1 7 GLU HB2 H -10.128 8.726 1.328 1.00 . A A . 7 GLU HB2 1 1 6 2280 1 1 7 GLU HB3 H -9.989 8.218 -0.358 1.00 . A A . 7 GLU HB3 1 1 6 2281 1 1 7 GLU HG2 H -11.113 6.510 0.955 1.00 . A A . 7 GLU HG2 1 1 6 2282 1 1 7 GLU HG3 H -9.576 5.876 0.375 1.00 . A A . 7 GLU HG3 1 1 6 2283 1 1 7 GLU N N -7.845 9.697 0.558 1.00 . A A . 7 GLU N 1 1 6 2284 1 1 7 GLU O O -7.928 6.850 -1.213 1.00 . A A . 7 GLU O 1 1 6 2285 1 1 7 GLU OE1 O -10.109 6.991 3.394 1.00 . A A . 7 GLU OE1 1 1 6 2286 1 1 7 GLU OE2 O -8.890 5.280 2.663 1.00 . A A . 7 GLU OE2 1 1 6 2287 1 1 8 TYR C C -3.689 7.073 -0.951 1.00 . A A . 8 TYR C 1 1 6 2288 1 1 8 TYR CA C -5.153 7.094 -1.393 1.00 . A A . 8 TYR CA 1 1 6 2289 1 1 8 TYR CB C -5.340 7.921 -2.671 1.00 . A A . 8 TYR CB 1 1 6 2290 1 1 8 TYR CD1 C -5.225 6.198 -4.501 1.00 . A A . 8 TYR CD1 1 1 6 2291 1 1 8 TYR CD2 C -3.668 8.069 -4.559 1.00 . A A . 8 TYR CD2 1 1 6 2292 1 1 8 TYR CE1 C -4.741 5.754 -5.741 1.00 . A A . 8 TYR CE1 1 1 6 2293 1 1 8 TYR CE2 C -3.203 7.641 -5.812 1.00 . A A . 8 TYR CE2 1 1 6 2294 1 1 8 TYR CG C -4.687 7.352 -3.906 1.00 . A A . 8 TYR CG 1 1 6 2295 1 1 8 TYR CZ C -3.735 6.480 -6.403 1.00 . A A . 8 TYR CZ 1 1 6 2296 1 1 8 TYR H H -5.572 8.230 0.349 1.00 . A A . 8 TYR H 1 1 6 2297 1 1 8 TYR HA H -5.467 6.068 -1.584 1.00 . A A . 8 TYR HA 1 1 6 2298 1 1 8 TYR HB2 H -6.402 8.007 -2.896 1.00 . A A . 8 TYR HB2 1 1 6 2299 1 1 8 TYR HB3 H -4.962 8.925 -2.498 1.00 . A A . 8 TYR HB3 1 1 6 2300 1 1 8 TYR HD1 H -6.026 5.660 -4.015 1.00 . A A . 8 TYR HD1 1 1 6 2301 1 1 8 TYR HD2 H -3.255 8.962 -4.113 1.00 . A A . 8 TYR HD2 1 1 6 2302 1 1 8 TYR HE1 H -5.159 4.862 -6.181 1.00 . A A . 8 TYR HE1 1 1 6 2303 1 1 8 TYR HE2 H -2.434 8.211 -6.309 1.00 . A A . 8 TYR HE2 1 1 6 2304 1 1 8 TYR HH H -2.589 6.619 -7.978 1.00 . A A . 8 TYR HH 1 1 6 2305 1 1 8 TYR N N -6.004 7.656 -0.360 1.00 . A A . 8 TYR N 1 1 6 2306 1 1 8 TYR O O -3.077 6.008 -0.907 1.00 . A A . 8 TYR O 1 1 6 2307 1 1 8 TYR OH O -3.273 6.054 -7.614 1.00 . A A . 8 TYR OH 1 1 6 2308 1 1 9 SER C C -1.134 7.592 0.729 1.00 . A A . 9 SER C 1 1 6 2309 1 1 9 SER CA C -1.716 8.485 -0.368 1.00 . A A . 9 SER CA 1 1 6 2310 1 1 9 SER CB C -1.485 9.960 -0.022 1.00 . A A . 9 SER CB 1 1 6 2311 1 1 9 SER H H -3.724 9.074 -0.673 1.00 . A A . 9 SER H 1 1 6 2312 1 1 9 SER HA H -1.156 8.294 -1.281 1.00 . A A . 9 SER HA 1 1 6 2313 1 1 9 SER HB2 H -2.099 10.248 0.833 1.00 . A A . 9 SER HB2 1 1 6 2314 1 1 9 SER HB3 H -0.434 10.110 0.230 1.00 . A A . 9 SER HB3 1 1 6 2315 1 1 9 SER HG H -2.739 10.743 -1.286 1.00 . A A . 9 SER HG 1 1 6 2316 1 1 9 SER N N -3.130 8.257 -0.658 1.00 . A A . 9 SER N 1 1 6 2317 1 1 9 SER O O 0.073 7.362 0.739 1.00 . A A . 9 SER O 1 1 6 2318 1 1 9 SER OG O -1.791 10.779 -1.130 1.00 . A A . 9 SER OG 1 1 6 2319 1 1 10 LYS C C -0.689 5.139 2.433 1.00 . A A . 10 LYS C 1 1 6 2320 1 1 10 LYS CA C -1.527 6.350 2.816 1.00 . A A . 10 LYS CA 1 1 6 2321 1 1 10 LYS CB C -2.709 5.853 3.653 1.00 . A A . 10 LYS CB 1 1 6 2322 1 1 10 LYS CD C -4.906 7.165 3.037 1.00 . A A . 10 LYS CD 1 1 6 2323 1 1 10 LYS CE C -5.472 5.898 2.388 1.00 . A A . 10 LYS CE 1 1 6 2324 1 1 10 LYS CG C -3.757 6.906 4.028 1.00 . A A . 10 LYS CG 1 1 6 2325 1 1 10 LYS H H -2.950 7.294 1.561 1.00 . A A . 10 LYS H 1 1 6 2326 1 1 10 LYS HA H -0.905 7.023 3.397 1.00 . A A . 10 LYS HA 1 1 6 2327 1 1 10 LYS HB2 H -3.177 5.001 3.168 1.00 . A A . 10 LYS HB2 1 1 6 2328 1 1 10 LYS HB3 H -2.281 5.488 4.587 1.00 . A A . 10 LYS HB3 1 1 6 2329 1 1 10 LYS HD2 H -5.711 7.659 3.584 1.00 . A A . 10 LYS HD2 1 1 6 2330 1 1 10 LYS HD3 H -4.584 7.852 2.258 1.00 . A A . 10 LYS HD3 1 1 6 2331 1 1 10 LYS HE2 H -6.352 6.151 1.805 1.00 . A A . 10 LYS HE2 1 1 6 2332 1 1 10 LYS HE3 H -4.732 5.483 1.706 1.00 . A A . 10 LYS HE3 1 1 6 2333 1 1 10 LYS HG2 H -4.214 6.540 4.945 1.00 . A A . 10 LYS HG2 1 1 6 2334 1 1 10 LYS HG3 H -3.240 7.840 4.235 1.00 . A A . 10 LYS HG3 1 1 6 2335 1 1 10 LYS HZ1 H -6.601 5.285 3.977 1.00 . A A . 10 LYS HZ1 1 1 6 2336 1 1 10 LYS HZ2 H -6.250 4.082 2.907 1.00 . A A . 10 LYS HZ2 1 1 6 2337 1 1 10 LYS HZ3 H -5.091 4.623 3.946 1.00 . A A . 10 LYS HZ3 1 1 6 2338 1 1 10 LYS N N -1.969 7.103 1.654 1.00 . A A . 10 LYS N 1 1 6 2339 1 1 10 LYS NZ N -5.883 4.894 3.383 1.00 . A A . 10 LYS NZ 1 1 6 2340 1 1 10 LYS O O 0.355 4.890 3.025 1.00 . A A . 10 LYS O 1 1 6 2341 1 1 11 TYR C C 0.008 3.577 -0.547 1.00 . A A . 11 TYR C 1 1 6 2342 1 1 11 TYR CA C -0.530 3.241 0.843 1.00 . A A . 11 TYR CA 1 1 6 2343 1 1 11 TYR CB C -1.543 2.090 0.792 1.00 . A A . 11 TYR CB 1 1 6 2344 1 1 11 TYR CD1 C -2.890 2.200 -1.370 1.00 . A A . 11 TYR CD1 1 1 6 2345 1 1 11 TYR CD2 C -3.929 2.947 0.697 1.00 . A A . 11 TYR CD2 1 1 6 2346 1 1 11 TYR CE1 C -4.036 2.585 -2.087 1.00 . A A . 11 TYR CE1 1 1 6 2347 1 1 11 TYR CE2 C -5.090 3.297 -0.014 1.00 . A A . 11 TYR CE2 1 1 6 2348 1 1 11 TYR CG C -2.821 2.401 0.023 1.00 . A A . 11 TYR CG 1 1 6 2349 1 1 11 TYR CZ C -5.137 3.133 -1.408 1.00 . A A . 11 TYR CZ 1 1 6 2350 1 1 11 TYR H H -2.095 4.679 1.104 1.00 . A A . 11 TYR H 1 1 6 2351 1 1 11 TYR HA H 0.328 2.919 1.432 1.00 . A A . 11 TYR HA 1 1 6 2352 1 1 11 TYR HB2 H -1.059 1.215 0.360 1.00 . A A . 11 TYR HB2 1 1 6 2353 1 1 11 TYR HB3 H -1.804 1.845 1.823 1.00 . A A . 11 TYR HB3 1 1 6 2354 1 1 11 TYR HD1 H -2.064 1.754 -1.903 1.00 . A A . 11 TYR HD1 1 1 6 2355 1 1 11 TYR HD2 H -3.881 3.112 1.764 1.00 . A A . 11 TYR HD2 1 1 6 2356 1 1 11 TYR HE1 H -4.067 2.453 -3.158 1.00 . A A . 11 TYR HE1 1 1 6 2357 1 1 11 TYR HE2 H -5.947 3.697 0.507 1.00 . A A . 11 TYR HE2 1 1 6 2358 1 1 11 TYR HH H -6.184 3.349 -3.044 1.00 . A A . 11 TYR HH 1 1 6 2359 1 1 11 TYR N N -1.185 4.397 1.445 1.00 . A A . 11 TYR N 1 1 6 2360 1 1 11 TYR O O 0.141 2.685 -1.382 1.00 . A A . 11 TYR O 1 1 6 2361 1 1 11 TYR OH O -6.254 3.502 -2.099 1.00 . A A . 11 TYR OH 1 1 6 2362 1 1 12 LEU C C 1.509 6.543 -2.070 1.00 . A A . 12 LEU C 1 1 6 2363 1 1 12 LEU CA C 0.607 5.312 -2.161 1.00 . A A . 12 LEU CA 1 1 6 2364 1 1 12 LEU CB C -0.727 5.556 -2.888 1.00 . A A . 12 LEU CB 1 1 6 2365 1 1 12 LEU CD1 C 0.165 6.444 -5.117 1.00 . A A . 12 LEU CD1 1 1 6 2366 1 1 12 LEU CD2 C -0.339 3.989 -4.869 1.00 . A A . 12 LEU CD2 1 1 6 2367 1 1 12 LEU CG C -0.715 5.405 -4.417 1.00 . A A . 12 LEU CG 1 1 6 2368 1 1 12 LEU H H 0.178 5.562 -0.100 1.00 . A A . 12 LEU H 1 1 6 2369 1 1 12 LEU HA H 1.166 4.538 -2.681 1.00 . A A . 12 LEU HA 1 1 6 2370 1 1 12 LEU HB2 H -1.448 4.825 -2.518 1.00 . A A . 12 LEU HB2 1 1 6 2371 1 1 12 LEU HB3 H -1.119 6.534 -2.615 1.00 . A A . 12 LEU HB3 1 1 6 2372 1 1 12 LEU HD11 H 0.043 6.354 -6.197 1.00 . A A . 12 LEU HD11 1 1 6 2373 1 1 12 LEU HD12 H -0.134 7.447 -4.813 1.00 . A A . 12 LEU HD12 1 1 6 2374 1 1 12 LEU HD13 H 1.214 6.285 -4.867 1.00 . A A . 12 LEU HD13 1 1 6 2375 1 1 12 LEU HD21 H -0.553 3.883 -5.933 1.00 . A A . 12 LEU HD21 1 1 6 2376 1 1 12 LEU HD22 H 0.721 3.793 -4.710 1.00 . A A . 12 LEU HD22 1 1 6 2377 1 1 12 LEU HD23 H -0.929 3.254 -4.319 1.00 . A A . 12 LEU HD23 1 1 6 2378 1 1 12 LEU HG H -1.744 5.569 -4.731 1.00 . A A . 12 LEU HG 1 1 6 2379 1 1 12 LEU N N 0.273 4.860 -0.822 1.00 . A A . 12 LEU N 1 1 6 2380 1 1 12 LEU O O 1.112 7.648 -2.435 1.00 . A A . 12 LEU O 1 1 6 2381 1 1 13 ASP C C 5.103 6.861 -1.771 1.00 . A A . 13 ASP C 1 1 6 2382 1 1 13 ASP CA C 3.714 7.398 -1.386 1.00 . A A . 13 ASP CA 1 1 6 2383 1 1 13 ASP CB C 3.561 7.912 0.050 1.00 . A A . 13 ASP CB 1 1 6 2384 1 1 13 ASP CG C 4.423 9.131 0.372 1.00 . A A . 13 ASP CG 1 1 6 2385 1 1 13 ASP H H 2.993 5.423 -1.239 1.00 . A A . 13 ASP H 1 1 6 2386 1 1 13 ASP HA H 3.502 8.225 -2.066 1.00 . A A . 13 ASP HA 1 1 6 2387 1 1 13 ASP HB2 H 2.518 8.192 0.210 1.00 . A A . 13 ASP HB2 1 1 6 2388 1 1 13 ASP HB3 H 3.787 7.088 0.716 1.00 . A A . 13 ASP HB3 1 1 6 2389 1 1 13 ASP N N 2.734 6.342 -1.570 1.00 . A A . 13 ASP N 1 1 6 2390 1 1 13 ASP O O 5.243 6.318 -2.866 1.00 . A A . 13 ASP O 1 1 6 2391 1 1 13 ASP OD1 O 4.135 10.204 -0.201 1.00 . A A . 13 ASP OD1 1 1 6 2392 1 1 13 ASP OD2 O 5.358 8.962 1.187 1.00 . A A . 13 ASP OD2 1 1 6 2393 1 1 14 SER C C 7.991 5.434 -0.584 1.00 . A A . 14 SER C 1 1 6 2394 1 1 14 SER CA C 7.519 6.734 -1.236 1.00 . A A . 14 SER CA 1 1 6 2395 1 1 14 SER CB C 8.396 7.910 -0.791 1.00 . A A . 14 SER CB 1 1 6 2396 1 1 14 SER H H 5.953 7.476 -0.032 1.00 . A A . 14 SER H 1 1 6 2397 1 1 14 SER HA H 7.645 6.636 -2.316 1.00 . A A . 14 SER HA 1 1 6 2398 1 1 14 SER HB2 H 8.346 8.032 0.292 1.00 . A A . 14 SER HB2 1 1 6 2399 1 1 14 SER HB3 H 9.431 7.722 -1.079 1.00 . A A . 14 SER HB3 1 1 6 2400 1 1 14 SER HG H 7.973 8.990 -2.354 1.00 . A A . 14 SER HG 1 1 6 2401 1 1 14 SER N N 6.127 7.038 -0.924 1.00 . A A . 14 SER N 1 1 6 2402 1 1 14 SER O O 8.504 4.555 -1.274 1.00 . A A . 14 SER O 1 1 6 2403 1 1 14 SER OG O 7.954 9.105 -1.400 1.00 . A A . 14 SER OG 1 1 6 2404 1 1 15 ARG C C 7.277 3.080 1.527 1.00 . A A . 15 ARG C 1 1 6 2405 1 1 15 ARG CA C 8.343 4.174 1.494 1.00 . A A . 15 ARG CA 1 1 6 2406 1 1 15 ARG CB C 8.768 4.645 2.897 1.00 . A A . 15 ARG CB 1 1 6 2407 1 1 15 ARG CD C 8.591 2.515 4.336 1.00 . A A . 15 ARG CD 1 1 6 2408 1 1 15 ARG CG C 9.508 3.592 3.738 1.00 . A A . 15 ARG CG 1 1 6 2409 1 1 15 ARG CZ C 10.180 0.766 5.159 1.00 . A A . 15 ARG CZ 1 1 6 2410 1 1 15 ARG H H 7.406 6.067 1.253 1.00 . A A . 15 ARG H 1 1 6 2411 1 1 15 ARG HA H 9.234 3.777 1.006 1.00 . A A . 15 ARG HA 1 1 6 2412 1 1 15 ARG HB2 H 9.459 5.478 2.760 1.00 . A A . 15 ARG HB2 1 1 6 2413 1 1 15 ARG HB3 H 7.910 5.016 3.456 1.00 . A A . 15 ARG HB3 1 1 6 2414 1 1 15 ARG HD2 H 7.727 2.995 4.795 1.00 . A A . 15 ARG HD2 1 1 6 2415 1 1 15 ARG HD3 H 8.241 1.828 3.569 1.00 . A A . 15 ARG HD3 1 1 6 2416 1 1 15 ARG HE H 9.018 1.940 6.333 1.00 . A A . 15 ARG HE 1 1 6 2417 1 1 15 ARG HG2 H 10.293 3.131 3.138 1.00 . A A . 15 ARG HG2 1 1 6 2418 1 1 15 ARG HG3 H 9.981 4.119 4.569 1.00 . A A . 15 ARG HG3 1 1 6 2419 1 1 15 ARG HH11 H 10.199 0.940 3.121 1.00 . A A . 15 ARG HH11 1 1 6 2420 1 1 15 ARG HH12 H 11.258 -0.284 3.779 1.00 . A A . 15 ARG HH12 1 1 6 2421 1 1 15 ARG HH21 H 10.406 0.331 7.142 1.00 . A A . 15 ARG HH21 1 1 6 2422 1 1 15 ARG HH22 H 11.378 -0.627 6.050 1.00 . A A . 15 ARG HH22 1 1 6 2423 1 1 15 ARG N N 7.845 5.317 0.740 1.00 . A A . 15 ARG N 1 1 6 2424 1 1 15 ARG NE N 9.273 1.735 5.377 1.00 . A A . 15 ARG NE 1 1 6 2425 1 1 15 ARG NH1 N 10.579 0.450 3.918 1.00 . A A . 15 ARG NH1 1 1 6 2426 1 1 15 ARG NH2 N 10.697 0.103 6.203 1.00 . A A . 15 ARG NH2 1 1 6 2427 1 1 15 ARG O O 7.482 1.996 0.985 1.00 . A A . 15 ARG O 1 1 6 2428 1 1 16 ARG C C 4.613 1.577 1.348 1.00 . A A . 16 ARG C 1 1 6 2429 1 1 16 ARG CA C 5.090 2.437 2.520 1.00 . A A . 16 ARG CA 1 1 6 2430 1 1 16 ARG CB C 3.934 3.199 3.174 1.00 . A A . 16 ARG CB 1 1 6 2431 1 1 16 ARG CD C 3.215 5.608 3.025 1.00 . A A . 16 ARG CD 1 1 6 2432 1 1 16 ARG CG C 3.329 4.284 2.271 1.00 . A A . 16 ARG CG 1 1 6 2433 1 1 16 ARG CZ C 5.266 6.551 4.158 1.00 . A A . 16 ARG CZ 1 1 6 2434 1 1 16 ARG H H 6.081 4.295 2.599 1.00 . A A . 16 ARG H 1 1 6 2435 1 1 16 ARG HA H 5.470 1.762 3.286 1.00 . A A . 16 ARG HA 1 1 6 2436 1 1 16 ARG HB2 H 3.148 2.495 3.450 1.00 . A A . 16 ARG HB2 1 1 6 2437 1 1 16 ARG HB3 H 4.312 3.647 4.093 1.00 . A A . 16 ARG HB3 1 1 6 2438 1 1 16 ARG HD2 H 2.532 6.255 2.473 1.00 . A A . 16 ARG HD2 1 1 6 2439 1 1 16 ARG HD3 H 2.784 5.439 4.011 1.00 . A A . 16 ARG HD3 1 1 6 2440 1 1 16 ARG HE H 4.889 6.560 2.174 1.00 . A A . 16 ARG HE 1 1 6 2441 1 1 16 ARG HG2 H 3.934 4.471 1.386 1.00 . A A . 16 ARG HG2 1 1 6 2442 1 1 16 ARG HG3 H 2.351 3.946 1.934 1.00 . A A . 16 ARG HG3 1 1 6 2443 1 1 16 ARG HH11 H 4.026 5.670 5.532 1.00 . A A . 16 ARG HH11 1 1 6 2444 1 1 16 ARG HH12 H 5.470 6.403 6.183 1.00 . A A . 16 ARG HH12 1 1 6 2445 1 1 16 ARG HH21 H 6.714 7.509 3.081 1.00 . A A . 16 ARG HH21 1 1 6 2446 1 1 16 ARG HH22 H 6.993 7.428 4.806 1.00 . A A . 16 ARG HH22 1 1 6 2447 1 1 16 ARG N N 6.164 3.369 2.207 1.00 . A A . 16 ARG N 1 1 6 2448 1 1 16 ARG NE N 4.523 6.278 3.072 1.00 . A A . 16 ARG NE 1 1 6 2449 1 1 16 ARG NH1 N 4.887 6.178 5.390 1.00 . A A . 16 ARG NH1 1 1 6 2450 1 1 16 ARG NH2 N 6.419 7.216 4.002 1.00 . A A . 16 ARG NH2 1 1 6 2451 1 1 16 ARG O O 4.494 0.367 1.498 1.00 . A A . 16 ARG O 1 1 6 2452 1 1 17 ALA C C 4.663 0.504 -1.542 1.00 . A A . 17 ALA C 1 1 6 2453 1 1 17 ALA CA C 3.690 1.501 -0.924 1.00 . A A . 17 ALA CA 1 1 6 2454 1 1 17 ALA CB C 3.235 2.551 -1.935 1.00 . A A . 17 ALA CB 1 1 6 2455 1 1 17 ALA H H 4.526 3.157 0.077 1.00 . A A . 17 ALA H 1 1 6 2456 1 1 17 ALA HA H 2.806 0.968 -0.571 1.00 . A A . 17 ALA HA 1 1 6 2457 1 1 17 ALA HB1 H 2.632 2.082 -2.713 1.00 . A A . 17 ALA HB1 1 1 6 2458 1 1 17 ALA HB2 H 2.638 3.294 -1.412 1.00 . A A . 17 ALA HB2 1 1 6 2459 1 1 17 ALA HB3 H 4.092 3.051 -2.383 1.00 . A A . 17 ALA HB3 1 1 6 2460 1 1 17 ALA N N 4.304 2.184 0.200 1.00 . A A . 17 ALA N 1 1 6 2461 1 1 17 ALA O O 4.317 -0.650 -1.772 1.00 . A A . 17 ALA O 1 1 6 2462 1 1 18 GLN C C 7.336 -0.980 -1.418 1.00 . A A . 18 GLN C 1 1 6 2463 1 1 18 GLN CA C 6.963 0.164 -2.359 1.00 . A A . 18 GLN CA 1 1 6 2464 1 1 18 GLN CB C 8.162 1.080 -2.626 1.00 . A A . 18 GLN CB 1 1 6 2465 1 1 18 GLN CD C 6.703 2.708 -3.999 1.00 . A A . 18 GLN CD 1 1 6 2466 1 1 18 GLN CG C 7.991 1.888 -3.918 1.00 . A A . 18 GLN CG 1 1 6 2467 1 1 18 GLN H H 6.099 1.922 -1.557 1.00 . A A . 18 GLN H 1 1 6 2468 1 1 18 GLN HA H 6.625 -0.275 -3.300 1.00 . A A . 18 GLN HA 1 1 6 2469 1 1 18 GLN HB2 H 8.315 1.752 -1.781 1.00 . A A . 18 GLN HB2 1 1 6 2470 1 1 18 GLN HB3 H 9.057 0.467 -2.741 1.00 . A A . 18 GLN HB3 1 1 6 2471 1 1 18 GLN HE21 H 7.489 4.146 -2.802 1.00 . A A . 18 GLN HE21 1 1 6 2472 1 1 18 GLN HE22 H 5.865 4.463 -3.373 1.00 . A A . 18 GLN HE22 1 1 6 2473 1 1 18 GLN HG2 H 8.842 2.562 -4.004 1.00 . A A . 18 GLN HG2 1 1 6 2474 1 1 18 GLN HG3 H 8.001 1.187 -4.750 1.00 . A A . 18 GLN HG3 1 1 6 2475 1 1 18 GLN N N 5.890 0.962 -1.791 1.00 . A A . 18 GLN N 1 1 6 2476 1 1 18 GLN NE2 N 6.678 3.862 -3.334 1.00 . A A . 18 GLN NE2 1 1 6 2477 1 1 18 GLN O O 7.591 -2.093 -1.869 1.00 . A A . 18 GLN O 1 1 6 2478 1 1 18 GLN OE1 O 5.747 2.308 -4.658 1.00 . A A . 18 GLN OE1 1 1 6 2479 1 1 19 ASP C C 6.492 -2.763 0.901 1.00 . A A . 19 ASP C 1 1 6 2480 1 1 19 ASP CA C 7.581 -1.687 0.933 1.00 . A A . 19 ASP CA 1 1 6 2481 1 1 19 ASP CB C 7.648 -0.984 2.293 1.00 . A A . 19 ASP CB 1 1 6 2482 1 1 19 ASP CG C 7.870 -1.971 3.435 1.00 . A A . 19 ASP CG 1 1 6 2483 1 1 19 ASP H H 7.146 0.250 0.161 1.00 . A A . 19 ASP H 1 1 6 2484 1 1 19 ASP HA H 8.547 -2.163 0.751 1.00 . A A . 19 ASP HA 1 1 6 2485 1 1 19 ASP HB2 H 8.472 -0.271 2.275 1.00 . A A . 19 ASP HB2 1 1 6 2486 1 1 19 ASP HB3 H 6.725 -0.436 2.476 1.00 . A A . 19 ASP HB3 1 1 6 2487 1 1 19 ASP N N 7.350 -0.701 -0.112 1.00 . A A . 19 ASP N 1 1 6 2488 1 1 19 ASP O O 6.803 -3.951 0.918 1.00 . A A . 19 ASP O 1 1 6 2489 1 1 19 ASP OD1 O 9.043 -2.353 3.639 1.00 . A A . 19 ASP OD1 1 1 6 2490 1 1 19 ASP OD2 O 6.862 -2.328 4.084 1.00 . A A . 19 ASP OD2 1 1 6 2491 1 1 20 PHE C C 4.184 -4.109 -0.523 1.00 . A A . 20 PHE C 1 1 6 2492 1 1 20 PHE CA C 4.084 -3.251 0.741 1.00 . A A . 20 PHE CA 1 1 6 2493 1 1 20 PHE CB C 2.764 -2.463 0.767 1.00 . A A . 20 PHE CB 1 1 6 2494 1 1 20 PHE CD1 C 3.125 -1.859 3.234 1.00 . A A . 20 PHE CD1 1 1 6 2495 1 1 20 PHE CD2 C 1.511 -0.601 1.917 1.00 . A A . 20 PHE CD2 1 1 6 2496 1 1 20 PHE CE1 C 2.869 -1.026 4.338 1.00 . A A . 20 PHE CE1 1 1 6 2497 1 1 20 PHE CE2 C 1.248 0.224 3.024 1.00 . A A . 20 PHE CE2 1 1 6 2498 1 1 20 PHE CG C 2.457 -1.641 2.011 1.00 . A A . 20 PHE CG 1 1 6 2499 1 1 20 PHE CZ C 1.932 0.015 4.233 1.00 . A A . 20 PHE CZ 1 1 6 2500 1 1 20 PHE H H 5.030 -1.354 0.858 1.00 . A A . 20 PHE H 1 1 6 2501 1 1 20 PHE HA H 4.097 -3.937 1.588 1.00 . A A . 20 PHE HA 1 1 6 2502 1 1 20 PHE HB2 H 2.757 -1.787 -0.088 1.00 . A A . 20 PHE HB2 1 1 6 2503 1 1 20 PHE HB3 H 1.944 -3.169 0.637 1.00 . A A . 20 PHE HB3 1 1 6 2504 1 1 20 PHE HD1 H 3.850 -2.649 3.349 1.00 . A A . 20 PHE HD1 1 1 6 2505 1 1 20 PHE HD2 H 0.987 -0.428 0.988 1.00 . A A . 20 PHE HD2 1 1 6 2506 1 1 20 PHE HE1 H 3.394 -1.188 5.268 1.00 . A A . 20 PHE HE1 1 1 6 2507 1 1 20 PHE HE2 H 0.519 1.016 2.949 1.00 . A A . 20 PHE HE2 1 1 6 2508 1 1 20 PHE HZ H 1.735 0.652 5.083 1.00 . A A . 20 PHE HZ 1 1 6 2509 1 1 20 PHE N N 5.221 -2.347 0.844 1.00 . A A . 20 PHE N 1 1 6 2510 1 1 20 PHE O O 3.900 -5.302 -0.469 1.00 . A A . 20 PHE O 1 1 6 2511 1 1 21 VAL C C 5.857 -5.323 -2.740 1.00 . A A . 21 VAL C 1 1 6 2512 1 1 21 VAL CA C 4.749 -4.280 -2.894 1.00 . A A . 21 VAL CA 1 1 6 2513 1 1 21 VAL CB C 4.973 -3.322 -4.078 1.00 . A A . 21 VAL CB 1 1 6 2514 1 1 21 VAL CG1 C 5.444 -4.063 -5.336 1.00 . A A . 21 VAL CG1 1 1 6 2515 1 1 21 VAL CG2 C 3.666 -2.593 -4.417 1.00 . A A . 21 VAL CG2 1 1 6 2516 1 1 21 VAL H H 4.840 -2.540 -1.652 1.00 . A A . 21 VAL H 1 1 6 2517 1 1 21 VAL HA H 3.828 -4.835 -3.067 1.00 . A A . 21 VAL HA 1 1 6 2518 1 1 21 VAL HB H 5.732 -2.586 -3.812 1.00 . A A . 21 VAL HB 1 1 6 2519 1 1 21 VAL HG11 H 6.443 -4.471 -5.186 1.00 . A A . 21 VAL HG11 1 1 6 2520 1 1 21 VAL HG12 H 4.751 -4.873 -5.569 1.00 . A A . 21 VAL HG12 1 1 6 2521 1 1 21 VAL HG13 H 5.482 -3.373 -6.178 1.00 . A A . 21 VAL HG13 1 1 6 2522 1 1 21 VAL HG21 H 3.256 -2.102 -3.537 1.00 . A A . 21 VAL HG21 1 1 6 2523 1 1 21 VAL HG22 H 3.853 -1.840 -5.184 1.00 . A A . 21 VAL HG22 1 1 6 2524 1 1 21 VAL HG23 H 2.930 -3.305 -4.792 1.00 . A A . 21 VAL HG23 1 1 6 2525 1 1 21 VAL N N 4.597 -3.526 -1.654 1.00 . A A . 21 VAL N 1 1 6 2526 1 1 21 VAL O O 5.635 -6.498 -3.025 1.00 . A A . 21 VAL O 1 1 6 2527 1 1 22 GLN C C 7.800 -6.905 -1.050 1.00 . A A . 22 GLN C 1 1 6 2528 1 1 22 GLN CA C 8.171 -5.769 -2.006 1.00 . A A . 22 GLN CA 1 1 6 2529 1 1 22 GLN CB C 9.322 -4.924 -1.440 1.00 . A A . 22 GLN CB 1 1 6 2530 1 1 22 GLN CD C 11.103 -6.525 -2.321 1.00 . A A . 22 GLN CD 1 1 6 2531 1 1 22 GLN CG C 10.578 -5.744 -1.117 1.00 . A A . 22 GLN CG 1 1 6 2532 1 1 22 GLN H H 7.142 -3.916 -2.059 1.00 . A A . 22 GLN H 1 1 6 2533 1 1 22 GLN HA H 8.486 -6.200 -2.957 1.00 . A A . 22 GLN HA 1 1 6 2534 1 1 22 GLN HB2 H 9.578 -4.148 -2.162 1.00 . A A . 22 GLN HB2 1 1 6 2535 1 1 22 GLN HB3 H 8.991 -4.440 -0.521 1.00 . A A . 22 GLN HB3 1 1 6 2536 1 1 22 GLN HE21 H 11.433 -4.809 -3.369 1.00 . A A . 22 GLN HE21 1 1 6 2537 1 1 22 GLN HE22 H 11.842 -6.296 -4.199 1.00 . A A . 22 GLN HE22 1 1 6 2538 1 1 22 GLN HG2 H 11.356 -5.060 -0.775 1.00 . A A . 22 GLN HG2 1 1 6 2539 1 1 22 GLN HG3 H 10.362 -6.436 -0.302 1.00 . A A . 22 GLN HG3 1 1 6 2540 1 1 22 GLN N N 7.035 -4.898 -2.271 1.00 . A A . 22 GLN N 1 1 6 2541 1 1 22 GLN NE2 N 11.491 -5.817 -3.383 1.00 . A A . 22 GLN NE2 1 1 6 2542 1 1 22 GLN O O 8.323 -8.009 -1.179 1.00 . A A . 22 GLN O 1 1 6 2543 1 1 22 GLN OE1 O 11.157 -7.752 -2.294 1.00 . A A . 22 GLN OE1 1 1 6 2544 1 1 23 TRP C C 5.634 -8.681 0.231 1.00 . A A . 23 TRP C 1 1 6 2545 1 1 23 TRP CA C 6.501 -7.620 0.898 1.00 . A A . 23 TRP CA 1 1 6 2546 1 1 23 TRP CB C 5.733 -6.910 2.013 1.00 . A A . 23 TRP CB 1 1 6 2547 1 1 23 TRP CD1 C 5.360 -8.753 3.683 1.00 . A A . 23 TRP CD1 1 1 6 2548 1 1 23 TRP CD2 C 3.462 -8.066 2.729 1.00 . A A . 23 TRP CD2 1 1 6 2549 1 1 23 TRP CE2 C 3.117 -9.120 3.622 1.00 . A A . 23 TRP CE2 1 1 6 2550 1 1 23 TRP CE3 C 2.438 -7.536 1.922 1.00 . A A . 23 TRP CE3 1 1 6 2551 1 1 23 TRP CG C 4.890 -7.826 2.830 1.00 . A A . 23 TRP CG 1 1 6 2552 1 1 23 TRP CH2 C 0.799 -9.031 2.940 1.00 . A A . 23 TRP CH2 1 1 6 2553 1 1 23 TRP CZ2 C 1.804 -9.596 3.741 1.00 . A A . 23 TRP CZ2 1 1 6 2554 1 1 23 TRP CZ3 C 1.118 -8.012 2.024 1.00 . A A . 23 TRP CZ3 1 1 6 2555 1 1 23 TRP H H 6.415 -5.758 -0.083 1.00 . A A . 23 TRP H 1 1 6 2556 1 1 23 TRP HA H 7.382 -8.097 1.331 1.00 . A A . 23 TRP HA 1 1 6 2557 1 1 23 TRP HB2 H 6.434 -6.386 2.662 1.00 . A A . 23 TRP HB2 1 1 6 2558 1 1 23 TRP HB3 H 5.063 -6.170 1.582 1.00 . A A . 23 TRP HB3 1 1 6 2559 1 1 23 TRP HD1 H 6.411 -8.898 3.858 1.00 . A A . 23 TRP HD1 1 1 6 2560 1 1 23 TRP HE1 H 4.386 -10.232 4.880 1.00 . A A . 23 TRP HE1 1 1 6 2561 1 1 23 TRP HE3 H 2.705 -6.777 1.200 1.00 . A A . 23 TRP HE3 1 1 6 2562 1 1 23 TRP HH2 H -0.214 -9.393 3.024 1.00 . A A . 23 TRP HH2 1 1 6 2563 1 1 23 TRP HZ2 H 1.572 -10.395 4.429 1.00 . A A . 23 TRP HZ2 1 1 6 2564 1 1 23 TRP HZ3 H 0.349 -7.602 1.388 1.00 . A A . 23 TRP HZ3 1 1 6 2565 1 1 23 TRP N N 6.903 -6.645 -0.094 1.00 . A A . 23 TRP N 1 1 6 2566 1 1 23 TRP NE1 N 4.313 -9.485 4.205 1.00 . A A . 23 TRP NE1 1 1 6 2567 1 1 23 TRP O O 5.924 -9.871 0.317 1.00 . A A . 23 TRP O 1 1 6 2568 1 1 24 LEU C C 4.383 -9.970 -2.130 1.00 . A A . 24 LEU C 1 1 6 2569 1 1 24 LEU CA C 3.623 -9.061 -1.157 1.00 . A A . 24 LEU CA 1 1 6 2570 1 1 24 LEU CB C 2.631 -8.133 -1.873 1.00 . A A . 24 LEU CB 1 1 6 2571 1 1 24 LEU CD1 C 0.324 -7.668 -2.686 1.00 . A A . 24 LEU CD1 1 1 6 2572 1 1 24 LEU CD2 C 1.233 -9.989 -2.946 1.00 . A A . 24 LEU CD2 1 1 6 2573 1 1 24 LEU CG C 1.232 -8.736 -2.067 1.00 . A A . 24 LEU CG 1 1 6 2574 1 1 24 LEU H H 4.405 -7.229 -0.430 1.00 . A A . 24 LEU H 1 1 6 2575 1 1 24 LEU HA H 3.082 -9.667 -0.429 1.00 . A A . 24 LEU HA 1 1 6 2576 1 1 24 LEU HB2 H 2.489 -7.249 -1.252 1.00 . A A . 24 LEU HB2 1 1 6 2577 1 1 24 LEU HB3 H 3.052 -7.803 -2.824 1.00 . A A . 24 LEU HB3 1 1 6 2578 1 1 24 LEU HD11 H 0.702 -7.382 -3.667 1.00 . A A . 24 LEU HD11 1 1 6 2579 1 1 24 LEU HD12 H -0.689 -8.058 -2.787 1.00 . A A . 24 LEU HD12 1 1 6 2580 1 1 24 LEU HD13 H 0.297 -6.788 -2.042 1.00 . A A . 24 LEU HD13 1 1 6 2581 1 1 24 LEU HD21 H 0.211 -10.247 -3.222 1.00 . A A . 24 LEU HD21 1 1 6 2582 1 1 24 LEU HD22 H 1.817 -9.817 -3.851 1.00 . A A . 24 LEU HD22 1 1 6 2583 1 1 24 LEU HD23 H 1.649 -10.829 -2.392 1.00 . A A . 24 LEU HD23 1 1 6 2584 1 1 24 LEU HG H 0.825 -9.000 -1.090 1.00 . A A . 24 LEU HG 1 1 6 2585 1 1 24 LEU N N 4.567 -8.227 -0.430 1.00 . A A . 24 LEU N 1 1 6 2586 1 1 24 LEU O O 4.096 -11.159 -2.239 1.00 . A A . 24 LEU O 1 1 6 2587 1 1 25 MET C C 7.056 -11.196 -2.979 1.00 . A A . 25 MET C 1 1 6 2588 1 1 25 MET CA C 6.263 -10.120 -3.720 1.00 . A A . 25 MET CA 1 1 6 2589 1 1 25 MET CB C 7.228 -9.139 -4.392 1.00 . A A . 25 MET CB 1 1 6 2590 1 1 25 MET CE C 6.591 -6.644 -7.693 1.00 . A A . 25 MET CE 1 1 6 2591 1 1 25 MET CG C 6.563 -8.385 -5.545 1.00 . A A . 25 MET CG 1 1 6 2592 1 1 25 MET H H 5.561 -8.419 -2.626 1.00 . A A . 25 MET H 1 1 6 2593 1 1 25 MET HA H 5.663 -10.608 -4.490 1.00 . A A . 25 MET HA 1 1 6 2594 1 1 25 MET HB2 H 7.602 -8.436 -3.648 1.00 . A A . 25 MET HB2 1 1 6 2595 1 1 25 MET HB3 H 8.075 -9.699 -4.791 1.00 . A A . 25 MET HB3 1 1 6 2596 1 1 25 MET HE1 H 6.485 -7.499 -8.360 1.00 . A A . 25 MET HE1 1 1 6 2597 1 1 25 MET HE2 H 5.606 -6.329 -7.351 1.00 . A A . 25 MET HE2 1 1 6 2598 1 1 25 MET HE3 H 7.067 -5.823 -8.231 1.00 . A A . 25 MET HE3 1 1 6 2599 1 1 25 MET HG2 H 6.309 -9.104 -6.325 1.00 . A A . 25 MET HG2 1 1 6 2600 1 1 25 MET HG3 H 5.643 -7.916 -5.198 1.00 . A A . 25 MET HG3 1 1 6 2601 1 1 25 MET N N 5.381 -9.399 -2.811 1.00 . A A . 25 MET N 1 1 6 2602 1 1 25 MET O O 6.986 -12.369 -3.343 1.00 . A A . 25 MET O 1 1 6 2603 1 1 25 MET SD S 7.617 -7.105 -6.274 1.00 . A A . 25 MET SD 1 1 6 2604 1 1 26 ASN C C 7.927 -12.868 -0.623 1.00 . A A . 26 ASN C 1 1 6 2605 1 1 26 ASN CA C 8.688 -11.662 -1.179 1.00 . A A . 26 ASN CA 1 1 6 2606 1 1 26 ASN CB C 9.340 -10.852 -0.051 1.00 . A A . 26 ASN CB 1 1 6 2607 1 1 26 ASN CG C 10.235 -11.722 0.826 1.00 . A A . 26 ASN CG 1 1 6 2608 1 1 26 ASN H H 7.813 -9.807 -1.713 1.00 . A A . 26 ASN H 1 1 6 2609 1 1 26 ASN HA H 9.476 -12.025 -1.841 1.00 . A A . 26 ASN HA 1 1 6 2610 1 1 26 ASN HB2 H 9.941 -10.050 -0.482 1.00 . A A . 26 ASN HB2 1 1 6 2611 1 1 26 ASN HB3 H 8.565 -10.406 0.572 1.00 . A A . 26 ASN HB3 1 1 6 2612 1 1 26 ASN HD21 H 11.648 -11.846 -0.636 1.00 . A A . 26 ASN HD21 1 1 6 2613 1 1 26 ASN HD22 H 12.014 -12.702 0.847 1.00 . A A . 26 ASN HD22 1 1 6 2614 1 1 26 ASN N N 7.816 -10.789 -1.955 1.00 . A A . 26 ASN N 1 1 6 2615 1 1 26 ASN ND2 N 11.395 -12.121 0.302 1.00 . A A . 26 ASN ND2 1 1 6 2616 1 1 26 ASN O O 8.415 -13.994 -0.698 1.00 . A A . 26 ASN O 1 1 6 2617 1 1 26 ASN OD1 O 9.883 -12.031 1.962 1.00 . A A . 26 ASN OD1 1 1 6 2618 1 1 27 THR C C 5.317 -14.551 -0.634 1.00 . A A . 27 THR C 1 1 6 2619 1 1 27 THR CA C 5.875 -13.661 0.480 1.00 . A A . 27 THR CA 1 1 6 2620 1 1 27 THR CB C 4.762 -13.021 1.321 1.00 . A A . 27 THR CB 1 1 6 2621 1 1 27 THR CG2 C 5.346 -12.324 2.551 1.00 . A A . 27 THR CG2 1 1 6 2622 1 1 27 THR H H 6.396 -11.674 -0.047 1.00 . A A . 27 THR H 1 1 6 2623 1 1 27 THR HA H 6.471 -14.292 1.142 1.00 . A A . 27 THR HA 1 1 6 2624 1 1 27 THR HB H 4.081 -13.804 1.657 1.00 . A A . 27 THR HB 1 1 6 2625 1 1 27 THR HG1 H 4.601 -11.330 0.363 1.00 . A A . 27 THR HG1 1 1 6 2626 1 1 27 THR HG21 H 6.001 -11.503 2.260 1.00 . A A . 27 THR HG21 1 1 6 2627 1 1 27 THR HG22 H 4.527 -11.931 3.150 1.00 . A A . 27 THR HG22 1 1 6 2628 1 1 27 THR HG23 H 5.916 -13.037 3.144 1.00 . A A . 27 THR HG23 1 1 6 2629 1 1 27 THR N N 6.734 -12.626 -0.072 1.00 . A A . 27 THR N 1 1 6 2630 1 1 27 THR O O 5.441 -15.772 -0.572 1.00 . A A . 27 THR O 1 1 6 2631 1 1 27 THR OG1 O 4.028 -12.073 0.573 1.00 . A A . 27 THR OG1 1 1 6 2632 1 1 28 NH2 HN1 H 4.610 -12.944 -1.670 1.00 . A A . 28 NH2 HN1 1 1 6 2633 1 1 28 NH2 HN2 H 4.334 -14.506 -2.415 1.00 . A A . 28 NH2 HN2 1 1 6 2634 1 1 28 NH2 N N 4.704 -13.952 -1.657 1.00 . A A . 28 NH2 N 1 1 7 2635 1 1 1 SER C C -14.161 -0.794 2.141 1.00 . A A . 1 SER C 1 1 7 2636 1 1 1 SER CA C -15.044 0.412 1.817 1.00 . A A . 1 SER CA 1 1 7 2637 1 1 1 SER CB C -14.214 1.695 1.710 1.00 . A A . 1 SER CB 1 1 7 2638 1 1 1 SER H1 H -15.722 0.740 3.713 1.00 . A A . 1 SER H1 1 1 7 2639 1 1 1 SER H2 H -16.712 1.349 2.543 1.00 . A A . 1 SER H2 1 1 7 2640 1 1 1 SER H3 H -16.681 -0.275 2.834 1.00 . A A . 1 SER H3 1 1 7 2641 1 1 1 SER HA H -15.519 0.244 0.849 1.00 . A A . 1 SER HA 1 1 7 2642 1 1 1 SER HB2 H -13.408 1.559 0.987 1.00 . A A . 1 SER HB2 1 1 7 2643 1 1 1 SER HB3 H -14.856 2.509 1.372 1.00 . A A . 1 SER HB3 1 1 7 2644 1 1 1 SER HG H -12.925 1.460 3.151 1.00 . A A . 1 SER HG 1 1 7 2645 1 1 1 SER N N -16.127 0.569 2.803 1.00 . A A . 1 SER N 1 1 7 2646 1 1 1 SER O O -13.825 -1.024 3.302 1.00 . A A . 1 SER O 1 1 7 2647 1 1 1 SER OG O -13.671 2.040 2.966 1.00 . A A . 1 SER OG 1 1 7 2648 1 1 2 GLN C C -11.584 -2.512 1.701 1.00 . A A . 2 GLN C 1 1 7 2649 1 1 2 GLN CA C -13.016 -2.785 1.234 1.00 . A A . 2 GLN CA 1 1 7 2650 1 1 2 GLN CB C -13.031 -3.555 -0.095 1.00 . A A . 2 GLN CB 1 1 7 2651 1 1 2 GLN CD C -12.372 -3.549 -2.559 1.00 . A A . 2 GLN CD 1 1 7 2652 1 1 2 GLN CG C -12.365 -2.777 -1.241 1.00 . A A . 2 GLN CG 1 1 7 2653 1 1 2 GLN H H -14.107 -1.302 0.181 1.00 . A A . 2 GLN H 1 1 7 2654 1 1 2 GLN HA H -13.504 -3.414 1.981 1.00 . A A . 2 GLN HA 1 1 7 2655 1 1 2 GLN HB2 H -12.508 -4.503 0.043 1.00 . A A . 2 GLN HB2 1 1 7 2656 1 1 2 GLN HB3 H -14.066 -3.769 -0.365 1.00 . A A . 2 GLN HB3 1 1 7 2657 1 1 2 GLN HE21 H -11.580 -1.948 -3.529 1.00 . A A . 2 GLN HE21 1 1 7 2658 1 1 2 GLN HE22 H -11.891 -3.360 -4.527 1.00 . A A . 2 GLN HE22 1 1 7 2659 1 1 2 GLN HG2 H -12.892 -1.836 -1.398 1.00 . A A . 2 GLN HG2 1 1 7 2660 1 1 2 GLN HG3 H -11.328 -2.559 -0.987 1.00 . A A . 2 GLN HG3 1 1 7 2661 1 1 2 GLN N N -13.796 -1.561 1.106 1.00 . A A . 2 GLN N 1 1 7 2662 1 1 2 GLN NE2 N -11.911 -2.900 -3.629 1.00 . A A . 2 GLN NE2 1 1 7 2663 1 1 2 GLN O O -11.075 -1.399 1.561 1.00 . A A . 2 GLN O 1 1 7 2664 1 1 2 GLN OE1 O -12.779 -4.707 -2.617 1.00 . A A . 2 GLN OE1 1 1 7 2665 1 1 3 GLY C C -8.516 -3.555 1.635 1.00 . A A . 3 GLY C 1 1 7 2666 1 1 3 GLY CA C -9.566 -3.480 2.747 1.00 . A A . 3 GLY CA 1 1 7 2667 1 1 3 GLY H H -11.403 -4.439 2.304 1.00 . A A . 3 GLY H 1 1 7 2668 1 1 3 GLY HA2 H -9.431 -2.552 3.303 1.00 . A A . 3 GLY HA2 1 1 7 2669 1 1 3 GLY HA3 H -9.414 -4.313 3.434 1.00 . A A . 3 GLY HA3 1 1 7 2670 1 1 3 GLY N N -10.928 -3.550 2.236 1.00 . A A . 3 GLY N 1 1 7 2671 1 1 3 GLY O O -7.488 -4.206 1.803 1.00 . A A . 3 GLY O 1 1 7 2672 1 1 4 THR C C -8.329 -1.500 -1.454 1.00 . A A . 4 THR C 1 1 7 2673 1 1 4 THR CA C -7.852 -2.688 -0.601 1.00 . A A . 4 THR CA 1 1 7 2674 1 1 4 THR CB C -7.682 -4.008 -1.379 1.00 . A A . 4 THR CB 1 1 7 2675 1 1 4 THR CG2 C -8.987 -4.518 -2.001 1.00 . A A . 4 THR CG2 1 1 7 2676 1 1 4 THR H H -9.643 -2.362 0.465 1.00 . A A . 4 THR H 1 1 7 2677 1 1 4 THR HA H -6.876 -2.416 -0.193 1.00 . A A . 4 THR HA 1 1 7 2678 1 1 4 THR HB H -7.320 -4.776 -0.694 1.00 . A A . 4 THR HB 1 1 7 2679 1 1 4 THR HG1 H -6.581 -4.709 -2.823 1.00 . A A . 4 THR HG1 1 1 7 2680 1 1 4 THR HG21 H -9.744 -4.658 -1.230 1.00 . A A . 4 THR HG21 1 1 7 2681 1 1 4 THR HG22 H -9.356 -3.817 -2.748 1.00 . A A . 4 THR HG22 1 1 7 2682 1 1 4 THR HG23 H -8.804 -5.477 -2.485 1.00 . A A . 4 THR HG23 1 1 7 2683 1 1 4 THR N N -8.768 -2.864 0.518 1.00 . A A . 4 THR N 1 1 7 2684 1 1 4 THR O O -8.219 -1.503 -2.679 1.00 . A A . 4 THR O 1 1 7 2685 1 1 4 THR OG1 O -6.694 -3.865 -2.379 1.00 . A A . 4 THR OG1 1 1 7 2686 1 1 5 THR C C -8.921 1.895 -0.375 1.00 . A A . 5 THR C 1 1 7 2687 1 1 5 THR CA C -9.262 0.799 -1.383 1.00 . A A . 5 THR CA 1 1 7 2688 1 1 5 THR CB C -10.752 0.754 -1.763 1.00 . A A . 5 THR CB 1 1 7 2689 1 1 5 THR CG2 C -11.215 2.077 -2.380 1.00 . A A . 5 THR CG2 1 1 7 2690 1 1 5 THR H H -8.947 -0.541 0.217 1.00 . A A . 5 THR H 1 1 7 2691 1 1 5 THR HA H -8.686 0.985 -2.291 1.00 . A A . 5 THR HA 1 1 7 2692 1 1 5 THR HB H -11.363 0.538 -0.885 1.00 . A A . 5 THR HB 1 1 7 2693 1 1 5 THR HG1 H -10.288 -0.201 -3.391 1.00 . A A . 5 THR HG1 1 1 7 2694 1 1 5 THR HG21 H -10.608 2.314 -3.255 1.00 . A A . 5 THR HG21 1 1 7 2695 1 1 5 THR HG22 H -12.258 1.989 -2.684 1.00 . A A . 5 THR HG22 1 1 7 2696 1 1 5 THR HG23 H -11.130 2.887 -1.655 1.00 . A A . 5 THR HG23 1 1 7 2697 1 1 5 THR N N -8.855 -0.464 -0.786 1.00 . A A . 5 THR N 1 1 7 2698 1 1 5 THR O O -7.978 2.656 -0.582 1.00 . A A . 5 THR O 1 1 7 2699 1 1 5 THR OG1 O -10.960 -0.276 -2.708 1.00 . A A . 5 THR OG1 1 1 7 2700 1 1 6 SER C C -8.064 2.394 2.568 1.00 . A A . 6 SER C 1 1 7 2701 1 1 6 SER CA C -9.363 2.814 1.869 1.00 . A A . 6 SER CA 1 1 7 2702 1 1 6 SER CB C -10.546 2.780 2.841 1.00 . A A . 6 SER CB 1 1 7 2703 1 1 6 SER H H -10.420 1.289 0.860 1.00 . A A . 6 SER H 1 1 7 2704 1 1 6 SER HA H -9.246 3.838 1.512 1.00 . A A . 6 SER HA 1 1 7 2705 1 1 6 SER HB2 H -10.296 3.323 3.753 1.00 . A A . 6 SER HB2 1 1 7 2706 1 1 6 SER HB3 H -11.400 3.267 2.369 1.00 . A A . 6 SER HB3 1 1 7 2707 1 1 6 SER HG H -10.161 1.035 3.623 1.00 . A A . 6 SER HG 1 1 7 2708 1 1 6 SER N N -9.658 1.942 0.741 1.00 . A A . 6 SER N 1 1 7 2709 1 1 6 SER O O -7.394 3.226 3.174 1.00 . A A . 6 SER O 1 1 7 2710 1 1 6 SER OG O -10.893 1.445 3.156 1.00 . A A . 6 SER OG 1 1 7 2711 1 1 7 GLU C C -5.371 0.702 2.019 1.00 . A A . 7 GLU C 1 1 7 2712 1 1 7 GLU CA C -6.501 0.532 3.031 1.00 . A A . 7 GLU CA 1 1 7 2713 1 1 7 GLU CB C -6.765 -0.947 3.332 1.00 . A A . 7 GLU CB 1 1 7 2714 1 1 7 GLU CD C -4.986 -1.044 5.142 1.00 . A A . 7 GLU CD 1 1 7 2715 1 1 7 GLU CG C -5.537 -1.683 3.869 1.00 . A A . 7 GLU CG 1 1 7 2716 1 1 7 GLU H H -8.288 0.493 1.914 1.00 . A A . 7 GLU H 1 1 7 2717 1 1 7 GLU HA H -6.243 1.047 3.957 1.00 . A A . 7 GLU HA 1 1 7 2718 1 1 7 GLU HB2 H -7.575 -1.024 4.057 1.00 . A A . 7 GLU HB2 1 1 7 2719 1 1 7 GLU HB3 H -7.070 -1.436 2.408 1.00 . A A . 7 GLU HB3 1 1 7 2720 1 1 7 GLU HG2 H -5.808 -2.718 4.077 1.00 . A A . 7 GLU HG2 1 1 7 2721 1 1 7 GLU HG3 H -4.773 -1.683 3.097 1.00 . A A . 7 GLU HG3 1 1 7 2722 1 1 7 GLU N N -7.716 1.105 2.476 1.00 . A A . 7 GLU N 1 1 7 2723 1 1 7 GLU O O -4.258 1.078 2.380 1.00 . A A . 7 GLU O 1 1 7 2724 1 1 7 GLU OE1 O -5.667 -1.173 6.182 1.00 . A A . 7 GLU OE1 1 1 7 2725 1 1 7 GLU OE2 O -3.897 -0.437 5.052 1.00 . A A . 7 GLU OE2 1 1 7 2726 1 1 8 TYR C C -4.230 2.075 -0.404 1.00 . A A . 8 TYR C 1 1 7 2727 1 1 8 TYR CA C -4.770 0.644 -0.371 1.00 . A A . 8 TYR CA 1 1 7 2728 1 1 8 TYR CB C -5.494 0.285 -1.667 1.00 . A A . 8 TYR CB 1 1 7 2729 1 1 8 TYR CD1 C -3.598 -0.082 -3.285 1.00 . A A . 8 TYR CD1 1 1 7 2730 1 1 8 TYR CD2 C -5.117 1.781 -3.667 1.00 . A A . 8 TYR CD2 1 1 7 2731 1 1 8 TYR CE1 C -2.849 0.296 -4.409 1.00 . A A . 8 TYR CE1 1 1 7 2732 1 1 8 TYR CE2 C -4.387 2.141 -4.810 1.00 . A A . 8 TYR CE2 1 1 7 2733 1 1 8 TYR CG C -4.737 0.652 -2.920 1.00 . A A . 8 TYR CG 1 1 7 2734 1 1 8 TYR CZ C -3.254 1.395 -5.186 1.00 . A A . 8 TYR CZ 1 1 7 2735 1 1 8 TYR H H -6.604 0.106 0.529 1.00 . A A . 8 TYR H 1 1 7 2736 1 1 8 TYR HA H -3.922 -0.027 -0.255 1.00 . A A . 8 TYR HA 1 1 7 2737 1 1 8 TYR HB2 H -5.675 -0.789 -1.679 1.00 . A A . 8 TYR HB2 1 1 7 2738 1 1 8 TYR HB3 H -6.452 0.798 -1.685 1.00 . A A . 8 TYR HB3 1 1 7 2739 1 1 8 TYR HD1 H -3.294 -0.937 -2.704 1.00 . A A . 8 TYR HD1 1 1 7 2740 1 1 8 TYR HD2 H -5.965 2.379 -3.366 1.00 . A A . 8 TYR HD2 1 1 7 2741 1 1 8 TYR HE1 H -1.968 -0.271 -4.663 1.00 . A A . 8 TYR HE1 1 1 7 2742 1 1 8 TYR HE2 H -4.710 2.995 -5.383 1.00 . A A . 8 TYR HE2 1 1 7 2743 1 1 8 TYR HH H -2.916 2.486 -6.771 1.00 . A A . 8 TYR HH 1 1 7 2744 1 1 8 TYR N N -5.674 0.433 0.745 1.00 . A A . 8 TYR N 1 1 7 2745 1 1 8 TYR O O -3.075 2.270 -0.771 1.00 . A A . 8 TYR O 1 1 7 2746 1 1 8 TYR OH O -2.548 1.733 -6.304 1.00 . A A . 8 TYR OH 1 1 7 2747 1 1 9 SER C C -3.342 4.645 0.905 1.00 . A A . 9 SER C 1 1 7 2748 1 1 9 SER CA C -4.650 4.460 0.124 1.00 . A A . 9 SER CA 1 1 7 2749 1 1 9 SER CB C -5.774 5.267 0.782 1.00 . A A . 9 SER CB 1 1 7 2750 1 1 9 SER H H -6.004 2.828 0.227 1.00 . A A . 9 SER H 1 1 7 2751 1 1 9 SER HA H -4.501 4.855 -0.879 1.00 . A A . 9 SER HA 1 1 7 2752 1 1 9 SER HB2 H -5.998 4.859 1.766 1.00 . A A . 9 SER HB2 1 1 7 2753 1 1 9 SER HB3 H -5.455 6.303 0.897 1.00 . A A . 9 SER HB3 1 1 7 2754 1 1 9 SER HG H -7.224 4.339 -0.139 1.00 . A A . 9 SER HG 1 1 7 2755 1 1 9 SER N N -5.048 3.061 -0.007 1.00 . A A . 9 SER N 1 1 7 2756 1 1 9 SER O O -2.622 5.612 0.663 1.00 . A A . 9 SER O 1 1 7 2757 1 1 9 SER OG O -6.938 5.248 -0.017 1.00 . A A . 9 SER OG 1 1 7 2758 1 1 10 LYS C C -0.649 3.299 1.603 1.00 . A A . 10 LYS C 1 1 7 2759 1 1 10 LYS CA C -1.765 3.730 2.551 1.00 . A A . 10 LYS CA 1 1 7 2760 1 1 10 LYS CB C -1.871 2.828 3.786 1.00 . A A . 10 LYS CB 1 1 7 2761 1 1 10 LYS CD C -3.134 4.556 5.267 1.00 . A A . 10 LYS CD 1 1 7 2762 1 1 10 LYS CE C -3.813 5.589 4.352 1.00 . A A . 10 LYS CE 1 1 7 2763 1 1 10 LYS CG C -3.079 3.132 4.688 1.00 . A A . 10 LYS CG 1 1 7 2764 1 1 10 LYS H H -3.636 2.947 2.003 1.00 . A A . 10 LYS H 1 1 7 2765 1 1 10 LYS HA H -1.525 4.736 2.887 1.00 . A A . 10 LYS HA 1 1 7 2766 1 1 10 LYS HB2 H -1.945 1.787 3.465 1.00 . A A . 10 LYS HB2 1 1 7 2767 1 1 10 LYS HB3 H -0.960 2.929 4.375 1.00 . A A . 10 LYS HB3 1 1 7 2768 1 1 10 LYS HD2 H -3.730 4.496 6.180 1.00 . A A . 10 LYS HD2 1 1 7 2769 1 1 10 LYS HD3 H -2.133 4.892 5.538 1.00 . A A . 10 LYS HD3 1 1 7 2770 1 1 10 LYS HE2 H -3.145 5.928 3.563 1.00 . A A . 10 LYS HE2 1 1 7 2771 1 1 10 LYS HE3 H -4.702 5.156 3.893 1.00 . A A . 10 LYS HE3 1 1 7 2772 1 1 10 LYS HG2 H -4.015 2.916 4.173 1.00 . A A . 10 LYS HG2 1 1 7 2773 1 1 10 LYS HG3 H -3.010 2.442 5.531 1.00 . A A . 10 LYS HG3 1 1 7 2774 1 1 10 LYS HZ1 H -4.674 7.439 4.492 1.00 . A A . 10 LYS HZ1 1 1 7 2775 1 1 10 LYS HZ2 H -4.868 6.510 5.841 1.00 . A A . 10 LYS HZ2 1 1 7 2776 1 1 10 LYS HZ3 H -3.409 7.212 5.527 1.00 . A A . 10 LYS HZ3 1 1 7 2777 1 1 10 LYS N N -3.023 3.730 1.830 1.00 . A A . 10 LYS N 1 1 7 2778 1 1 10 LYS NZ N -4.223 6.781 5.112 1.00 . A A . 10 LYS NZ 1 1 7 2779 1 1 10 LYS O O 0.260 4.083 1.334 1.00 . A A . 10 LYS O 1 1 7 2780 1 1 11 TYR C C -0.001 1.960 -1.260 1.00 . A A . 11 TYR C 1 1 7 2781 1 1 11 TYR CA C 0.289 1.531 0.174 1.00 . A A . 11 TYR CA 1 1 7 2782 1 1 11 TYR CB C 0.433 0.021 0.376 1.00 . A A . 11 TYR CB 1 1 7 2783 1 1 11 TYR CD1 C -1.451 -1.414 -0.528 1.00 . A A . 11 TYR CD1 1 1 7 2784 1 1 11 TYR CD2 C -1.265 -1.082 1.875 1.00 . A A . 11 TYR CD2 1 1 7 2785 1 1 11 TYR CE1 C -2.498 -2.328 -0.319 1.00 . A A . 11 TYR CE1 1 1 7 2786 1 1 11 TYR CE2 C -2.286 -2.023 2.085 1.00 . A A . 11 TYR CE2 1 1 7 2787 1 1 11 TYR CG C -0.837 -0.783 0.569 1.00 . A A . 11 TYR CG 1 1 7 2788 1 1 11 TYR CZ C -2.917 -2.633 0.987 1.00 . A A . 11 TYR CZ 1 1 7 2789 1 1 11 TYR H H -1.571 1.545 1.132 1.00 . A A . 11 TYR H 1 1 7 2790 1 1 11 TYR HA H 1.251 1.966 0.444 1.00 . A A . 11 TYR HA 1 1 7 2791 1 1 11 TYR HB2 H 0.987 -0.392 -0.463 1.00 . A A . 11 TYR HB2 1 1 7 2792 1 1 11 TYR HB3 H 1.034 -0.101 1.275 1.00 . A A . 11 TYR HB3 1 1 7 2793 1 1 11 TYR HD1 H -1.104 -1.214 -1.531 1.00 . A A . 11 TYR HD1 1 1 7 2794 1 1 11 TYR HD2 H -0.792 -0.610 2.724 1.00 . A A . 11 TYR HD2 1 1 7 2795 1 1 11 TYR HE1 H -2.971 -2.812 -1.162 1.00 . A A . 11 TYR HE1 1 1 7 2796 1 1 11 TYR HE2 H -2.567 -2.283 3.094 1.00 . A A . 11 TYR HE2 1 1 7 2797 1 1 11 TYR HH H -4.135 -3.671 2.110 1.00 . A A . 11 TYR HH 1 1 7 2798 1 1 11 TYR N N -0.723 2.078 1.057 1.00 . A A . 11 TYR N 1 1 7 2799 1 1 11 TYR O O -0.091 1.158 -2.187 1.00 . A A . 11 TYR O 1 1 7 2800 1 1 11 TYR OH O -3.930 -3.526 1.183 1.00 . A A . 11 TYR OH 1 1 7 2801 1 1 12 LEU C C 0.656 5.263 -2.556 1.00 . A A . 12 LEU C 1 1 7 2802 1 1 12 LEU CA C -0.293 4.049 -2.598 1.00 . A A . 12 LEU CA 1 1 7 2803 1 1 12 LEU CB C -1.780 4.425 -2.684 1.00 . A A . 12 LEU CB 1 1 7 2804 1 1 12 LEU CD1 C -1.819 5.133 -5.128 1.00 . A A . 12 LEU CD1 1 1 7 2805 1 1 12 LEU CD2 C -3.646 5.844 -3.585 1.00 . A A . 12 LEU CD2 1 1 7 2806 1 1 12 LEU CG C -2.149 5.531 -3.685 1.00 . A A . 12 LEU CG 1 1 7 2807 1 1 12 LEU H H -0.083 3.816 -0.540 1.00 . A A . 12 LEU H 1 1 7 2808 1 1 12 LEU HA H -0.023 3.401 -3.425 1.00 . A A . 12 LEU HA 1 1 7 2809 1 1 12 LEU HB2 H -2.335 3.517 -2.923 1.00 . A A . 12 LEU HB2 1 1 7 2810 1 1 12 LEU HB3 H -2.086 4.760 -1.695 1.00 . A A . 12 LEU HB3 1 1 7 2811 1 1 12 LEU HD11 H -0.766 4.875 -5.233 1.00 . A A . 12 LEU HD11 1 1 7 2812 1 1 12 LEU HD12 H -2.421 4.275 -5.419 1.00 . A A . 12 LEU HD12 1 1 7 2813 1 1 12 LEU HD13 H -2.042 5.965 -5.796 1.00 . A A . 12 LEU HD13 1 1 7 2814 1 1 12 LEU HD21 H -3.870 6.255 -2.601 1.00 . A A . 12 LEU HD21 1 1 7 2815 1 1 12 LEU HD22 H -3.920 6.583 -4.338 1.00 . A A . 12 LEU HD22 1 1 7 2816 1 1 12 LEU HD23 H -4.235 4.940 -3.741 1.00 . A A . 12 LEU HD23 1 1 7 2817 1 1 12 LEU HG H -1.621 6.445 -3.411 1.00 . A A . 12 LEU HG 1 1 7 2818 1 1 12 LEU N N -0.124 3.279 -1.391 1.00 . A A . 12 LEU N 1 1 7 2819 1 1 12 LEU O O 0.891 5.893 -3.585 1.00 . A A . 12 LEU O 1 1 7 2820 1 1 13 ASP C C 3.523 6.376 -1.690 1.00 . A A . 13 ASP C 1 1 7 2821 1 1 13 ASP CA C 2.121 6.695 -1.139 1.00 . A A . 13 ASP CA 1 1 7 2822 1 1 13 ASP CB C 2.076 7.004 0.367 1.00 . A A . 13 ASP CB 1 1 7 2823 1 1 13 ASP CG C 2.797 8.299 0.735 1.00 . A A . 13 ASP CG 1 1 7 2824 1 1 13 ASP H H 0.984 5.039 -0.558 1.00 . A A . 13 ASP H 1 1 7 2825 1 1 13 ASP HA H 1.749 7.571 -1.670 1.00 . A A . 13 ASP HA 1 1 7 2826 1 1 13 ASP HB2 H 1.031 7.109 0.666 1.00 . A A . 13 ASP HB2 1 1 7 2827 1 1 13 ASP HB3 H 2.497 6.163 0.920 1.00 . A A . 13 ASP HB3 1 1 7 2828 1 1 13 ASP N N 1.209 5.587 -1.375 1.00 . A A . 13 ASP N 1 1 7 2829 1 1 13 ASP O O 3.656 6.106 -2.882 1.00 . A A . 13 ASP O 1 1 7 2830 1 1 13 ASP OD1 O 2.299 9.368 0.324 1.00 . A A . 13 ASP OD1 1 1 7 2831 1 1 13 ASP OD2 O 3.837 8.193 1.423 1.00 . A A . 13 ASP OD2 1 1 7 2832 1 1 14 SER C C 6.606 5.089 -0.550 1.00 . A A . 14 SER C 1 1 7 2833 1 1 14 SER CA C 5.958 6.280 -1.257 1.00 . A A . 14 SER CA 1 1 7 2834 1 1 14 SER CB C 6.703 7.599 -1.013 1.00 . A A . 14 SER CB 1 1 7 2835 1 1 14 SER H H 4.394 6.648 0.120 1.00 . A A . 14 SER H 1 1 7 2836 1 1 14 SER HA H 6.023 6.079 -2.327 1.00 . A A . 14 SER HA 1 1 7 2837 1 1 14 SER HB2 H 6.625 7.899 0.032 1.00 . A A . 14 SER HB2 1 1 7 2838 1 1 14 SER HB3 H 7.755 7.479 -1.277 1.00 . A A . 14 SER HB3 1 1 7 2839 1 1 14 SER HG H 6.629 9.430 -1.670 1.00 . A A . 14 SER HG 1 1 7 2840 1 1 14 SER N N 4.566 6.425 -0.849 1.00 . A A . 14 SER N 1 1 7 2841 1 1 14 SER O O 6.620 3.995 -1.112 1.00 . A A . 14 SER O 1 1 7 2842 1 1 14 SER OG O 6.143 8.616 -1.817 1.00 . A A . 14 SER OG 1 1 7 2843 1 1 15 ARG C C 6.963 3.027 1.562 1.00 . A A . 15 ARG C 1 1 7 2844 1 1 15 ARG CA C 7.872 4.233 1.370 1.00 . A A . 15 ARG CA 1 1 7 2845 1 1 15 ARG CB C 8.430 4.756 2.703 1.00 . A A . 15 ARG CB 1 1 7 2846 1 1 15 ARG CD C 8.718 2.536 4.059 1.00 . A A . 15 ARG CD 1 1 7 2847 1 1 15 ARG CG C 9.377 3.766 3.411 1.00 . A A . 15 ARG CG 1 1 7 2848 1 1 15 ARG CZ C 6.912 2.040 5.700 1.00 . A A . 15 ARG CZ 1 1 7 2849 1 1 15 ARG H H 7.088 6.190 1.097 1.00 . A A . 15 ARG H 1 1 7 2850 1 1 15 ARG HA H 8.718 3.936 0.748 1.00 . A A . 15 ARG HA 1 1 7 2851 1 1 15 ARG HB2 H 9.014 5.650 2.482 1.00 . A A . 15 ARG HB2 1 1 7 2852 1 1 15 ARG HB3 H 7.618 5.048 3.370 1.00 . A A . 15 ARG HB3 1 1 7 2853 1 1 15 ARG HD2 H 8.310 1.862 3.310 1.00 . A A . 15 ARG HD2 1 1 7 2854 1 1 15 ARG HD3 H 9.487 1.976 4.589 1.00 . A A . 15 ARG HD3 1 1 7 2855 1 1 15 ARG HE H 7.533 3.899 5.181 1.00 . A A . 15 ARG HE 1 1 7 2856 1 1 15 ARG HG2 H 10.130 3.425 2.699 1.00 . A A . 15 ARG HG2 1 1 7 2857 1 1 15 ARG HG3 H 9.892 4.314 4.202 1.00 . A A . 15 ARG HG3 1 1 7 2858 1 1 15 ARG HH11 H 7.745 0.356 4.888 1.00 . A A . 15 ARG HH11 1 1 7 2859 1 1 15 ARG HH12 H 6.476 0.076 6.056 1.00 . A A . 15 ARG HH12 1 1 7 2860 1 1 15 ARG HH21 H 5.878 3.495 6.692 1.00 . A A . 15 ARG HH21 1 1 7 2861 1 1 15 ARG HH22 H 5.418 1.853 7.080 1.00 . A A . 15 ARG HH22 1 1 7 2862 1 1 15 ARG N N 7.148 5.282 0.662 1.00 . A A . 15 ARG N 1 1 7 2863 1 1 15 ARG NE N 7.672 2.912 5.017 1.00 . A A . 15 ARG NE 1 1 7 2864 1 1 15 ARG NH1 N 7.057 0.716 5.534 1.00 . A A . 15 ARG NH1 1 1 7 2865 1 1 15 ARG NH2 N 5.995 2.500 6.562 1.00 . A A . 15 ARG NH2 1 1 7 2866 1 1 15 ARG O O 7.255 1.957 1.037 1.00 . A A . 15 ARG O 1 1 7 2867 1 1 16 ARG C C 4.384 1.426 1.399 1.00 . A A . 16 ARG C 1 1 7 2868 1 1 16 ARG CA C 4.941 2.133 2.638 1.00 . A A . 16 ARG CA 1 1 7 2869 1 1 16 ARG CB C 3.833 2.648 3.567 1.00 . A A . 16 ARG CB 1 1 7 2870 1 1 16 ARG CD C 1.952 4.253 3.964 1.00 . A A . 16 ARG CD 1 1 7 2871 1 1 16 ARG CG C 3.068 3.846 2.995 1.00 . A A . 16 ARG CG 1 1 7 2872 1 1 16 ARG CZ C 0.542 6.307 4.253 1.00 . A A . 16 ARG CZ 1 1 7 2873 1 1 16 ARG H H 5.698 4.116 2.703 1.00 . A A . 16 ARG H 1 1 7 2874 1 1 16 ARG HA H 5.494 1.383 3.204 1.00 . A A . 16 ARG HA 1 1 7 2875 1 1 16 ARG HB2 H 3.134 1.833 3.762 1.00 . A A . 16 ARG HB2 1 1 7 2876 1 1 16 ARG HB3 H 4.285 2.947 4.513 1.00 . A A . 16 ARG HB3 1 1 7 2877 1 1 16 ARG HD2 H 1.233 3.436 4.037 1.00 . A A . 16 ARG HD2 1 1 7 2878 1 1 16 ARG HD3 H 2.383 4.434 4.947 1.00 . A A . 16 ARG HD3 1 1 7 2879 1 1 16 ARG HE H 1.226 5.583 2.491 1.00 . A A . 16 ARG HE 1 1 7 2880 1 1 16 ARG HG2 H 3.745 4.690 2.862 1.00 . A A . 16 ARG HG2 1 1 7 2881 1 1 16 ARG HG3 H 2.646 3.574 2.028 1.00 . A A . 16 ARG HG3 1 1 7 2882 1 1 16 ARG HH11 H 0.929 5.390 6.042 1.00 . A A . 16 ARG HH11 1 1 7 2883 1 1 16 ARG HH12 H -0.079 6.813 6.130 1.00 . A A . 16 ARG HH12 1 1 7 2884 1 1 16 ARG HH21 H -0.053 7.446 2.664 1.00 . A A . 16 ARG HH21 1 1 7 2885 1 1 16 ARG HH22 H -0.639 7.972 4.225 1.00 . A A . 16 ARG HH22 1 1 7 2886 1 1 16 ARG N N 5.869 3.203 2.309 1.00 . A A . 16 ARG N 1 1 7 2887 1 1 16 ARG NE N 1.250 5.453 3.494 1.00 . A A . 16 ARG NE 1 1 7 2888 1 1 16 ARG NH1 N 0.460 6.157 5.583 1.00 . A A . 16 ARG NH1 1 1 7 2889 1 1 16 ARG NH2 N -0.102 7.325 3.666 1.00 . A A . 16 ARG NH2 1 1 7 2890 1 1 16 ARG O O 4.083 0.239 1.476 1.00 . A A . 16 ARG O 1 1 7 2891 1 1 17 ALA C C 4.766 0.572 -1.552 1.00 . A A . 17 ALA C 1 1 7 2892 1 1 17 ALA CA C 3.743 1.536 -0.964 1.00 . A A . 17 ALA CA 1 1 7 2893 1 1 17 ALA CB C 3.362 2.647 -1.942 1.00 . A A . 17 ALA CB 1 1 7 2894 1 1 17 ALA H H 4.598 3.074 0.215 1.00 . A A . 17 ALA H 1 1 7 2895 1 1 17 ALA HA H 2.847 0.961 -0.745 1.00 . A A . 17 ALA HA 1 1 7 2896 1 1 17 ALA HB1 H 2.975 2.216 -2.866 1.00 . A A . 17 ALA HB1 1 1 7 2897 1 1 17 ALA HB2 H 2.596 3.271 -1.489 1.00 . A A . 17 ALA HB2 1 1 7 2898 1 1 17 ALA HB3 H 4.223 3.273 -2.164 1.00 . A A . 17 ALA HB3 1 1 7 2899 1 1 17 ALA N N 4.257 2.124 0.262 1.00 . A A . 17 ALA N 1 1 7 2900 1 1 17 ALA O O 4.460 -0.594 -1.787 1.00 . A A . 17 ALA O 1 1 7 2901 1 1 18 GLN C C 7.399 -0.904 -1.375 1.00 . A A . 18 GLN C 1 1 7 2902 1 1 18 GLN CA C 7.093 0.276 -2.298 1.00 . A A . 18 GLN CA 1 1 7 2903 1 1 18 GLN CB C 8.314 1.194 -2.447 1.00 . A A . 18 GLN CB 1 1 7 2904 1 1 18 GLN CD C 6.985 2.326 -4.379 1.00 . A A . 18 GLN CD 1 1 7 2905 1 1 18 GLN CG C 8.341 2.047 -3.728 1.00 . A A . 18 GLN CG 1 1 7 2906 1 1 18 GLN H H 6.170 2.027 -1.535 1.00 . A A . 18 GLN H 1 1 7 2907 1 1 18 GLN HA H 6.812 -0.145 -3.264 1.00 . A A . 18 GLN HA 1 1 7 2908 1 1 18 GLN HB2 H 8.367 1.854 -1.580 1.00 . A A . 18 GLN HB2 1 1 7 2909 1 1 18 GLN HB3 H 9.219 0.584 -2.448 1.00 . A A . 18 GLN HB3 1 1 7 2910 1 1 18 GLN HE21 H 6.491 3.714 -2.969 1.00 . A A . 18 GLN HE21 1 1 7 2911 1 1 18 GLN HE22 H 5.326 3.489 -4.257 1.00 . A A . 18 GLN HE22 1 1 7 2912 1 1 18 GLN HG2 H 8.829 2.995 -3.501 1.00 . A A . 18 GLN HG2 1 1 7 2913 1 1 18 GLN HG3 H 8.947 1.517 -4.461 1.00 . A A . 18 GLN HG3 1 1 7 2914 1 1 18 GLN N N 5.988 1.060 -1.770 1.00 . A A . 18 GLN N 1 1 7 2915 1 1 18 GLN NE2 N 6.214 3.265 -3.831 1.00 . A A . 18 GLN NE2 1 1 7 2916 1 1 18 GLN O O 7.537 -2.030 -1.844 1.00 . A A . 18 GLN O 1 1 7 2917 1 1 18 GLN OE1 O 6.641 1.707 -5.382 1.00 . A A . 18 GLN OE1 1 1 7 2918 1 1 19 ASP C C 6.713 -2.758 0.878 1.00 . A A . 19 ASP C 1 1 7 2919 1 1 19 ASP CA C 7.769 -1.658 0.941 1.00 . A A . 19 ASP CA 1 1 7 2920 1 1 19 ASP CB C 7.815 -0.999 2.323 1.00 . A A . 19 ASP CB 1 1 7 2921 1 1 19 ASP CG C 8.038 -2.022 3.433 1.00 . A A . 19 ASP CG 1 1 7 2922 1 1 19 ASP H H 7.303 0.291 0.249 1.00 . A A . 19 ASP H 1 1 7 2923 1 1 19 ASP HA H 8.748 -2.096 0.734 1.00 . A A . 19 ASP HA 1 1 7 2924 1 1 19 ASP HB2 H 8.631 -0.277 2.341 1.00 . A A . 19 ASP HB2 1 1 7 2925 1 1 19 ASP HB3 H 6.878 -0.471 2.507 1.00 . A A . 19 ASP HB3 1 1 7 2926 1 1 19 ASP N N 7.490 -0.649 -0.067 1.00 . A A . 19 ASP N 1 1 7 2927 1 1 19 ASP O O 7.055 -3.936 0.809 1.00 . A A . 19 ASP O 1 1 7 2928 1 1 19 ASP OD1 O 9.197 -2.469 3.570 1.00 . A A . 19 ASP OD1 1 1 7 2929 1 1 19 ASP OD2 O 7.045 -2.341 4.123 1.00 . A A . 19 ASP OD2 1 1 7 2930 1 1 20 PHE C C 4.409 -4.101 -0.535 1.00 . A A . 20 PHE C 1 1 7 2931 1 1 20 PHE CA C 4.314 -3.278 0.754 1.00 . A A . 20 PHE CA 1 1 7 2932 1 1 20 PHE CB C 3.002 -2.495 0.833 1.00 . A A . 20 PHE CB 1 1 7 2933 1 1 20 PHE CD1 C 1.221 -3.865 1.988 1.00 . A A . 20 PHE CD1 1 1 7 2934 1 1 20 PHE CD2 C 1.160 -3.667 -0.440 1.00 . A A . 20 PHE CD2 1 1 7 2935 1 1 20 PHE CE1 C 0.075 -4.677 1.950 1.00 . A A . 20 PHE CE1 1 1 7 2936 1 1 20 PHE CE2 C 0.022 -4.489 -0.478 1.00 . A A . 20 PHE CE2 1 1 7 2937 1 1 20 PHE CG C 1.762 -3.358 0.792 1.00 . A A . 20 PHE CG 1 1 7 2938 1 1 20 PHE CZ C -0.519 -4.996 0.716 1.00 . A A . 20 PHE CZ 1 1 7 2939 1 1 20 PHE H H 5.224 -1.376 0.952 1.00 . A A . 20 PHE H 1 1 7 2940 1 1 20 PHE HA H 4.339 -3.960 1.605 1.00 . A A . 20 PHE HA 1 1 7 2941 1 1 20 PHE HB2 H 2.985 -1.946 1.774 1.00 . A A . 20 PHE HB2 1 1 7 2942 1 1 20 PHE HB3 H 2.961 -1.776 0.015 1.00 . A A . 20 PHE HB3 1 1 7 2943 1 1 20 PHE HD1 H 1.690 -3.630 2.935 1.00 . A A . 20 PHE HD1 1 1 7 2944 1 1 20 PHE HD2 H 1.579 -3.271 -1.355 1.00 . A A . 20 PHE HD2 1 1 7 2945 1 1 20 PHE HE1 H -0.344 -5.062 2.868 1.00 . A A . 20 PHE HE1 1 1 7 2946 1 1 20 PHE HE2 H -0.445 -4.721 -1.424 1.00 . A A . 20 PHE HE2 1 1 7 2947 1 1 20 PHE HZ H -1.396 -5.627 0.687 1.00 . A A . 20 PHE HZ 1 1 7 2948 1 1 20 PHE N N 5.435 -2.363 0.881 1.00 . A A . 20 PHE N 1 1 7 2949 1 1 20 PHE O O 4.098 -5.288 -0.515 1.00 . A A . 20 PHE O 1 1 7 2950 1 1 21 VAL C C 6.052 -5.302 -2.802 1.00 . A A . 21 VAL C 1 1 7 2951 1 1 21 VAL CA C 4.969 -4.228 -2.910 1.00 . A A . 21 VAL CA 1 1 7 2952 1 1 21 VAL CB C 5.181 -3.248 -4.080 1.00 . A A . 21 VAL CB 1 1 7 2953 1 1 21 VAL CG1 C 5.686 -3.949 -5.347 1.00 . A A . 21 VAL CG1 1 1 7 2954 1 1 21 VAL CG2 C 3.858 -2.546 -4.413 1.00 . A A . 21 VAL CG2 1 1 7 2955 1 1 21 VAL H H 5.104 -2.519 -1.635 1.00 . A A . 21 VAL H 1 1 7 2956 1 1 21 VAL HA H 4.038 -4.767 -3.081 1.00 . A A . 21 VAL HA 1 1 7 2957 1 1 21 VAL HB H 5.916 -2.495 -3.798 1.00 . A A . 21 VAL HB 1 1 7 2958 1 1 21 VAL HG11 H 6.702 -4.315 -5.197 1.00 . A A . 21 VAL HG11 1 1 7 2959 1 1 21 VAL HG12 H 5.032 -4.784 -5.602 1.00 . A A . 21 VAL HG12 1 1 7 2960 1 1 21 VAL HG13 H 5.701 -3.242 -6.177 1.00 . A A . 21 VAL HG13 1 1 7 2961 1 1 21 VAL HG21 H 4.034 -1.760 -5.148 1.00 . A A . 21 VAL HG21 1 1 7 2962 1 1 21 VAL HG22 H 3.150 -3.266 -4.824 1.00 . A A . 21 VAL HG22 1 1 7 2963 1 1 21 VAL HG23 H 3.421 -2.102 -3.521 1.00 . A A . 21 VAL HG23 1 1 7 2964 1 1 21 VAL N N 4.840 -3.500 -1.652 1.00 . A A . 21 VAL N 1 1 7 2965 1 1 21 VAL O O 5.775 -6.472 -3.059 1.00 . A A . 21 VAL O 1 1 7 2966 1 1 22 GLN C C 8.044 -6.956 -1.221 1.00 . A A . 22 GLN C 1 1 7 2967 1 1 22 GLN CA C 8.374 -5.867 -2.239 1.00 . A A . 22 GLN CA 1 1 7 2968 1 1 22 GLN CB C 9.647 -5.133 -1.822 1.00 . A A . 22 GLN CB 1 1 7 2969 1 1 22 GLN CD C 11.512 -3.806 -2.887 1.00 . A A . 22 GLN CD 1 1 7 2970 1 1 22 GLN CG C 10.021 -4.112 -2.896 1.00 . A A . 22 GLN CG 1 1 7 2971 1 1 22 GLN H H 7.440 -3.948 -2.197 1.00 . A A . 22 GLN H 1 1 7 2972 1 1 22 GLN HA H 8.579 -6.349 -3.197 1.00 . A A . 22 GLN HA 1 1 7 2973 1 1 22 GLN HB2 H 9.509 -4.629 -0.863 1.00 . A A . 22 GLN HB2 1 1 7 2974 1 1 22 GLN HB3 H 10.443 -5.872 -1.720 1.00 . A A . 22 GLN HB3 1 1 7 2975 1 1 22 GLN HE21 H 11.922 -5.624 -3.707 1.00 . A A . 22 GLN HE21 1 1 7 2976 1 1 22 GLN HE22 H 13.310 -4.611 -3.383 1.00 . A A . 22 GLN HE22 1 1 7 2977 1 1 22 GLN HG2 H 9.746 -4.507 -3.874 1.00 . A A . 22 GLN HG2 1 1 7 2978 1 1 22 GLN HG3 H 9.458 -3.200 -2.721 1.00 . A A . 22 GLN HG3 1 1 7 2979 1 1 22 GLN N N 7.273 -4.923 -2.409 1.00 . A A . 22 GLN N 1 1 7 2980 1 1 22 GLN NE2 N 12.314 -4.758 -3.367 1.00 . A A . 22 GLN NE2 1 1 7 2981 1 1 22 GLN O O 8.529 -8.080 -1.338 1.00 . A A . 22 GLN O 1 1 7 2982 1 1 22 GLN OE1 O 11.933 -2.734 -2.460 1.00 . A A . 22 GLN OE1 1 1 7 2983 1 1 23 TRP C C 5.886 -8.586 0.243 1.00 . A A . 23 TRP C 1 1 7 2984 1 1 23 TRP CA C 6.838 -7.543 0.823 1.00 . A A . 23 TRP CA 1 1 7 2985 1 1 23 TRP CB C 6.183 -6.766 1.964 1.00 . A A . 23 TRP CB 1 1 7 2986 1 1 23 TRP CD1 C 5.916 -8.523 3.742 1.00 . A A . 23 TRP CD1 1 1 7 2987 1 1 23 TRP CD2 C 3.962 -7.861 2.884 1.00 . A A . 23 TRP CD2 1 1 7 2988 1 1 23 TRP CE2 C 3.673 -8.895 3.819 1.00 . A A . 23 TRP CE2 1 1 7 2989 1 1 23 TRP CE3 C 2.890 -7.342 2.135 1.00 . A A . 23 TRP CE3 1 1 7 2990 1 1 23 TRP CG C 5.395 -7.630 2.883 1.00 . A A . 23 TRP CG 1 1 7 2991 1 1 23 TRP CH2 C 1.320 -8.827 3.270 1.00 . A A . 23 TRP CH2 1 1 7 2992 1 1 23 TRP CZ2 C 2.371 -9.370 4.026 1.00 . A A . 23 TRP CZ2 1 1 7 2993 1 1 23 TRP CZ3 C 1.581 -7.825 2.318 1.00 . A A . 23 TRP CZ3 1 1 7 2994 1 1 23 TRP H H 6.774 -5.711 -0.233 1.00 . A A . 23 TRP H 1 1 7 2995 1 1 23 TRP HA H 7.723 -8.048 1.212 1.00 . A A . 23 TRP HA 1 1 7 2996 1 1 23 TRP HB2 H 6.948 -6.234 2.530 1.00 . A A . 23 TRP HB2 1 1 7 2997 1 1 23 TRP HB3 H 5.496 -6.030 1.552 1.00 . A A . 23 TRP HB3 1 1 7 2998 1 1 23 TRP HD1 H 6.977 -8.664 3.862 1.00 . A A . 23 TRP HD1 1 1 7 2999 1 1 23 TRP HE1 H 5.016 -9.973 5.030 1.00 . A A . 23 TRP HE1 1 1 7 3000 1 1 23 TRP HE3 H 3.114 -6.588 1.392 1.00 . A A . 23 TRP HE3 1 1 7 3001 1 1 23 TRP HH2 H 0.316 -9.195 3.414 1.00 . A A . 23 TRP HH2 1 1 7 3002 1 1 23 TRP HZ2 H 2.182 -10.155 4.743 1.00 . A A . 23 TRP HZ2 1 1 7 3003 1 1 23 TRP HZ3 H 0.774 -7.436 1.716 1.00 . A A . 23 TRP HZ3 1 1 7 3004 1 1 23 TRP N N 7.218 -6.622 -0.226 1.00 . A A . 23 TRP N 1 1 7 3005 1 1 23 TRP NE1 N 4.902 -9.243 4.343 1.00 . A A . 23 TRP NE1 1 1 7 3006 1 1 23 TRP O O 6.160 -9.780 0.308 1.00 . A A . 23 TRP O 1 1 7 3007 1 1 24 LEU C C 4.372 -9.866 -1.989 1.00 . A A . 24 LEU C 1 1 7 3008 1 1 24 LEU CA C 3.748 -8.911 -0.971 1.00 . A A . 24 LEU CA 1 1 7 3009 1 1 24 LEU CB C 2.751 -7.957 -1.641 1.00 . A A . 24 LEU CB 1 1 7 3010 1 1 24 LEU CD1 C 0.753 -9.517 -1.383 1.00 . A A . 24 LEU CD1 1 1 7 3011 1 1 24 LEU CD2 C 0.672 -7.589 -2.970 1.00 . A A . 24 LEU CD2 1 1 7 3012 1 1 24 LEU CG C 1.578 -8.656 -2.348 1.00 . A A . 24 LEU CG 1 1 7 3013 1 1 24 LEU H H 4.632 -7.110 -0.305 1.00 . A A . 24 LEU H 1 1 7 3014 1 1 24 LEU HA H 3.238 -9.482 -0.196 1.00 . A A . 24 LEU HA 1 1 7 3015 1 1 24 LEU HB2 H 2.353 -7.286 -0.881 1.00 . A A . 24 LEU HB2 1 1 7 3016 1 1 24 LEU HB3 H 3.294 -7.358 -2.374 1.00 . A A . 24 LEU HB3 1 1 7 3017 1 1 24 LEU HD11 H 0.435 -8.922 -0.527 1.00 . A A . 24 LEU HD11 1 1 7 3018 1 1 24 LEU HD12 H -0.129 -9.899 -1.897 1.00 . A A . 24 LEU HD12 1 1 7 3019 1 1 24 LEU HD13 H 1.338 -10.368 -1.035 1.00 . A A . 24 LEU HD13 1 1 7 3020 1 1 24 LEU HD21 H 0.249 -6.960 -2.188 1.00 . A A . 24 LEU HD21 1 1 7 3021 1 1 24 LEU HD22 H 1.247 -6.969 -3.659 1.00 . A A . 24 LEU HD22 1 1 7 3022 1 1 24 LEU HD23 H -0.139 -8.067 -3.521 1.00 . A A . 24 LEU HD23 1 1 7 3023 1 1 24 LEU HG H 1.956 -9.289 -3.152 1.00 . A A . 24 LEU HG 1 1 7 3024 1 1 24 LEU N N 4.774 -8.110 -0.324 1.00 . A A . 24 LEU N 1 1 7 3025 1 1 24 LEU O O 3.966 -11.022 -2.094 1.00 . A A . 24 LEU O 1 1 7 3026 1 1 25 MET C C 6.900 -11.268 -2.997 1.00 . A A . 25 MET C 1 1 7 3027 1 1 25 MET CA C 6.126 -10.151 -3.694 1.00 . A A . 25 MET CA 1 1 7 3028 1 1 25 MET CB C 7.101 -9.245 -4.449 1.00 . A A . 25 MET CB 1 1 7 3029 1 1 25 MET CE C 8.745 -8.007 -6.966 1.00 . A A . 25 MET CE 1 1 7 3030 1 1 25 MET CG C 6.388 -8.423 -5.528 1.00 . A A . 25 MET CG 1 1 7 3031 1 1 25 MET H H 5.647 -8.409 -2.557 1.00 . A A . 25 MET H 1 1 7 3032 1 1 25 MET HA H 5.430 -10.597 -4.405 1.00 . A A . 25 MET HA 1 1 7 3033 1 1 25 MET HB2 H 7.595 -8.585 -3.737 1.00 . A A . 25 MET HB2 1 1 7 3034 1 1 25 MET HB3 H 7.857 -9.871 -4.923 1.00 . A A . 25 MET HB3 1 1 7 3035 1 1 25 MET HE1 H 8.353 -8.758 -7.652 1.00 . A A . 25 MET HE1 1 1 7 3036 1 1 25 MET HE2 H 9.390 -7.321 -7.515 1.00 . A A . 25 MET HE2 1 1 7 3037 1 1 25 MET HE3 H 9.327 -8.493 -6.184 1.00 . A A . 25 MET HE3 1 1 7 3038 1 1 25 MET HG2 H 6.085 -9.090 -6.336 1.00 . A A . 25 MET HG2 1 1 7 3039 1 1 25 MET HG3 H 5.487 -7.980 -5.107 1.00 . A A . 25 MET HG3 1 1 7 3040 1 1 25 MET N N 5.372 -9.370 -2.726 1.00 . A A . 25 MET N 1 1 7 3041 1 1 25 MET O O 6.749 -12.435 -3.355 1.00 . A A . 25 MET O 1 1 7 3042 1 1 25 MET SD S 7.376 -7.075 -6.232 1.00 . A A . 25 MET SD 1 1 7 3043 1 1 26 ASN C C 7.744 -12.967 -0.658 1.00 . A A . 26 ASN C 1 1 7 3044 1 1 26 ASN CA C 8.571 -11.833 -1.269 1.00 . A A . 26 ASN CA 1 1 7 3045 1 1 26 ASN CB C 9.348 -11.069 -0.190 1.00 . A A . 26 ASN CB 1 1 7 3046 1 1 26 ASN CG C 10.227 -12.000 0.638 1.00 . A A . 26 ASN CG 1 1 7 3047 1 1 26 ASN H H 7.799 -9.922 -1.771 1.00 . A A . 26 ASN H 1 1 7 3048 1 1 26 ASN HA H 9.289 -12.267 -1.966 1.00 . A A . 26 ASN HA 1 1 7 3049 1 1 26 ASN HB2 H 9.980 -10.317 -0.664 1.00 . A A . 26 ASN HB2 1 1 7 3050 1 1 26 ASN HB3 H 8.650 -10.562 0.477 1.00 . A A . 26 ASN HB3 1 1 7 3051 1 1 26 ASN HD21 H 11.465 -12.333 -0.946 1.00 . A A . 26 ASN HD21 1 1 7 3052 1 1 26 ASN HD22 H 11.882 -13.172 0.532 1.00 . A A . 26 ASN HD22 1 1 7 3053 1 1 26 ASN N N 7.732 -10.903 -2.013 1.00 . A A . 26 ASN N 1 1 7 3054 1 1 26 ASN ND2 N 11.279 -12.543 0.024 1.00 . A A . 26 ASN ND2 1 1 7 3055 1 1 26 ASN O O 8.144 -14.127 -0.730 1.00 . A A . 26 ASN O 1 1 7 3056 1 1 26 ASN OD1 O 9.959 -12.228 1.815 1.00 . A A . 26 ASN OD1 1 1 7 3057 1 1 27 THR C C 5.001 -14.450 -0.528 1.00 . A A . 27 THR C 1 1 7 3058 1 1 27 THR CA C 5.692 -13.597 0.541 1.00 . A A . 27 THR CA 1 1 7 3059 1 1 27 THR CB C 4.683 -12.867 1.438 1.00 . A A . 27 THR CB 1 1 7 3060 1 1 27 THR CG2 C 5.401 -12.212 2.621 1.00 . A A . 27 THR CG2 1 1 7 3061 1 1 27 THR H H 6.319 -11.658 -0.035 1.00 . A A . 27 THR H 1 1 7 3062 1 1 27 THR HA H 6.273 -14.269 1.174 1.00 . A A . 27 THR HA 1 1 7 3063 1 1 27 THR HB H 3.961 -13.588 1.824 1.00 . A A . 27 THR HB 1 1 7 3064 1 1 27 THR HG1 H 3.560 -12.249 -0.036 1.00 . A A . 27 THR HG1 1 1 7 3065 1 1 27 THR HG21 H 6.092 -11.442 2.275 1.00 . A A . 27 THR HG21 1 1 7 3066 1 1 27 THR HG22 H 4.661 -11.755 3.274 1.00 . A A . 27 THR HG22 1 1 7 3067 1 1 27 THR HG23 H 5.960 -12.963 3.178 1.00 . A A . 27 THR HG23 1 1 7 3068 1 1 27 THR N N 6.594 -12.631 -0.064 1.00 . A A . 27 THR N 1 1 7 3069 1 1 27 THR O O 4.890 -15.663 -0.371 1.00 . A A . 27 THR O 1 1 7 3070 1 1 27 THR OG1 O 3.995 -11.859 0.726 1.00 . A A . 27 THR OG1 1 1 7 3071 1 1 28 NH2 HN1 H 4.646 -12.830 -1.721 1.00 . A A . 28 NH2 HN1 1 1 7 3072 1 1 28 NH2 HN2 H 4.082 -14.368 -2.339 1.00 . A A . 28 NH2 HN2 1 1 7 3073 1 1 28 NH2 N N 4.535 -13.831 -1.615 1.00 . A A . 28 NH2 N 1 1 8 3074 1 1 1 SER C C -12.110 11.753 5.521 1.00 . A A . 1 SER C 1 1 8 3075 1 1 1 SER CA C -11.445 12.412 4.314 1.00 . A A . 1 SER CA 1 1 8 3076 1 1 1 SER CB C -9.944 12.101 4.300 1.00 . A A . 1 SER CB 1 1 8 3077 1 1 1 SER H1 H -11.259 14.270 3.482 1.00 . A A . 1 SER H1 1 1 8 3078 1 1 1 SER H2 H -12.678 14.040 4.290 1.00 . A A . 1 SER H2 1 1 8 3079 1 1 1 SER H3 H -11.280 14.277 5.132 1.00 . A A . 1 SER H3 1 1 8 3080 1 1 1 SER HA H -11.885 12.011 3.401 1.00 . A A . 1 SER HA 1 1 8 3081 1 1 1 SER HB2 H -9.498 12.467 3.375 1.00 . A A . 1 SER HB2 1 1 8 3082 1 1 1 SER HB3 H -9.463 12.596 5.145 1.00 . A A . 1 SER HB3 1 1 8 3083 1 1 1 SER HG H -8.813 10.578 4.699 1.00 . A A . 1 SER HG 1 1 8 3084 1 1 1 SER N N -11.683 13.864 4.303 1.00 . A A . 1 SER N 1 1 8 3085 1 1 1 SER O O -11.710 12.001 6.658 1.00 . A A . 1 SER O 1 1 8 3086 1 1 1 SER OG O -9.720 10.708 4.406 1.00 . A A . 1 SER OG 1 1 8 3087 1 1 2 GLN C C -13.047 8.791 6.457 1.00 . A A . 2 GLN C 1 1 8 3088 1 1 2 GLN CA C -13.796 10.117 6.284 1.00 . A A . 2 GLN CA 1 1 8 3089 1 1 2 GLN CB C -15.264 9.905 5.873 1.00 . A A . 2 GLN CB 1 1 8 3090 1 1 2 GLN CD C -15.677 12.095 4.597 1.00 . A A . 2 GLN CD 1 1 8 3091 1 1 2 GLN CG C -16.066 11.214 5.786 1.00 . A A . 2 GLN CG 1 1 8 3092 1 1 2 GLN H H -13.399 10.762 4.307 1.00 . A A . 2 GLN H 1 1 8 3093 1 1 2 GLN HA H -13.787 10.644 7.239 1.00 . A A . 2 GLN HA 1 1 8 3094 1 1 2 GLN HB2 H -15.316 9.376 4.920 1.00 . A A . 2 GLN HB2 1 1 8 3095 1 1 2 GLN HB3 H -15.742 9.284 6.633 1.00 . A A . 2 GLN HB3 1 1 8 3096 1 1 2 GLN HE21 H -15.773 13.784 5.734 1.00 . A A . 2 GLN HE21 1 1 8 3097 1 1 2 GLN HE22 H -15.339 14.024 4.055 1.00 . A A . 2 GLN HE22 1 1 8 3098 1 1 2 GLN HG2 H -17.122 10.963 5.677 1.00 . A A . 2 GLN HG2 1 1 8 3099 1 1 2 GLN HG3 H -15.941 11.766 6.718 1.00 . A A . 2 GLN HG3 1 1 8 3100 1 1 2 GLN N N -13.108 10.899 5.266 1.00 . A A . 2 GLN N 1 1 8 3101 1 1 2 GLN NE2 N -15.588 13.408 4.816 1.00 . A A . 2 GLN NE2 1 1 8 3102 1 1 2 GLN O O -13.625 7.716 6.307 1.00 . A A . 2 GLN O 1 1 8 3103 1 1 2 GLN OE1 O -15.452 11.598 3.495 1.00 . A A . 2 GLN OE1 1 1 8 3104 1 1 3 GLY C C -10.735 7.076 5.414 1.00 . A A . 3 GLY C 1 1 8 3105 1 1 3 GLY CA C -10.847 7.730 6.793 1.00 . A A . 3 GLY CA 1 1 8 3106 1 1 3 GLY H H -11.335 9.795 6.866 1.00 . A A . 3 GLY H 1 1 8 3107 1 1 3 GLY HA2 H -9.860 8.064 7.111 1.00 . A A . 3 GLY HA2 1 1 8 3108 1 1 3 GLY HA3 H -11.223 7.005 7.517 1.00 . A A . 3 GLY HA3 1 1 8 3109 1 1 3 GLY N N -11.741 8.877 6.742 1.00 . A A . 3 GLY N 1 1 8 3110 1 1 3 GLY O O -10.759 5.851 5.309 1.00 . A A . 3 GLY O 1 1 8 3111 1 1 4 THR C C -9.193 7.443 2.462 1.00 . A A . 4 THR C 1 1 8 3112 1 1 4 THR CA C -10.628 7.472 2.974 1.00 . A A . 4 THR CA 1 1 8 3113 1 1 4 THR CB C -11.583 8.355 2.144 1.00 . A A . 4 THR CB 1 1 8 3114 1 1 4 THR CG2 C -13.036 8.173 2.594 1.00 . A A . 4 THR CG2 1 1 8 3115 1 1 4 THR H H -10.555 8.895 4.539 1.00 . A A . 4 THR H 1 1 8 3116 1 1 4 THR HA H -10.996 6.457 2.882 1.00 . A A . 4 THR HA 1 1 8 3117 1 1 4 THR HB H -11.522 8.059 1.097 1.00 . A A . 4 THR HB 1 1 8 3118 1 1 4 THR HG1 H -11.140 9.970 3.156 1.00 . A A . 4 THR HG1 1 1 8 3119 1 1 4 THR HG21 H -13.691 8.766 1.955 1.00 . A A . 4 THR HG21 1 1 8 3120 1 1 4 THR HG22 H -13.321 7.123 2.516 1.00 . A A . 4 THR HG22 1 1 8 3121 1 1 4 THR HG23 H -13.160 8.500 3.624 1.00 . A A . 4 THR HG23 1 1 8 3122 1 1 4 THR N N -10.626 7.901 4.365 1.00 . A A . 4 THR N 1 1 8 3123 1 1 4 THR O O -8.481 6.462 2.667 1.00 . A A . 4 THR O 1 1 8 3124 1 1 4 THR OG1 O -11.250 9.726 2.232 1.00 . A A . 4 THR OG1 1 1 8 3125 1 1 5 THR C C -6.406 8.567 2.445 1.00 . A A . 5 THR C 1 1 8 3126 1 1 5 THR CA C -7.422 8.730 1.313 1.00 . A A . 5 THR CA 1 1 8 3127 1 1 5 THR CB C -7.316 10.117 0.662 1.00 . A A . 5 THR CB 1 1 8 3128 1 1 5 THR CG2 C -8.207 10.221 -0.580 1.00 . A A . 5 THR CG2 1 1 8 3129 1 1 5 THR H H -9.448 9.268 1.704 1.00 . A A . 5 THR H 1 1 8 3130 1 1 5 THR HA H -7.225 7.967 0.561 1.00 . A A . 5 THR HA 1 1 8 3131 1 1 5 THR HB H -6.282 10.289 0.362 1.00 . A A . 5 THR HB 1 1 8 3132 1 1 5 THR HG1 H -7.598 11.975 1.167 1.00 . A A . 5 THR HG1 1 1 8 3133 1 1 5 THR HG21 H -8.070 11.198 -1.044 1.00 . A A . 5 THR HG21 1 1 8 3134 1 1 5 THR HG22 H -7.933 9.450 -1.299 1.00 . A A . 5 THR HG22 1 1 8 3135 1 1 5 THR HG23 H -9.258 10.104 -0.312 1.00 . A A . 5 THR HG23 1 1 8 3136 1 1 5 THR N N -8.773 8.526 1.813 1.00 . A A . 5 THR N 1 1 8 3137 1 1 5 THR O O -5.365 7.941 2.257 1.00 . A A . 5 THR O 1 1 8 3138 1 1 5 THR OG1 O -7.694 11.117 1.588 1.00 . A A . 5 THR OG1 1 1 8 3139 1 1 6 SER C C -5.587 7.486 5.115 1.00 . A A . 6 SER C 1 1 8 3140 1 1 6 SER CA C -5.973 8.947 4.859 1.00 . A A . 6 SER CA 1 1 8 3141 1 1 6 SER CB C -6.801 9.491 6.027 1.00 . A A . 6 SER CB 1 1 8 3142 1 1 6 SER H H -7.585 9.645 3.680 1.00 . A A . 6 SER H 1 1 8 3143 1 1 6 SER HA H -5.060 9.539 4.778 1.00 . A A . 6 SER HA 1 1 8 3144 1 1 6 SER HB2 H -7.691 8.876 6.167 1.00 . A A . 6 SER HB2 1 1 8 3145 1 1 6 SER HB3 H -6.206 9.467 6.941 1.00 . A A . 6 SER HB3 1 1 8 3146 1 1 6 SER HG H -6.410 11.361 5.666 1.00 . A A . 6 SER HG 1 1 8 3147 1 1 6 SER N N -6.732 9.107 3.626 1.00 . A A . 6 SER N 1 1 8 3148 1 1 6 SER O O -4.514 7.228 5.656 1.00 . A A . 6 SER O 1 1 8 3149 1 1 6 SER OG O -7.198 10.819 5.759 1.00 . A A . 6 SER OG 1 1 8 3150 1 1 7 GLU C C -5.512 4.632 3.505 1.00 . A A . 7 GLU C 1 1 8 3151 1 1 7 GLU CA C -6.184 5.118 4.795 1.00 . A A . 7 GLU CA 1 1 8 3152 1 1 7 GLU CB C -7.486 4.364 5.111 1.00 . A A . 7 GLU CB 1 1 8 3153 1 1 7 GLU CD C -8.529 2.141 5.675 1.00 . A A . 7 GLU CD 1 1 8 3154 1 1 7 GLU CG C -7.242 2.862 5.288 1.00 . A A . 7 GLU CG 1 1 8 3155 1 1 7 GLU H H -7.316 6.820 4.275 1.00 . A A . 7 GLU H 1 1 8 3156 1 1 7 GLU HA H -5.505 4.927 5.627 1.00 . A A . 7 GLU HA 1 1 8 3157 1 1 7 GLU HB2 H -7.899 4.761 6.040 1.00 . A A . 7 GLU HB2 1 1 8 3158 1 1 7 GLU HB3 H -8.221 4.512 4.321 1.00 . A A . 7 GLU HB3 1 1 8 3159 1 1 7 GLU HG2 H -6.871 2.437 4.355 1.00 . A A . 7 GLU HG2 1 1 8 3160 1 1 7 GLU HG3 H -6.494 2.704 6.066 1.00 . A A . 7 GLU HG3 1 1 8 3161 1 1 7 GLU N N -6.452 6.542 4.720 1.00 . A A . 7 GLU N 1 1 8 3162 1 1 7 GLU O O -4.333 4.286 3.530 1.00 . A A . 7 GLU O 1 1 8 3163 1 1 7 GLU OE1 O -8.817 2.101 6.891 1.00 . A A . 7 GLU OE1 1 1 8 3164 1 1 7 GLU OE2 O -9.204 1.643 4.748 1.00 . A A . 7 GLU OE2 1 1 8 3165 1 1 8 TYR C C -4.659 4.596 0.465 1.00 . A A . 8 TYR C 1 1 8 3166 1 1 8 TYR CA C -5.800 3.881 1.185 1.00 . A A . 8 TYR CA 1 1 8 3167 1 1 8 TYR CB C -6.957 3.519 0.243 1.00 . A A . 8 TYR CB 1 1 8 3168 1 1 8 TYR CD1 C -7.219 5.293 -1.555 1.00 . A A . 8 TYR CD1 1 1 8 3169 1 1 8 TYR CD2 C -8.988 5.016 0.090 1.00 . A A . 8 TYR CD2 1 1 8 3170 1 1 8 TYR CE1 C -7.967 6.299 -2.190 1.00 . A A . 8 TYR CE1 1 1 8 3171 1 1 8 TYR CE2 C -9.747 6.004 -0.558 1.00 . A A . 8 TYR CE2 1 1 8 3172 1 1 8 TYR CG C -7.712 4.673 -0.390 1.00 . A A . 8 TYR CG 1 1 8 3173 1 1 8 TYR CZ C -9.230 6.660 -1.688 1.00 . A A . 8 TYR CZ 1 1 8 3174 1 1 8 TYR H H -7.220 4.880 2.426 1.00 . A A . 8 TYR H 1 1 8 3175 1 1 8 TYR HA H -5.394 2.924 1.500 1.00 . A A . 8 TYR HA 1 1 8 3176 1 1 8 TYR HB2 H -6.551 2.902 -0.561 1.00 . A A . 8 TYR HB2 1 1 8 3177 1 1 8 TYR HB3 H -7.659 2.895 0.798 1.00 . A A . 8 TYR HB3 1 1 8 3178 1 1 8 TYR HD1 H -6.263 5.002 -1.967 1.00 . A A . 8 TYR HD1 1 1 8 3179 1 1 8 TYR HD2 H -9.391 4.516 0.958 1.00 . A A . 8 TYR HD2 1 1 8 3180 1 1 8 TYR HE1 H -7.573 6.787 -3.069 1.00 . A A . 8 TYR HE1 1 1 8 3181 1 1 8 TYR HE2 H -10.732 6.251 -0.193 1.00 . A A . 8 TYR HE2 1 1 8 3182 1 1 8 TYR HH H -9.526 8.009 -3.069 1.00 . A A . 8 TYR HH 1 1 8 3183 1 1 8 TYR N N -6.270 4.535 2.402 1.00 . A A . 8 TYR N 1 1 8 3184 1 1 8 TYR O O -3.688 3.940 0.092 1.00 . A A . 8 TYR O 1 1 8 3185 1 1 8 TYR OH O -9.958 7.640 -2.296 1.00 . A A . 8 TYR OH 1 1 8 3186 1 1 9 SER C C -2.387 6.551 -0.036 1.00 . A A . 9 SER C 1 1 8 3187 1 1 9 SER CA C -3.813 6.646 -0.579 1.00 . A A . 9 SER CA 1 1 8 3188 1 1 9 SER CB C -4.231 8.107 -0.762 1.00 . A A . 9 SER CB 1 1 8 3189 1 1 9 SER H H -5.573 6.414 0.595 1.00 . A A . 9 SER H 1 1 8 3190 1 1 9 SER HA H -3.829 6.207 -1.573 1.00 . A A . 9 SER HA 1 1 8 3191 1 1 9 SER HB2 H -4.212 8.636 0.186 1.00 . A A . 9 SER HB2 1 1 8 3192 1 1 9 SER HB3 H -3.531 8.596 -1.442 1.00 . A A . 9 SER HB3 1 1 8 3193 1 1 9 SER HG H -5.526 7.688 -2.150 1.00 . A A . 9 SER HG 1 1 8 3194 1 1 9 SER N N -4.774 5.911 0.235 1.00 . A A . 9 SER N 1 1 8 3195 1 1 9 SER O O -1.440 6.618 -0.813 1.00 . A A . 9 SER O 1 1 8 3196 1 1 9 SER OG O -5.523 8.177 -1.323 1.00 . A A . 9 SER OG 1 1 8 3197 1 1 10 LYS C C -0.107 5.184 1.523 1.00 . A A . 10 LYS C 1 1 8 3198 1 1 10 LYS CA C -0.925 6.404 1.929 1.00 . A A . 10 LYS CA 1 1 8 3199 1 1 10 LYS CB C -1.105 6.481 3.447 1.00 . A A . 10 LYS CB 1 1 8 3200 1 1 10 LYS CD C -1.272 9.050 3.449 1.00 . A A . 10 LYS CD 1 1 8 3201 1 1 10 LYS CE C -1.859 9.643 2.156 1.00 . A A . 10 LYS CE 1 1 8 3202 1 1 10 LYS CG C -1.903 7.717 3.888 1.00 . A A . 10 LYS CG 1 1 8 3203 1 1 10 LYS H H -3.042 6.309 1.871 1.00 . A A . 10 LYS H 1 1 8 3204 1 1 10 LYS HA H -0.365 7.279 1.603 1.00 . A A . 10 LYS HA 1 1 8 3205 1 1 10 LYS HB2 H -1.625 5.587 3.795 1.00 . A A . 10 LYS HB2 1 1 8 3206 1 1 10 LYS HB3 H -0.121 6.508 3.916 1.00 . A A . 10 LYS HB3 1 1 8 3207 1 1 10 LYS HD2 H -1.432 9.778 4.245 1.00 . A A . 10 LYS HD2 1 1 8 3208 1 1 10 LYS HD3 H -0.196 8.916 3.333 1.00 . A A . 10 LYS HD3 1 1 8 3209 1 1 10 LYS HE2 H -1.257 10.501 1.859 1.00 . A A . 10 LYS HE2 1 1 8 3210 1 1 10 LYS HE3 H -1.834 8.933 1.333 1.00 . A A . 10 LYS HE3 1 1 8 3211 1 1 10 LYS HG2 H -2.931 7.647 3.537 1.00 . A A . 10 LYS HG2 1 1 8 3212 1 1 10 LYS HG3 H -1.921 7.697 4.979 1.00 . A A . 10 LYS HG3 1 1 8 3213 1 1 10 LYS HZ1 H -3.575 10.530 1.491 1.00 . A A . 10 LYS HZ1 1 1 8 3214 1 1 10 LYS HZ2 H -3.837 9.311 2.567 1.00 . A A . 10 LYS HZ2 1 1 8 3215 1 1 10 LYS HZ3 H -3.282 10.773 3.095 1.00 . A A . 10 LYS HZ3 1 1 8 3216 1 1 10 LYS N N -2.227 6.398 1.283 1.00 . A A . 10 LYS N 1 1 8 3217 1 1 10 LYS NZ N -3.246 10.100 2.344 1.00 . A A . 10 LYS NZ 1 1 8 3218 1 1 10 LYS O O 1.017 5.332 1.049 1.00 . A A . 10 LYS O 1 1 8 3219 1 1 11 TYR C C -0.100 2.457 -0.185 1.00 . A A . 11 TYR C 1 1 8 3220 1 1 11 TYR CA C -0.001 2.744 1.314 1.00 . A A . 11 TYR CA 1 1 8 3221 1 1 11 TYR CB C -0.487 1.604 2.209 1.00 . A A . 11 TYR CB 1 1 8 3222 1 1 11 TYR CD1 C -2.649 0.776 1.164 1.00 . A A . 11 TYR CD1 1 1 8 3223 1 1 11 TYR CD2 C -2.683 1.572 3.462 1.00 . A A . 11 TYR CD2 1 1 8 3224 1 1 11 TYR CE1 C -4.005 0.422 1.268 1.00 . A A . 11 TYR CE1 1 1 8 3225 1 1 11 TYR CE2 C -4.031 1.194 3.575 1.00 . A A . 11 TYR CE2 1 1 8 3226 1 1 11 TYR CG C -1.984 1.360 2.259 1.00 . A A . 11 TYR CG 1 1 8 3227 1 1 11 TYR CZ C -4.694 0.620 2.477 1.00 . A A . 11 TYR CZ 1 1 8 3228 1 1 11 TYR H H -1.638 3.926 1.962 1.00 . A A . 11 TYR H 1 1 8 3229 1 1 11 TYR HA H 1.062 2.848 1.511 1.00 . A A . 11 TYR HA 1 1 8 3230 1 1 11 TYR HB2 H 0.004 0.686 1.893 1.00 . A A . 11 TYR HB2 1 1 8 3231 1 1 11 TYR HB3 H -0.138 1.840 3.215 1.00 . A A . 11 TYR HB3 1 1 8 3232 1 1 11 TYR HD1 H -2.122 0.581 0.242 1.00 . A A . 11 TYR HD1 1 1 8 3233 1 1 11 TYR HD2 H -2.186 2.017 4.312 1.00 . A A . 11 TYR HD2 1 1 8 3234 1 1 11 TYR HE1 H -4.516 -0.003 0.417 1.00 . A A . 11 TYR HE1 1 1 8 3235 1 1 11 TYR HE2 H -4.553 1.360 4.506 1.00 . A A . 11 TYR HE2 1 1 8 3236 1 1 11 TYR HH H -6.386 0.442 3.440 1.00 . A A . 11 TYR HH 1 1 8 3237 1 1 11 TYR N N -0.671 3.983 1.681 1.00 . A A . 11 TYR N 1 1 8 3238 1 1 11 TYR O O 0.336 1.402 -0.641 1.00 . A A . 11 TYR O 1 1 8 3239 1 1 11 TYR OH O -6.008 0.263 2.577 1.00 . A A . 11 TYR OH 1 1 8 3240 1 1 12 LEU C C 0.355 4.474 -2.918 1.00 . A A . 12 LEU C 1 1 8 3241 1 1 12 LEU CA C -0.675 3.459 -2.387 1.00 . A A . 12 LEU CA 1 1 8 3242 1 1 12 LEU CB C -2.126 3.792 -2.769 1.00 . A A . 12 LEU CB 1 1 8 3243 1 1 12 LEU CD1 C -2.024 3.089 -5.205 1.00 . A A . 12 LEU CD1 1 1 8 3244 1 1 12 LEU CD2 C -3.862 4.567 -4.403 1.00 . A A . 12 LEU CD2 1 1 8 3245 1 1 12 LEU CG C -2.381 4.212 -4.222 1.00 . A A . 12 LEU CG 1 1 8 3246 1 1 12 LEU H H -1.007 4.240 -0.487 1.00 . A A . 12 LEU H 1 1 8 3247 1 1 12 LEU HA H -0.428 2.473 -2.771 1.00 . A A . 12 LEU HA 1 1 8 3248 1 1 12 LEU HB2 H -2.747 2.930 -2.519 1.00 . A A . 12 LEU HB2 1 1 8 3249 1 1 12 LEU HB3 H -2.439 4.620 -2.143 1.00 . A A . 12 LEU HB3 1 1 8 3250 1 1 12 LEU HD11 H -2.214 3.422 -6.226 1.00 . A A . 12 LEU HD11 1 1 8 3251 1 1 12 LEU HD12 H -0.975 2.811 -5.121 1.00 . A A . 12 LEU HD12 1 1 8 3252 1 1 12 LEU HD13 H -2.637 2.210 -4.999 1.00 . A A . 12 LEU HD13 1 1 8 3253 1 1 12 LEU HD21 H -4.489 3.710 -4.153 1.00 . A A . 12 LEU HD21 1 1 8 3254 1 1 12 LEU HD22 H -4.128 5.404 -3.758 1.00 . A A . 12 LEU HD22 1 1 8 3255 1 1 12 LEU HD23 H -4.048 4.854 -5.438 1.00 . A A . 12 LEU HD23 1 1 8 3256 1 1 12 LEU HG H -1.804 5.117 -4.428 1.00 . A A . 12 LEU HG 1 1 8 3257 1 1 12 LEU N N -0.628 3.424 -0.941 1.00 . A A . 12 LEU N 1 1 8 3258 1 1 12 LEU O O 0.674 4.451 -4.105 1.00 . A A . 12 LEU O 1 1 8 3259 1 1 13 ASP C C 3.217 5.922 -2.652 1.00 . A A . 13 ASP C 1 1 8 3260 1 1 13 ASP CA C 1.787 6.438 -2.435 1.00 . A A . 13 ASP CA 1 1 8 3261 1 1 13 ASP CB C 1.653 7.580 -1.412 1.00 . A A . 13 ASP CB 1 1 8 3262 1 1 13 ASP CG C 2.425 8.837 -1.812 1.00 . A A . 13 ASP CG 1 1 8 3263 1 1 13 ASP H H 0.601 5.333 -1.086 1.00 . A A . 13 ASP H 1 1 8 3264 1 1 13 ASP HA H 1.459 6.842 -3.391 1.00 . A A . 13 ASP HA 1 1 8 3265 1 1 13 ASP HB2 H 0.604 7.863 -1.341 1.00 . A A . 13 ASP HB2 1 1 8 3266 1 1 13 ASP HB3 H 1.972 7.235 -0.429 1.00 . A A . 13 ASP HB3 1 1 8 3267 1 1 13 ASP N N 0.882 5.360 -2.056 1.00 . A A . 13 ASP N 1 1 8 3268 1 1 13 ASP O O 3.442 5.122 -3.557 1.00 . A A . 13 ASP O 1 1 8 3269 1 1 13 ASP OD1 O 2.093 9.398 -2.879 1.00 . A A . 13 ASP OD1 1 1 8 3270 1 1 13 ASP OD2 O 3.335 9.214 -1.042 1.00 . A A . 13 ASP OD2 1 1 8 3271 1 1 14 SER C C 6.130 5.064 -1.124 1.00 . A A . 14 SER C 1 1 8 3272 1 1 14 SER CA C 5.609 6.147 -2.074 1.00 . A A . 14 SER CA 1 1 8 3273 1 1 14 SER CB C 6.380 7.474 -1.996 1.00 . A A . 14 SER CB 1 1 8 3274 1 1 14 SER H H 3.945 7.074 -1.154 1.00 . A A . 14 SER H 1 1 8 3275 1 1 14 SER HA H 5.771 5.773 -3.087 1.00 . A A . 14 SER HA 1 1 8 3276 1 1 14 SER HB2 H 7.443 7.297 -2.162 1.00 . A A . 14 SER HB2 1 1 8 3277 1 1 14 SER HB3 H 6.014 8.142 -2.777 1.00 . A A . 14 SER HB3 1 1 8 3278 1 1 14 SER HG H 6.613 8.965 -0.765 1.00 . A A . 14 SER HG 1 1 8 3279 1 1 14 SER N N 4.191 6.409 -1.871 1.00 . A A . 14 SER N 1 1 8 3280 1 1 14 SER O O 5.835 3.891 -1.336 1.00 . A A . 14 SER O 1 1 8 3281 1 1 14 SER OG O 6.192 8.102 -0.743 1.00 . A A . 14 SER OG 1 1 8 3282 1 1 15 ARG C C 6.861 3.385 1.254 1.00 . A A . 15 ARG C 1 1 8 3283 1 1 15 ARG CA C 7.679 4.593 0.794 1.00 . A A . 15 ARG CA 1 1 8 3284 1 1 15 ARG CB C 8.176 5.449 1.973 1.00 . A A . 15 ARG CB 1 1 8 3285 1 1 15 ARG CD C 9.029 3.586 3.580 1.00 . A A . 15 ARG CD 1 1 8 3286 1 1 15 ARG CG C 9.346 4.850 2.772 1.00 . A A . 15 ARG CG 1 1 8 3287 1 1 15 ARG CZ C 7.283 2.786 5.170 1.00 . A A . 15 ARG CZ 1 1 8 3288 1 1 15 ARG H H 7.068 6.450 -0.016 1.00 . A A . 15 ARG H 1 1 8 3289 1 1 15 ARG HA H 8.554 4.230 0.252 1.00 . A A . 15 ARG HA 1 1 8 3290 1 1 15 ARG HB2 H 8.548 6.389 1.564 1.00 . A A . 15 ARG HB2 1 1 8 3291 1 1 15 ARG HB3 H 7.346 5.689 2.637 1.00 . A A . 15 ARG HB3 1 1 8 3292 1 1 15 ARG HD2 H 8.886 2.742 2.908 1.00 . A A . 15 ARG HD2 1 1 8 3293 1 1 15 ARG HD3 H 9.891 3.361 4.209 1.00 . A A . 15 ARG HD3 1 1 8 3294 1 1 15 ARG HE H 7.473 4.695 4.513 1.00 . A A . 15 ARG HE 1 1 8 3295 1 1 15 ARG HG2 H 10.169 4.632 2.090 1.00 . A A . 15 ARG HG2 1 1 8 3296 1 1 15 ARG HG3 H 9.686 5.612 3.475 1.00 . A A . 15 ARG HG3 1 1 8 3297 1 1 15 ARG HH11 H 8.546 1.302 4.551 1.00 . A A . 15 ARG HH11 1 1 8 3298 1 1 15 ARG HH12 H 7.304 0.807 5.676 1.00 . A A . 15 ARG HH12 1 1 8 3299 1 1 15 ARG HH21 H 5.875 4.015 5.994 1.00 . A A . 15 ARG HH21 1 1 8 3300 1 1 15 ARG HH22 H 5.798 2.342 6.498 1.00 . A A . 15 ARG HH22 1 1 8 3301 1 1 15 ARG N N 6.934 5.453 -0.123 1.00 . A A . 15 ARG N 1 1 8 3302 1 1 15 ARG NE N 7.855 3.763 4.445 1.00 . A A . 15 ARG NE 1 1 8 3303 1 1 15 ARG NH1 N 7.750 1.530 5.128 1.00 . A A . 15 ARG NH1 1 1 8 3304 1 1 15 ARG NH2 N 6.232 3.071 5.950 1.00 . A A . 15 ARG NH2 1 1 8 3305 1 1 15 ARG O O 7.293 2.246 1.089 1.00 . A A . 15 ARG O 1 1 8 3306 1 1 16 ARG C C 4.481 1.584 1.228 1.00 . A A . 16 ARG C 1 1 8 3307 1 1 16 ARG CA C 4.768 2.615 2.311 1.00 . A A . 16 ARG CA 1 1 8 3308 1 1 16 ARG CB C 3.467 3.283 2.751 1.00 . A A . 16 ARG CB 1 1 8 3309 1 1 16 ARG CD C 2.777 5.368 4.008 1.00 . A A . 16 ARG CD 1 1 8 3310 1 1 16 ARG CG C 3.703 4.148 3.988 1.00 . A A . 16 ARG CG 1 1 8 3311 1 1 16 ARG CZ C 4.126 7.014 2.683 1.00 . A A . 16 ARG CZ 1 1 8 3312 1 1 16 ARG H H 5.375 4.602 1.883 1.00 . A A . 16 ARG H 1 1 8 3313 1 1 16 ARG HA H 5.221 2.111 3.166 1.00 . A A . 16 ARG HA 1 1 8 3314 1 1 16 ARG HB2 H 3.097 3.884 1.921 1.00 . A A . 16 ARG HB2 1 1 8 3315 1 1 16 ARG HB3 H 2.728 2.522 2.997 1.00 . A A . 16 ARG HB3 1 1 8 3316 1 1 16 ARG HD2 H 1.745 5.020 3.960 1.00 . A A . 16 ARG HD2 1 1 8 3317 1 1 16 ARG HD3 H 2.910 5.919 4.939 1.00 . A A . 16 ARG HD3 1 1 8 3318 1 1 16 ARG HE H 2.341 6.238 2.123 1.00 . A A . 16 ARG HE 1 1 8 3319 1 1 16 ARG HG2 H 3.525 3.521 4.861 1.00 . A A . 16 ARG HG2 1 1 8 3320 1 1 16 ARG HG3 H 4.737 4.484 4.006 1.00 . A A . 16 ARG HG3 1 1 8 3321 1 1 16 ARG HH11 H 4.974 6.607 4.499 1.00 . A A . 16 ARG HH11 1 1 8 3322 1 1 16 ARG HH12 H 5.892 7.677 3.468 1.00 . A A . 16 ARG HH12 1 1 8 3323 1 1 16 ARG HH21 H 3.566 7.638 0.820 1.00 . A A . 16 ARG HH21 1 1 8 3324 1 1 16 ARG HH22 H 5.105 8.245 1.379 1.00 . A A . 16 ARG HH22 1 1 8 3325 1 1 16 ARG N N 5.676 3.640 1.814 1.00 . A A . 16 ARG N 1 1 8 3326 1 1 16 ARG NE N 3.031 6.256 2.863 1.00 . A A . 16 ARG NE 1 1 8 3327 1 1 16 ARG NH1 N 5.075 7.106 3.627 1.00 . A A . 16 ARG NH1 1 1 8 3328 1 1 16 ARG NH2 N 4.276 7.689 1.536 1.00 . A A . 16 ARG NH2 1 1 8 3329 1 1 16 ARG O O 4.708 0.394 1.428 1.00 . A A . 16 ARG O 1 1 8 3330 1 1 17 ALA C C 4.936 0.415 -1.508 1.00 . A A . 17 ALA C 1 1 8 3331 1 1 17 ALA CA C 3.707 1.211 -1.068 1.00 . A A . 17 ALA CA 1 1 8 3332 1 1 17 ALA CB C 3.175 2.064 -2.218 1.00 . A A . 17 ALA CB 1 1 8 3333 1 1 17 ALA H H 3.865 3.050 -0.032 1.00 . A A . 17 ALA H 1 1 8 3334 1 1 17 ALA HA H 2.924 0.507 -0.781 1.00 . A A . 17 ALA HA 1 1 8 3335 1 1 17 ALA HB1 H 3.964 2.708 -2.599 1.00 . A A . 17 ALA HB1 1 1 8 3336 1 1 17 ALA HB2 H 2.827 1.414 -3.020 1.00 . A A . 17 ALA HB2 1 1 8 3337 1 1 17 ALA HB3 H 2.351 2.681 -1.866 1.00 . A A . 17 ALA HB3 1 1 8 3338 1 1 17 ALA N N 3.996 2.054 0.075 1.00 . A A . 17 ALA N 1 1 8 3339 1 1 17 ALA O O 4.779 -0.710 -1.972 1.00 . A A . 17 ALA O 1 1 8 3340 1 1 18 GLN C C 7.635 -0.890 -0.783 1.00 . A A . 18 GLN C 1 1 8 3341 1 1 18 GLN CA C 7.357 0.254 -1.753 1.00 . A A . 18 GLN CA 1 1 8 3342 1 1 18 GLN CB C 8.596 1.161 -1.851 1.00 . A A . 18 GLN CB 1 1 8 3343 1 1 18 GLN CD C 7.623 2.168 -3.991 1.00 . A A . 18 GLN CD 1 1 8 3344 1 1 18 GLN CG C 8.461 2.404 -2.738 1.00 . A A . 18 GLN CG 1 1 8 3345 1 1 18 GLN H H 6.227 1.872 -0.894 1.00 . A A . 18 GLN H 1 1 8 3346 1 1 18 GLN HA H 7.177 -0.194 -2.729 1.00 . A A . 18 GLN HA 1 1 8 3347 1 1 18 GLN HB2 H 8.900 1.484 -0.855 1.00 . A A . 18 GLN HB2 1 1 8 3348 1 1 18 GLN HB3 H 9.403 0.551 -2.262 1.00 . A A . 18 GLN HB3 1 1 8 3349 1 1 18 GLN HE21 H 6.031 3.115 -3.153 1.00 . A A . 18 GLN HE21 1 1 8 3350 1 1 18 GLN HE22 H 5.772 2.501 -4.776 1.00 . A A . 18 GLN HE22 1 1 8 3351 1 1 18 GLN HG2 H 8.033 3.213 -2.153 1.00 . A A . 18 GLN HG2 1 1 8 3352 1 1 18 GLN HG3 H 9.461 2.721 -3.039 1.00 . A A . 18 GLN HG3 1 1 8 3353 1 1 18 GLN N N 6.148 0.971 -1.357 1.00 . A A . 18 GLN N 1 1 8 3354 1 1 18 GLN NE2 N 6.374 2.639 -3.978 1.00 . A A . 18 GLN NE2 1 1 8 3355 1 1 18 GLN O O 8.019 -1.980 -1.200 1.00 . A A . 18 GLN O 1 1 8 3356 1 1 18 GLN OE1 O 8.096 1.573 -4.956 1.00 . A A . 18 GLN OE1 1 1 8 3357 1 1 19 ASP C C 6.655 -2.798 1.291 1.00 . A A . 19 ASP C 1 1 8 3358 1 1 19 ASP CA C 7.631 -1.652 1.539 1.00 . A A . 19 ASP CA 1 1 8 3359 1 1 19 ASP CB C 7.453 -1.028 2.927 1.00 . A A . 19 ASP CB 1 1 8 3360 1 1 19 ASP CG C 7.615 -2.062 4.037 1.00 . A A . 19 ASP CG 1 1 8 3361 1 1 19 ASP H H 7.044 0.253 0.778 1.00 . A A . 19 ASP H 1 1 8 3362 1 1 19 ASP HA H 8.651 -2.034 1.465 1.00 . A A . 19 ASP HA 1 1 8 3363 1 1 19 ASP HB2 H 8.204 -0.248 3.053 1.00 . A A . 19 ASP HB2 1 1 8 3364 1 1 19 ASP HB3 H 6.467 -0.572 3.014 1.00 . A A . 19 ASP HB3 1 1 8 3365 1 1 19 ASP N N 7.432 -0.643 0.514 1.00 . A A . 19 ASP N 1 1 8 3366 1 1 19 ASP O O 7.063 -3.954 1.194 1.00 . A A . 19 ASP O 1 1 8 3367 1 1 19 ASP OD1 O 8.778 -2.293 4.435 1.00 . A A . 19 ASP OD1 1 1 8 3368 1 1 19 ASP OD2 O 6.574 -2.606 4.467 1.00 . A A . 19 ASP OD2 1 1 8 3369 1 1 20 PHE C C 4.424 -4.175 -0.357 1.00 . A A . 20 PHE C 1 1 8 3370 1 1 20 PHE CA C 4.308 -3.432 0.974 1.00 . A A . 20 PHE CA 1 1 8 3371 1 1 20 PHE CB C 2.934 -2.772 1.129 1.00 . A A . 20 PHE CB 1 1 8 3372 1 1 20 PHE CD1 C 2.742 -3.058 3.643 1.00 . A A . 20 PHE CD1 1 1 8 3373 1 1 20 PHE CD2 C 2.295 -0.868 2.682 1.00 . A A . 20 PHE CD2 1 1 8 3374 1 1 20 PHE CE1 C 2.522 -2.539 4.931 1.00 . A A . 20 PHE CE1 1 1 8 3375 1 1 20 PHE CE2 C 2.077 -0.349 3.971 1.00 . A A . 20 PHE CE2 1 1 8 3376 1 1 20 PHE CG C 2.659 -2.218 2.516 1.00 . A A . 20 PHE CG 1 1 8 3377 1 1 20 PHE CZ C 2.196 -1.183 5.095 1.00 . A A . 20 PHE CZ 1 1 8 3378 1 1 20 PHE H H 5.106 -1.488 1.255 1.00 . A A . 20 PHE H 1 1 8 3379 1 1 20 PHE HA H 4.405 -4.181 1.759 1.00 . A A . 20 PHE HA 1 1 8 3380 1 1 20 PHE HB2 H 2.843 -1.980 0.384 1.00 . A A . 20 PHE HB2 1 1 8 3381 1 1 20 PHE HB3 H 2.167 -3.519 0.917 1.00 . A A . 20 PHE HB3 1 1 8 3382 1 1 20 PHE HD1 H 2.973 -4.107 3.529 1.00 . A A . 20 PHE HD1 1 1 8 3383 1 1 20 PHE HD2 H 2.188 -0.226 1.821 1.00 . A A . 20 PHE HD2 1 1 8 3384 1 1 20 PHE HE1 H 2.603 -3.184 5.794 1.00 . A A . 20 PHE HE1 1 1 8 3385 1 1 20 PHE HE2 H 1.815 0.689 4.101 1.00 . A A . 20 PHE HE2 1 1 8 3386 1 1 20 PHE HZ H 2.031 -0.782 6.085 1.00 . A A . 20 PHE HZ 1 1 8 3387 1 1 20 PHE N N 5.366 -2.462 1.170 1.00 . A A . 20 PHE N 1 1 8 3388 1 1 20 PHE O O 4.118 -5.362 -0.385 1.00 . A A . 20 PHE O 1 1 8 3389 1 1 21 VAL C C 5.912 -5.305 -2.803 1.00 . A A . 21 VAL C 1 1 8 3390 1 1 21 VAL CA C 4.818 -4.240 -2.742 1.00 . A A . 21 VAL CA 1 1 8 3391 1 1 21 VAL CB C 4.811 -3.273 -3.940 1.00 . A A . 21 VAL CB 1 1 8 3392 1 1 21 VAL CG1 C 6.179 -2.641 -4.213 1.00 . A A . 21 VAL CG1 1 1 8 3393 1 1 21 VAL CG2 C 4.332 -3.992 -5.205 1.00 . A A . 21 VAL CG2 1 1 8 3394 1 1 21 VAL H H 5.139 -2.561 -1.432 1.00 . A A . 21 VAL H 1 1 8 3395 1 1 21 VAL HA H 3.876 -4.786 -2.783 1.00 . A A . 21 VAL HA 1 1 8 3396 1 1 21 VAL HB H 4.094 -2.479 -3.731 1.00 . A A . 21 VAL HB 1 1 8 3397 1 1 21 VAL HG11 H 6.592 -2.258 -3.287 1.00 . A A . 21 VAL HG11 1 1 8 3398 1 1 21 VAL HG12 H 6.866 -3.376 -4.633 1.00 . A A . 21 VAL HG12 1 1 8 3399 1 1 21 VAL HG13 H 6.068 -1.818 -4.920 1.00 . A A . 21 VAL HG13 1 1 8 3400 1 1 21 VAL HG21 H 5.015 -4.803 -5.456 1.00 . A A . 21 VAL HG21 1 1 8 3401 1 1 21 VAL HG22 H 3.334 -4.400 -5.047 1.00 . A A . 21 VAL HG22 1 1 8 3402 1 1 21 VAL HG23 H 4.295 -3.286 -6.036 1.00 . A A . 21 VAL HG23 1 1 8 3403 1 1 21 VAL N N 4.838 -3.533 -1.461 1.00 . A A . 21 VAL N 1 1 8 3404 1 1 21 VAL O O 5.643 -6.439 -3.193 1.00 . A A . 21 VAL O 1 1 8 3405 1 1 22 GLN C C 7.963 -7.019 -1.335 1.00 . A A . 22 GLN C 1 1 8 3406 1 1 22 GLN CA C 8.241 -5.903 -2.339 1.00 . A A . 22 GLN CA 1 1 8 3407 1 1 22 GLN CB C 9.538 -5.171 -2.007 1.00 . A A . 22 GLN CB 1 1 8 3408 1 1 22 GLN CD C 11.272 -3.758 -3.174 1.00 . A A . 22 GLN CD 1 1 8 3409 1 1 22 GLN CG C 9.801 -4.137 -3.104 1.00 . A A . 22 GLN CG 1 1 8 3410 1 1 22 GLN H H 7.299 -4.015 -2.065 1.00 . A A . 22 GLN H 1 1 8 3411 1 1 22 GLN HA H 8.382 -6.353 -3.323 1.00 . A A . 22 GLN HA 1 1 8 3412 1 1 22 GLN HB2 H 9.474 -4.681 -1.034 1.00 . A A . 22 GLN HB2 1 1 8 3413 1 1 22 GLN HB3 H 10.345 -5.905 -1.984 1.00 . A A . 22 GLN HB3 1 1 8 3414 1 1 22 GLN HE21 H 11.713 -5.552 -4.028 1.00 . A A . 22 GLN HE21 1 1 8 3415 1 1 22 GLN HE22 H 13.072 -4.485 -3.771 1.00 . A A . 22 GLN HE22 1 1 8 3416 1 1 22 GLN HG2 H 9.506 -4.554 -4.066 1.00 . A A . 22 GLN HG2 1 1 8 3417 1 1 22 GLN HG3 H 9.194 -3.254 -2.917 1.00 . A A . 22 GLN HG3 1 1 8 3418 1 1 22 GLN N N 7.136 -4.958 -2.392 1.00 . A A . 22 GLN N 1 1 8 3419 1 1 22 GLN NE2 N 12.086 -4.672 -3.703 1.00 . A A . 22 GLN NE2 1 1 8 3420 1 1 22 GLN O O 8.382 -8.154 -1.545 1.00 . A A . 22 GLN O 1 1 8 3421 1 1 22 GLN OE1 O 11.665 -2.669 -2.764 1.00 . A A . 22 GLN OE1 1 1 8 3422 1 1 23 TRP C C 5.918 -8.675 0.222 1.00 . A A . 23 TRP C 1 1 8 3423 1 1 23 TRP CA C 6.910 -7.658 0.780 1.00 . A A . 23 TRP CA 1 1 8 3424 1 1 23 TRP CB C 6.321 -6.906 1.971 1.00 . A A . 23 TRP CB 1 1 8 3425 1 1 23 TRP CD1 C 6.066 -8.672 3.747 1.00 . A A . 23 TRP CD1 1 1 8 3426 1 1 23 TRP CD2 C 4.103 -7.905 3.004 1.00 . A A . 23 TRP CD2 1 1 8 3427 1 1 23 TRP CE2 C 3.813 -8.894 3.985 1.00 . A A . 23 TRP CE2 1 1 8 3428 1 1 23 TRP CE3 C 3.017 -7.329 2.319 1.00 . A A . 23 TRP CE3 1 1 8 3429 1 1 23 TRP CG C 5.543 -7.760 2.909 1.00 . A A . 23 TRP CG 1 1 8 3430 1 1 23 TRP CH2 C 1.434 -8.653 3.622 1.00 . A A . 23 TRP CH2 1 1 8 3431 1 1 23 TRP CZ2 C 2.499 -9.266 4.302 1.00 . A A . 23 TRP CZ2 1 1 8 3432 1 1 23 TRP CZ3 C 1.693 -7.693 2.626 1.00 . A A . 23 TRP CZ3 1 1 8 3433 1 1 23 TRP H H 6.836 -5.777 -0.189 1.00 . A A . 23 TRP H 1 1 8 3434 1 1 23 TRP HA H 7.810 -8.182 1.107 1.00 . A A . 23 TRP HA 1 1 8 3435 1 1 23 TRP HB2 H 7.122 -6.407 2.518 1.00 . A A . 23 TRP HB2 1 1 8 3436 1 1 23 TRP HB3 H 5.637 -6.144 1.607 1.00 . A A . 23 TRP HB3 1 1 8 3437 1 1 23 TRP HD1 H 7.124 -8.856 3.817 1.00 . A A . 23 TRP HD1 1 1 8 3438 1 1 23 TRP HE1 H 5.164 -10.038 5.124 1.00 . A A . 23 TRP HE1 1 1 8 3439 1 1 23 TRP HE3 H 3.235 -6.619 1.534 1.00 . A A . 23 TRP HE3 1 1 8 3440 1 1 23 TRP HH2 H 0.420 -8.932 3.861 1.00 . A A . 23 TRP HH2 1 1 8 3441 1 1 23 TRP HZ2 H 2.309 -10.018 5.053 1.00 . A A . 23 TRP HZ2 1 1 8 3442 1 1 23 TRP HZ3 H 0.873 -7.240 2.089 1.00 . A A . 23 TRP HZ3 1 1 8 3443 1 1 23 TRP N N 7.244 -6.701 -0.256 1.00 . A A . 23 TRP N 1 1 8 3444 1 1 23 TRP NE1 N 5.051 -9.318 4.426 1.00 . A A . 23 TRP NE1 1 1 8 3445 1 1 23 TRP O O 6.174 -9.876 0.247 1.00 . A A . 23 TRP O 1 1 8 3446 1 1 24 LEU C C 4.331 -9.863 -1.998 1.00 . A A . 24 LEU C 1 1 8 3447 1 1 24 LEU CA C 3.738 -8.930 -0.942 1.00 . A A . 24 LEU CA 1 1 8 3448 1 1 24 LEU CB C 2.754 -7.934 -1.571 1.00 . A A . 24 LEU CB 1 1 8 3449 1 1 24 LEU CD1 C 0.696 -9.412 -1.350 1.00 . A A . 24 LEU CD1 1 1 8 3450 1 1 24 LEU CD2 C 0.714 -7.475 -2.933 1.00 . A A . 24 LEU CD2 1 1 8 3451 1 1 24 LEU CG C 1.566 -8.581 -2.301 1.00 . A A . 24 LEU CG 1 1 8 3452 1 1 24 LEU H H 4.664 -7.169 -0.228 1.00 . A A . 24 LEU H 1 1 8 3453 1 1 24 LEU HA H 3.224 -9.516 -0.181 1.00 . A A . 24 LEU HA 1 1 8 3454 1 1 24 LEU HB2 H 2.369 -7.287 -0.783 1.00 . A A . 24 LEU HB2 1 1 8 3455 1 1 24 LEU HB3 H 3.304 -7.316 -2.282 1.00 . A A . 24 LEU HB3 1 1 8 3456 1 1 24 LEU HD11 H 1.247 -10.280 -0.989 1.00 . A A . 24 LEU HD11 1 1 8 3457 1 1 24 LEU HD12 H 0.384 -8.804 -0.500 1.00 . A A . 24 LEU HD12 1 1 8 3458 1 1 24 LEU HD13 H -0.189 -9.765 -1.879 1.00 . A A . 24 LEU HD13 1 1 8 3459 1 1 24 LEU HD21 H 1.320 -6.893 -3.629 1.00 . A A . 24 LEU HD21 1 1 8 3460 1 1 24 LEU HD22 H -0.120 -7.916 -3.480 1.00 . A A . 24 LEU HD22 1 1 8 3461 1 1 24 LEU HD23 H 0.324 -6.813 -2.160 1.00 . A A . 24 LEU HD23 1 1 8 3462 1 1 24 LEU HG H 1.929 -9.224 -3.103 1.00 . A A . 24 LEU HG 1 1 8 3463 1 1 24 LEU N N 4.789 -8.170 -0.285 1.00 . A A . 24 LEU N 1 1 8 3464 1 1 24 LEU O O 3.905 -11.008 -2.127 1.00 . A A . 24 LEU O 1 1 8 3465 1 1 25 MET C C 6.830 -11.279 -3.120 1.00 . A A . 25 MET C 1 1 8 3466 1 1 25 MET CA C 6.036 -10.132 -3.750 1.00 . A A . 25 MET CA 1 1 8 3467 1 1 25 MET CB C 6.963 -9.217 -4.553 1.00 . A A . 25 MET CB 1 1 8 3468 1 1 25 MET CE C 6.008 -6.672 -7.739 1.00 . A A . 25 MET CE 1 1 8 3469 1 1 25 MET CG C 6.195 -8.449 -5.632 1.00 . A A . 25 MET CG 1 1 8 3470 1 1 25 MET H H 5.614 -8.408 -2.549 1.00 . A A . 25 MET H 1 1 8 3471 1 1 25 MET HA H 5.303 -10.566 -4.432 1.00 . A A . 25 MET HA 1 1 8 3472 1 1 25 MET HB2 H 7.455 -8.522 -3.876 1.00 . A A . 25 MET HB2 1 1 8 3473 1 1 25 MET HB3 H 7.728 -9.823 -5.040 1.00 . A A . 25 MET HB3 1 1 8 3474 1 1 25 MET HE1 H 5.050 -6.387 -7.307 1.00 . A A . 25 MET HE1 1 1 8 3475 1 1 25 MET HE2 H 6.418 -5.831 -8.298 1.00 . A A . 25 MET HE2 1 1 8 3476 1 1 25 MET HE3 H 5.863 -7.517 -8.413 1.00 . A A . 25 MET HE3 1 1 8 3477 1 1 25 MET HG2 H 5.879 -9.157 -6.398 1.00 . A A . 25 MET HG2 1 1 8 3478 1 1 25 MET HG3 H 5.303 -7.998 -5.199 1.00 . A A . 25 MET HG3 1 1 8 3479 1 1 25 MET N N 5.327 -9.363 -2.737 1.00 . A A . 25 MET N 1 1 8 3480 1 1 25 MET O O 6.636 -12.431 -3.503 1.00 . A A . 25 MET O 1 1 8 3481 1 1 25 MET SD S 7.163 -7.139 -6.424 1.00 . A A . 25 MET SD 1 1 8 3482 1 1 26 ASN C C 7.758 -13.075 -0.886 1.00 . A A . 26 ASN C 1 1 8 3483 1 1 26 ASN CA C 8.584 -11.959 -1.528 1.00 . A A . 26 ASN CA 1 1 8 3484 1 1 26 ASN CB C 9.486 -11.305 -0.467 1.00 . A A . 26 ASN CB 1 1 8 3485 1 1 26 ASN CG C 10.456 -10.248 -1.002 1.00 . A A . 26 ASN CG 1 1 8 3486 1 1 26 ASN H H 7.833 -10.000 -1.898 1.00 . A A . 26 ASN H 1 1 8 3487 1 1 26 ASN HA H 9.210 -12.423 -2.291 1.00 . A A . 26 ASN HA 1 1 8 3488 1 1 26 ASN HB2 H 8.859 -10.846 0.299 1.00 . A A . 26 ASN HB2 1 1 8 3489 1 1 26 ASN HB3 H 10.082 -12.087 0.006 1.00 . A A . 26 ASN HB3 1 1 8 3490 1 1 26 ASN HD21 H 10.735 -11.231 -2.772 1.00 . A A . 26 ASN HD21 1 1 8 3491 1 1 26 ASN HD22 H 11.617 -9.733 -2.583 1.00 . A A . 26 ASN HD22 1 1 8 3492 1 1 26 ASN N N 7.726 -10.968 -2.172 1.00 . A A . 26 ASN N 1 1 8 3493 1 1 26 ASN ND2 N 10.977 -10.422 -2.219 1.00 . A A . 26 ASN ND2 1 1 8 3494 1 1 26 ASN O O 8.098 -14.249 -1.018 1.00 . A A . 26 ASN O 1 1 8 3495 1 1 26 ASN OD1 O 10.742 -9.275 -0.309 1.00 . A A . 26 ASN OD1 1 1 8 3496 1 1 27 THR C C 5.004 -14.472 -0.546 1.00 . A A . 27 THR C 1 1 8 3497 1 1 27 THR CA C 5.788 -13.644 0.475 1.00 . A A . 27 THR CA 1 1 8 3498 1 1 27 THR CB C 4.865 -12.889 1.442 1.00 . A A . 27 THR CB 1 1 8 3499 1 1 27 THR CG2 C 5.672 -12.252 2.576 1.00 . A A . 27 THR CG2 1 1 8 3500 1 1 27 THR H H 6.453 -11.722 -0.129 1.00 . A A . 27 THR H 1 1 8 3501 1 1 27 THR HA H 6.394 -14.333 1.066 1.00 . A A . 27 THR HA 1 1 8 3502 1 1 27 THR HB H 4.157 -13.597 1.876 1.00 . A A . 27 THR HB 1 1 8 3503 1 1 27 THR HG1 H 4.753 -11.195 0.485 1.00 . A A . 27 THR HG1 1 1 8 3504 1 1 27 THR HG21 H 6.371 -11.512 2.189 1.00 . A A . 27 THR HG21 1 1 8 3505 1 1 27 THR HG22 H 4.985 -11.765 3.265 1.00 . A A . 27 THR HG22 1 1 8 3506 1 1 27 THR HG23 H 6.230 -13.021 3.108 1.00 . A A . 27 THR HG23 1 1 8 3507 1 1 27 THR N N 6.676 -12.706 -0.193 1.00 . A A . 27 THR N 1 1 8 3508 1 1 27 THR O O 4.996 -15.698 -0.473 1.00 . A A . 27 THR O 1 1 8 3509 1 1 27 THR OG1 O 4.140 -11.876 0.776 1.00 . A A . 27 THR OG1 1 1 8 3510 1 1 28 NH2 HN1 H 4.361 -12.803 -1.526 1.00 . A A . 28 NH2 HN1 1 1 8 3511 1 1 28 NH2 HN2 H 3.826 -14.329 -2.199 1.00 . A A . 28 NH2 HN2 1 1 8 3512 1 1 28 NH2 N N 4.345 -13.815 -1.503 1.00 . A A . 28 NH2 N 1 1 9 3513 1 1 1 SER C C -13.210 -2.725 -0.976 1.00 . A A . 1 SER C 1 1 9 3514 1 1 1 SER CA C -14.327 -2.393 -1.966 1.00 . A A . 1 SER CA 1 1 9 3515 1 1 1 SER CB C -15.038 -3.650 -2.489 1.00 . A A . 1 SER CB 1 1 9 3516 1 1 1 SER H1 H -13.143 -2.106 -3.604 1.00 . A A . 1 SER H1 1 1 9 3517 1 1 1 SER H2 H -14.588 -1.316 -3.687 1.00 . A A . 1 SER H2 1 1 9 3518 1 1 1 SER H3 H -13.387 -0.737 -2.715 1.00 . A A . 1 SER H3 1 1 9 3519 1 1 1 SER HA H -15.071 -1.796 -1.436 1.00 . A A . 1 SER HA 1 1 9 3520 1 1 1 SER HB2 H -15.344 -4.274 -1.649 1.00 . A A . 1 SER HB2 1 1 9 3521 1 1 1 SER HB3 H -15.927 -3.352 -3.046 1.00 . A A . 1 SER HB3 1 1 9 3522 1 1 1 SER HG H -14.678 -5.162 -3.664 1.00 . A A . 1 SER HG 1 1 9 3523 1 1 1 SER N N -13.822 -1.572 -3.080 1.00 . A A . 1 SER N 1 1 9 3524 1 1 1 SER O O -13.116 -2.104 0.081 1.00 . A A . 1 SER O 1 1 9 3525 1 1 1 SER OG O -14.196 -4.393 -3.350 1.00 . A A . 1 SER OG 1 1 9 3526 1 1 2 GLN C C -10.169 -2.976 -0.458 1.00 . A A . 2 GLN C 1 1 9 3527 1 1 2 GLN CA C -11.208 -4.099 -0.532 1.00 . A A . 2 GLN CA 1 1 9 3528 1 1 2 GLN CB C -10.618 -5.411 -1.071 1.00 . A A . 2 GLN CB 1 1 9 3529 1 1 2 GLN CD C -9.609 -6.670 -3.015 1.00 . A A . 2 GLN CD 1 1 9 3530 1 1 2 GLN CG C -10.052 -5.306 -2.494 1.00 . A A . 2 GLN CG 1 1 9 3531 1 1 2 GLN H H -12.531 -4.180 -2.201 1.00 . A A . 2 GLN H 1 1 9 3532 1 1 2 GLN HA H -11.555 -4.300 0.483 1.00 . A A . 2 GLN HA 1 1 9 3533 1 1 2 GLN HB2 H -9.823 -5.735 -0.397 1.00 . A A . 2 GLN HB2 1 1 9 3534 1 1 2 GLN HB3 H -11.403 -6.169 -1.062 1.00 . A A . 2 GLN HB3 1 1 9 3535 1 1 2 GLN HE21 H -8.037 -6.722 -1.720 1.00 . A A . 2 GLN HE21 1 1 9 3536 1 1 2 GLN HE22 H -8.199 -8.113 -2.772 1.00 . A A . 2 GLN HE22 1 1 9 3537 1 1 2 GLN HG2 H -10.811 -4.909 -3.168 1.00 . A A . 2 GLN HG2 1 1 9 3538 1 1 2 GLN HG3 H -9.190 -4.639 -2.506 1.00 . A A . 2 GLN HG3 1 1 9 3539 1 1 2 GLN N N -12.360 -3.697 -1.328 1.00 . A A . 2 GLN N 1 1 9 3540 1 1 2 GLN NE2 N -8.525 -7.212 -2.456 1.00 . A A . 2 GLN NE2 1 1 9 3541 1 1 2 GLN O O -9.562 -2.770 0.590 1.00 . A A . 2 GLN O 1 1 9 3542 1 1 2 GLN OE1 O -10.236 -7.229 -3.912 1.00 . A A . 2 GLN OE1 1 1 9 3543 1 1 3 GLY C C -9.749 0.149 -1.066 1.00 . A A . 3 GLY C 1 1 9 3544 1 1 3 GLY CA C -9.073 -1.104 -1.620 1.00 . A A . 3 GLY CA 1 1 9 3545 1 1 3 GLY H H -10.514 -2.456 -2.389 1.00 . A A . 3 GLY H 1 1 9 3546 1 1 3 GLY HA2 H -8.168 -1.316 -1.051 1.00 . A A . 3 GLY HA2 1 1 9 3547 1 1 3 GLY HA3 H -8.794 -0.934 -2.661 1.00 . A A . 3 GLY HA3 1 1 9 3548 1 1 3 GLY N N -9.979 -2.239 -1.560 1.00 . A A . 3 GLY N 1 1 9 3549 1 1 3 GLY O O -9.902 1.135 -1.785 1.00 . A A . 3 GLY O 1 1 9 3550 1 1 4 THR C C -9.702 1.952 1.718 1.00 . A A . 4 THR C 1 1 9 3551 1 1 4 THR CA C -10.774 1.207 0.924 1.00 . A A . 4 THR CA 1 1 9 3552 1 1 4 THR CB C -11.926 0.698 1.805 1.00 . A A . 4 THR CB 1 1 9 3553 1 1 4 THR CG2 C -11.539 -0.445 2.751 1.00 . A A . 4 THR CG2 1 1 9 3554 1 1 4 THR H H -9.929 -0.732 0.743 1.00 . A A . 4 THR H 1 1 9 3555 1 1 4 THR HA H -11.214 1.897 0.202 1.00 . A A . 4 THR HA 1 1 9 3556 1 1 4 THR HB H -12.719 0.340 1.148 1.00 . A A . 4 THR HB 1 1 9 3557 1 1 4 THR HG1 H -13.209 1.460 3.053 1.00 . A A . 4 THR HG1 1 1 9 3558 1 1 4 THR HG21 H -10.741 -0.134 3.421 1.00 . A A . 4 THR HG21 1 1 9 3559 1 1 4 THR HG22 H -12.406 -0.726 3.348 1.00 . A A . 4 THR HG22 1 1 9 3560 1 1 4 THR HG23 H -11.217 -1.320 2.188 1.00 . A A . 4 THR HG23 1 1 9 3561 1 1 4 THR N N -10.143 0.103 0.212 1.00 . A A . 4 THR N 1 1 9 3562 1 1 4 THR O O -8.875 1.316 2.367 1.00 . A A . 4 THR O 1 1 9 3563 1 1 4 THR OG1 O -12.442 1.770 2.567 1.00 . A A . 4 THR OG1 1 1 9 3564 1 1 5 THR C C -8.098 3.777 3.504 1.00 . A A . 5 THR C 1 1 9 3565 1 1 5 THR CA C -8.710 4.210 2.166 1.00 . A A . 5 THR CA 1 1 9 3566 1 1 5 THR CB C -9.285 5.636 2.206 1.00 . A A . 5 THR CB 1 1 9 3567 1 1 5 THR CG2 C -10.462 5.805 3.175 1.00 . A A . 5 THR CG2 1 1 9 3568 1 1 5 THR H H -10.452 3.707 1.085 1.00 . A A . 5 THR H 1 1 9 3569 1 1 5 THR HA H -7.896 4.235 1.440 1.00 . A A . 5 THR HA 1 1 9 3570 1 1 5 THR HB H -9.634 5.890 1.203 1.00 . A A . 5 THR HB 1 1 9 3571 1 1 5 THR HG1 H -7.530 6.423 1.946 1.00 . A A . 5 THR HG1 1 1 9 3572 1 1 5 THR HG21 H -11.241 5.073 2.960 1.00 . A A . 5 THR HG21 1 1 9 3573 1 1 5 THR HG22 H -10.130 5.691 4.206 1.00 . A A . 5 THR HG22 1 1 9 3574 1 1 5 THR HG23 H -10.880 6.805 3.056 1.00 . A A . 5 THR HG23 1 1 9 3575 1 1 5 THR N N -9.710 3.289 1.627 1.00 . A A . 5 THR N 1 1 9 3576 1 1 5 THR O O -6.881 3.841 3.661 1.00 . A A . 5 THR O 1 1 9 3577 1 1 5 THR OG1 O -8.268 6.553 2.548 1.00 . A A . 5 THR OG1 1 1 9 3578 1 1 6 SER C C -7.312 1.935 5.737 1.00 . A A . 6 SER C 1 1 9 3579 1 1 6 SER CA C -8.519 2.882 5.778 1.00 . A A . 6 SER CA 1 1 9 3580 1 1 6 SER CB C -9.715 2.239 6.492 1.00 . A A . 6 SER CB 1 1 9 3581 1 1 6 SER H H -9.917 3.296 4.239 1.00 . A A . 6 SER H 1 1 9 3582 1 1 6 SER HA H -8.231 3.765 6.351 1.00 . A A . 6 SER HA 1 1 9 3583 1 1 6 SER HB2 H -9.396 1.856 7.462 1.00 . A A . 6 SER HB2 1 1 9 3584 1 1 6 SER HB3 H -10.489 2.991 6.650 1.00 . A A . 6 SER HB3 1 1 9 3585 1 1 6 SER HG H -10.590 1.532 4.899 1.00 . A A . 6 SER HG 1 1 9 3586 1 1 6 SER N N -8.931 3.329 4.452 1.00 . A A . 6 SER N 1 1 9 3587 1 1 6 SER O O -6.309 2.199 6.399 1.00 . A A . 6 SER O 1 1 9 3588 1 1 6 SER OG O -10.257 1.181 5.728 1.00 . A A . 6 SER OG 1 1 9 3589 1 1 7 GLU C C -5.442 0.241 3.618 1.00 . A A . 7 GLU C 1 1 9 3590 1 1 7 GLU CA C -6.335 -0.129 4.799 1.00 . A A . 7 GLU CA 1 1 9 3591 1 1 7 GLU CB C -6.907 -1.549 4.655 1.00 . A A . 7 GLU CB 1 1 9 3592 1 1 7 GLU CD C -8.372 -3.179 3.406 1.00 . A A . 7 GLU CD 1 1 9 3593 1 1 7 GLU CG C -7.762 -1.781 3.402 1.00 . A A . 7 GLU CG 1 1 9 3594 1 1 7 GLU H H -8.242 0.725 4.404 1.00 . A A . 7 GLU H 1 1 9 3595 1 1 7 GLU HA H -5.718 -0.139 5.697 1.00 . A A . 7 GLU HA 1 1 9 3596 1 1 7 GLU HB2 H -6.073 -2.253 4.630 1.00 . A A . 7 GLU HB2 1 1 9 3597 1 1 7 GLU HB3 H -7.514 -1.765 5.535 1.00 . A A . 7 GLU HB3 1 1 9 3598 1 1 7 GLU HG2 H -8.568 -1.053 3.365 1.00 . A A . 7 GLU HG2 1 1 9 3599 1 1 7 GLU HG3 H -7.152 -1.680 2.504 1.00 . A A . 7 GLU HG3 1 1 9 3600 1 1 7 GLU N N -7.409 0.844 4.966 1.00 . A A . 7 GLU N 1 1 9 3601 1 1 7 GLU O O -4.228 0.065 3.670 1.00 . A A . 7 GLU O 1 1 9 3602 1 1 7 GLU OE1 O -7.661 -4.112 2.972 1.00 . A A . 7 GLU OE1 1 1 9 3603 1 1 7 GLU OE2 O -9.539 -3.291 3.841 1.00 . A A . 7 GLU OE2 1 1 9 3604 1 1 8 TYR C C -4.358 2.000 1.298 1.00 . A A . 8 TYR C 1 1 9 3605 1 1 8 TYR CA C -5.465 0.952 1.248 1.00 . A A . 8 TYR CA 1 1 9 3606 1 1 8 TYR CB C -6.583 1.336 0.282 1.00 . A A . 8 TYR CB 1 1 9 3607 1 1 8 TYR CD1 C -5.812 0.210 -1.830 1.00 . A A . 8 TYR CD1 1 1 9 3608 1 1 8 TYR CD2 C -6.367 2.579 -1.902 1.00 . A A . 8 TYR CD2 1 1 9 3609 1 1 8 TYR CE1 C -5.627 0.207 -3.220 1.00 . A A . 8 TYR CE1 1 1 9 3610 1 1 8 TYR CE2 C -6.194 2.574 -3.294 1.00 . A A . 8 TYR CE2 1 1 9 3611 1 1 8 TYR CG C -6.185 1.393 -1.170 1.00 . A A . 8 TYR CG 1 1 9 3612 1 1 8 TYR CZ C -5.815 1.392 -3.955 1.00 . A A . 8 TYR CZ 1 1 9 3613 1 1 8 TYR H H -7.071 0.832 2.598 1.00 . A A . 8 TYR H 1 1 9 3614 1 1 8 TYR HA H -5.032 0.012 0.911 1.00 . A A . 8 TYR HA 1 1 9 3615 1 1 8 TYR HB2 H -7.362 0.580 0.362 1.00 . A A . 8 TYR HB2 1 1 9 3616 1 1 8 TYR HB3 H -7.005 2.292 0.585 1.00 . A A . 8 TYR HB3 1 1 9 3617 1 1 8 TYR HD1 H -5.692 -0.708 -1.275 1.00 . A A . 8 TYR HD1 1 1 9 3618 1 1 8 TYR HD2 H -6.659 3.492 -1.404 1.00 . A A . 8 TYR HD2 1 1 9 3619 1 1 8 TYR HE1 H -5.358 -0.718 -3.706 1.00 . A A . 8 TYR HE1 1 1 9 3620 1 1 8 TYR HE2 H -6.366 3.485 -3.846 1.00 . A A . 8 TYR HE2 1 1 9 3621 1 1 8 TYR HH H -5.374 0.542 -5.658 1.00 . A A . 8 TYR HH 1 1 9 3622 1 1 8 TYR N N -6.071 0.706 2.539 1.00 . A A . 8 TYR N 1 1 9 3623 1 1 8 TYR O O -3.248 1.720 0.849 1.00 . A A . 8 TYR O 1 1 9 3624 1 1 8 TYR OH O -5.632 1.397 -5.307 1.00 . A A . 8 TYR OH 1 1 9 3625 1 1 9 SER C C -2.364 3.947 2.444 1.00 . A A . 9 SER C 1 1 9 3626 1 1 9 SER CA C -3.741 4.327 1.884 1.00 . A A . 9 SER CA 1 1 9 3627 1 1 9 SER CB C -4.357 5.478 2.684 1.00 . A A . 9 SER CB 1 1 9 3628 1 1 9 SER H H -5.585 3.337 2.218 1.00 . A A . 9 SER H 1 1 9 3629 1 1 9 SER HA H -3.636 4.693 0.868 1.00 . A A . 9 SER HA 1 1 9 3630 1 1 9 SER HB2 H -4.580 5.153 3.698 1.00 . A A . 9 SER HB2 1 1 9 3631 1 1 9 SER HB3 H -3.652 6.309 2.726 1.00 . A A . 9 SER HB3 1 1 9 3632 1 1 9 SER HG H -5.941 6.594 2.630 1.00 . A A . 9 SER HG 1 1 9 3633 1 1 9 SER N N -4.658 3.192 1.838 1.00 . A A . 9 SER N 1 1 9 3634 1 1 9 SER O O -1.341 4.458 1.989 1.00 . A A . 9 SER O 1 1 9 3635 1 1 9 SER OG O -5.546 5.923 2.067 1.00 . A A . 9 SER OG 1 1 9 3636 1 1 10 LYS C C -0.146 1.923 3.239 1.00 . A A . 10 LYS C 1 1 9 3637 1 1 10 LYS CA C -1.194 2.549 4.155 1.00 . A A . 10 LYS CA 1 1 9 3638 1 1 10 LYS CB C -1.622 1.508 5.193 1.00 . A A . 10 LYS CB 1 1 9 3639 1 1 10 LYS CD C -2.761 3.114 6.877 1.00 . A A . 10 LYS CD 1 1 9 3640 1 1 10 LYS CE C -3.203 4.395 6.154 1.00 . A A . 10 LYS CE 1 1 9 3641 1 1 10 LYS CG C -2.877 1.857 6.001 1.00 . A A . 10 LYS CG 1 1 9 3642 1 1 10 LYS H H -3.246 2.644 3.686 1.00 . A A . 10 LYS H 1 1 9 3643 1 1 10 LYS HA H -0.736 3.386 4.681 1.00 . A A . 10 LYS HA 1 1 9 3644 1 1 10 LYS HB2 H -1.823 0.570 4.674 1.00 . A A . 10 LYS HB2 1 1 9 3645 1 1 10 LYS HB3 H -0.791 1.336 5.879 1.00 . A A . 10 LYS HB3 1 1 9 3646 1 1 10 LYS HD2 H -3.429 2.976 7.728 1.00 . A A . 10 LYS HD2 1 1 9 3647 1 1 10 LYS HD3 H -1.743 3.221 7.253 1.00 . A A . 10 LYS HD3 1 1 9 3648 1 1 10 LYS HE2 H -2.493 4.678 5.379 1.00 . A A . 10 LYS HE2 1 1 9 3649 1 1 10 LYS HE3 H -4.180 4.230 5.698 1.00 . A A . 10 LYS HE3 1 1 9 3650 1 1 10 LYS HG2 H -3.745 1.934 5.350 1.00 . A A . 10 LYS HG2 1 1 9 3651 1 1 10 LYS HG3 H -3.040 0.999 6.650 1.00 . A A . 10 LYS HG3 1 1 9 3652 1 1 10 LYS HZ1 H -3.614 6.348 6.589 1.00 . A A . 10 LYS HZ1 1 1 9 3653 1 1 10 LYS HZ2 H -3.987 5.303 7.809 1.00 . A A . 10 LYS HZ2 1 1 9 3654 1 1 10 LYS HZ3 H -2.413 5.700 7.514 1.00 . A A . 10 LYS HZ3 1 1 9 3655 1 1 10 LYS N N -2.358 3.035 3.425 1.00 . A A . 10 LYS N 1 1 9 3656 1 1 10 LYS NZ N -3.313 5.525 7.090 1.00 . A A . 10 LYS NZ 1 1 9 3657 1 1 10 LYS O O 0.999 1.760 3.650 1.00 . A A . 10 LYS O 1 1 9 3658 1 1 11 TYR C C 0.077 1.663 -0.396 1.00 . A A . 11 TYR C 1 1 9 3659 1 1 11 TYR CA C 0.355 1.062 0.985 1.00 . A A . 11 TYR CA 1 1 9 3660 1 1 11 TYR CB C 0.235 -0.448 0.994 1.00 . A A . 11 TYR CB 1 1 9 3661 1 1 11 TYR CD1 C -1.755 -1.227 -0.382 1.00 . A A . 11 TYR CD1 1 1 9 3662 1 1 11 TYR CD2 C -1.840 -1.433 2.041 1.00 . A A . 11 TYR CD2 1 1 9 3663 1 1 11 TYR CE1 C -2.991 -1.887 -0.482 1.00 . A A . 11 TYR CE1 1 1 9 3664 1 1 11 TYR CE2 C -3.061 -2.121 1.939 1.00 . A A . 11 TYR CE2 1 1 9 3665 1 1 11 TYR CG C -1.166 -1.017 0.879 1.00 . A A . 11 TYR CG 1 1 9 3666 1 1 11 TYR CZ C -3.642 -2.340 0.679 1.00 . A A . 11 TYR CZ 1 1 9 3667 1 1 11 TYR H H -1.523 1.538 1.820 1.00 . A A . 11 TYR H 1 1 9 3668 1 1 11 TYR HA H 1.384 1.320 1.231 1.00 . A A . 11 TYR HA 1 1 9 3669 1 1 11 TYR HB2 H 0.846 -0.814 0.179 1.00 . A A . 11 TYR HB2 1 1 9 3670 1 1 11 TYR HB3 H 0.655 -0.756 1.949 1.00 . A A . 11 TYR HB3 1 1 9 3671 1 1 11 TYR HD1 H -1.258 -0.891 -1.279 1.00 . A A . 11 TYR HD1 1 1 9 3672 1 1 11 TYR HD2 H -1.414 -1.221 3.012 1.00 . A A . 11 TYR HD2 1 1 9 3673 1 1 11 TYR HE1 H -3.434 -2.050 -1.454 1.00 . A A . 11 TYR HE1 1 1 9 3674 1 1 11 TYR HE2 H -3.559 -2.471 2.832 1.00 . A A . 11 TYR HE2 1 1 9 3675 1 1 11 TYR HH H -5.144 -3.097 -0.316 1.00 . A A . 11 TYR HH 1 1 9 3676 1 1 11 TYR N N -0.534 1.569 2.011 1.00 . A A . 11 TYR N 1 1 9 3677 1 1 11 TYR O O 0.292 1.020 -1.421 1.00 . A A . 11 TYR O 1 1 9 3678 1 1 11 TYR OH O -4.839 -2.988 0.587 1.00 . A A . 11 TYR OH 1 1 9 3679 1 1 12 LEU C C 0.241 4.789 -1.848 1.00 . A A . 12 LEU C 1 1 9 3680 1 1 12 LEU CA C -0.756 3.655 -1.613 1.00 . A A . 12 LEU CA 1 1 9 3681 1 1 12 LEU CB C -2.159 4.187 -1.320 1.00 . A A . 12 LEU CB 1 1 9 3682 1 1 12 LEU CD1 C -2.572 6.301 -2.725 1.00 . A A . 12 LEU CD1 1 1 9 3683 1 1 12 LEU CD2 C -3.032 4.017 -3.699 1.00 . A A . 12 LEU CD2 1 1 9 3684 1 1 12 LEU CG C -2.990 4.858 -2.420 1.00 . A A . 12 LEU CG 1 1 9 3685 1 1 12 LEU H H -0.535 3.375 0.469 1.00 . A A . 12 LEU H 1 1 9 3686 1 1 12 LEU HA H -0.771 3.002 -2.486 1.00 . A A . 12 LEU HA 1 1 9 3687 1 1 12 LEU HB2 H -2.742 3.330 -0.982 1.00 . A A . 12 LEU HB2 1 1 9 3688 1 1 12 LEU HB3 H -2.052 4.888 -0.497 1.00 . A A . 12 LEU HB3 1 1 9 3689 1 1 12 LEU HD11 H -3.345 6.776 -3.330 1.00 . A A . 12 LEU HD11 1 1 9 3690 1 1 12 LEU HD12 H -2.460 6.863 -1.798 1.00 . A A . 12 LEU HD12 1 1 9 3691 1 1 12 LEU HD13 H -1.639 6.333 -3.283 1.00 . A A . 12 LEU HD13 1 1 9 3692 1 1 12 LEU HD21 H -3.775 4.429 -4.383 1.00 . A A . 12 LEU HD21 1 1 9 3693 1 1 12 LEU HD22 H -2.059 4.027 -4.190 1.00 . A A . 12 LEU HD22 1 1 9 3694 1 1 12 LEU HD23 H -3.301 2.989 -3.457 1.00 . A A . 12 LEU HD23 1 1 9 3695 1 1 12 LEU HG H -3.997 4.910 -1.999 1.00 . A A . 12 LEU HG 1 1 9 3696 1 1 12 LEU N N -0.382 2.912 -0.417 1.00 . A A . 12 LEU N 1 1 9 3697 1 1 12 LEU O O 0.509 5.158 -2.989 1.00 . A A . 12 LEU O 1 1 9 3698 1 1 13 ASP C C 3.033 6.234 -1.221 1.00 . A A . 13 ASP C 1 1 9 3699 1 1 13 ASP CA C 1.619 6.508 -0.673 1.00 . A A . 13 ASP CA 1 1 9 3700 1 1 13 ASP CB C 1.583 6.955 0.795 1.00 . A A . 13 ASP CB 1 1 9 3701 1 1 13 ASP CG C 2.048 8.395 1.005 1.00 . A A . 13 ASP CG 1 1 9 3702 1 1 13 ASP H H 0.480 4.952 0.143 1.00 . A A . 13 ASP H 1 1 9 3703 1 1 13 ASP HA H 1.171 7.290 -1.287 1.00 . A A . 13 ASP HA 1 1 9 3704 1 1 13 ASP HB2 H 0.551 6.884 1.147 1.00 . A A . 13 ASP HB2 1 1 9 3705 1 1 13 ASP HB3 H 2.179 6.259 1.386 1.00 . A A . 13 ASP HB3 1 1 9 3706 1 1 13 ASP N N 0.760 5.340 -0.745 1.00 . A A . 13 ASP N 1 1 9 3707 1 1 13 ASP O O 3.178 5.605 -2.267 1.00 . A A . 13 ASP O 1 1 9 3708 1 1 13 ASP OD1 O 1.278 9.303 0.625 1.00 . A A . 13 ASP OD1 1 1 9 3709 1 1 13 ASP OD2 O 3.165 8.560 1.541 1.00 . A A . 13 ASP OD2 1 1 9 3710 1 1 14 SER C C 6.136 5.389 -0.546 1.00 . A A . 14 SER C 1 1 9 3711 1 1 14 SER CA C 5.455 6.675 -1.023 1.00 . A A . 14 SER CA 1 1 9 3712 1 1 14 SER CB C 6.182 7.960 -0.600 1.00 . A A . 14 SER CB 1 1 9 3713 1 1 14 SER H H 3.919 7.216 0.322 1.00 . A A . 14 SER H 1 1 9 3714 1 1 14 SER HA H 5.462 6.658 -2.114 1.00 . A A . 14 SER HA 1 1 9 3715 1 1 14 SER HB2 H 6.159 8.078 0.484 1.00 . A A . 14 SER HB2 1 1 9 3716 1 1 14 SER HB3 H 7.218 7.929 -0.941 1.00 . A A . 14 SER HB3 1 1 9 3717 1 1 14 SER HG H 4.640 9.115 -0.886 1.00 . A A . 14 SER HG 1 1 9 3718 1 1 14 SER N N 4.080 6.728 -0.546 1.00 . A A . 14 SER N 1 1 9 3719 1 1 14 SER O O 5.832 4.321 -1.075 1.00 . A A . 14 SER O 1 1 9 3720 1 1 14 SER OG O 5.553 9.082 -1.183 1.00 . A A . 14 SER OG 1 1 9 3721 1 1 15 ARG C C 6.999 3.171 1.268 1.00 . A A . 15 ARG C 1 1 9 3722 1 1 15 ARG CA C 7.864 4.377 0.925 1.00 . A A . 15 ARG CA 1 1 9 3723 1 1 15 ARG CB C 8.690 4.840 2.137 1.00 . A A . 15 ARG CB 1 1 9 3724 1 1 15 ARG CD C 9.065 2.731 3.593 1.00 . A A . 15 ARG CD 1 1 9 3725 1 1 15 ARG CG C 9.686 3.792 2.670 1.00 . A A . 15 ARG CG 1 1 9 3726 1 1 15 ARG CZ C 9.850 0.868 5.044 1.00 . A A . 15 ARG CZ 1 1 9 3727 1 1 15 ARG H H 7.234 6.389 0.840 1.00 . A A . 15 ARG H 1 1 9 3728 1 1 15 ARG HA H 8.556 4.093 0.131 1.00 . A A . 15 ARG HA 1 1 9 3729 1 1 15 ARG HB2 H 9.274 5.705 1.818 1.00 . A A . 15 ARG HB2 1 1 9 3730 1 1 15 ARG HB3 H 8.031 5.160 2.946 1.00 . A A . 15 ARG HB3 1 1 9 3731 1 1 15 ARG HD2 H 8.478 3.220 4.371 1.00 . A A . 15 ARG HD2 1 1 9 3732 1 1 15 ARG HD3 H 8.419 2.058 3.035 1.00 . A A . 15 ARG HD3 1 1 9 3733 1 1 15 ARG HE H 11.061 2.112 3.991 1.00 . A A . 15 ARG HE 1 1 9 3734 1 1 15 ARG HG2 H 10.191 3.305 1.834 1.00 . A A . 15 ARG HG2 1 1 9 3735 1 1 15 ARG HG3 H 10.435 4.330 3.254 1.00 . A A . 15 ARG HG3 1 1 9 3736 1 1 15 ARG HH11 H 7.816 1.085 5.033 1.00 . A A . 15 ARG HH11 1 1 9 3737 1 1 15 ARG HH12 H 8.424 -0.233 6.007 1.00 . A A . 15 ARG HH12 1 1 9 3738 1 1 15 ARG HH21 H 11.820 0.374 5.270 1.00 . A A . 15 ARG HH21 1 1 9 3739 1 1 15 ARG HH22 H 10.690 -0.635 6.142 1.00 . A A . 15 ARG HH22 1 1 9 3740 1 1 15 ARG N N 7.051 5.485 0.433 1.00 . A A . 15 ARG N 1 1 9 3741 1 1 15 ARG NE N 10.100 1.900 4.220 1.00 . A A . 15 ARG NE 1 1 9 3742 1 1 15 ARG NH1 N 8.594 0.550 5.391 1.00 . A A . 15 ARG NH1 1 1 9 3743 1 1 15 ARG NH2 N 10.870 0.144 5.525 1.00 . A A . 15 ARG NH2 1 1 9 3744 1 1 15 ARG O O 7.260 2.076 0.777 1.00 . A A . 15 ARG O 1 1 9 3745 1 1 16 ARG C C 4.500 1.484 1.505 1.00 . A A . 16 ARG C 1 1 9 3746 1 1 16 ARG CA C 5.126 2.319 2.625 1.00 . A A . 16 ARG CA 1 1 9 3747 1 1 16 ARG CB C 4.091 2.901 3.597 1.00 . A A . 16 ARG CB 1 1 9 3748 1 1 16 ARG CD C 2.254 4.525 4.061 1.00 . A A . 16 ARG CD 1 1 9 3749 1 1 16 ARG CG C 3.059 3.835 2.948 1.00 . A A . 16 ARG CG 1 1 9 3750 1 1 16 ARG CZ C 0.368 6.142 4.240 1.00 . A A . 16 ARG CZ 1 1 9 3751 1 1 16 ARG H H 5.827 4.314 2.459 1.00 . A A . 16 ARG H 1 1 9 3752 1 1 16 ARG HA H 5.760 1.651 3.211 1.00 . A A . 16 ARG HA 1 1 9 3753 1 1 16 ARG HB2 H 3.569 2.074 4.079 1.00 . A A . 16 ARG HB2 1 1 9 3754 1 1 16 ARG HB3 H 4.629 3.454 4.368 1.00 . A A . 16 ARG HB3 1 1 9 3755 1 1 16 ARG HD2 H 1.926 3.788 4.795 1.00 . A A . 16 ARG HD2 1 1 9 3756 1 1 16 ARG HD3 H 2.908 5.240 4.559 1.00 . A A . 16 ARG HD3 1 1 9 3757 1 1 16 ARG HE H 0.711 4.937 2.646 1.00 . A A . 16 ARG HE 1 1 9 3758 1 1 16 ARG HG2 H 3.563 4.588 2.346 1.00 . A A . 16 ARG HG2 1 1 9 3759 1 1 16 ARG HG3 H 2.401 3.261 2.294 1.00 . A A . 16 ARG HG3 1 1 9 3760 1 1 16 ARG HH11 H 1.551 6.104 5.910 1.00 . A A . 16 ARG HH11 1 1 9 3761 1 1 16 ARG HH12 H 0.207 7.218 5.968 1.00 . A A . 16 ARG HH12 1 1 9 3762 1 1 16 ARG HH21 H -1.027 6.399 2.774 1.00 . A A . 16 ARG HH21 1 1 9 3763 1 1 16 ARG HH22 H -1.240 7.403 4.193 1.00 . A A . 16 ARG HH22 1 1 9 3764 1 1 16 ARG N N 5.984 3.378 2.114 1.00 . A A . 16 ARG N 1 1 9 3765 1 1 16 ARG NE N 1.061 5.215 3.554 1.00 . A A . 16 ARG NE 1 1 9 3766 1 1 16 ARG NH1 N 0.741 6.519 5.472 1.00 . A A . 16 ARG NH1 1 1 9 3767 1 1 16 ARG NH2 N -0.719 6.699 3.689 1.00 . A A . 16 ARG NH2 1 1 9 3768 1 1 16 ARG O O 4.349 0.274 1.662 1.00 . A A . 16 ARG O 1 1 9 3769 1 1 17 ALA C C 4.721 0.523 -1.420 1.00 . A A . 17 ALA C 1 1 9 3770 1 1 17 ALA CA C 3.649 1.413 -0.794 1.00 . A A . 17 ALA CA 1 1 9 3771 1 1 17 ALA CB C 3.099 2.418 -1.805 1.00 . A A . 17 ALA CB 1 1 9 3772 1 1 17 ALA H H 4.329 3.105 0.288 1.00 . A A . 17 ALA H 1 1 9 3773 1 1 17 ALA HA H 2.827 0.770 -0.484 1.00 . A A . 17 ALA HA 1 1 9 3774 1 1 17 ALA HB1 H 2.354 3.046 -1.322 1.00 . A A . 17 ALA HB1 1 1 9 3775 1 1 17 ALA HB2 H 3.897 3.050 -2.180 1.00 . A A . 17 ALA HB2 1 1 9 3776 1 1 17 ALA HB3 H 2.640 1.891 -2.642 1.00 . A A . 17 ALA HB3 1 1 9 3777 1 1 17 ALA N N 4.163 2.112 0.372 1.00 . A A . 17 ALA N 1 1 9 3778 1 1 17 ALA O O 4.444 -0.635 -1.721 1.00 . A A . 17 ALA O 1 1 9 3779 1 1 18 GLN C C 7.409 -0.913 -1.353 1.00 . A A . 18 GLN C 1 1 9 3780 1 1 18 GLN CA C 7.018 0.278 -2.230 1.00 . A A . 18 GLN CA 1 1 9 3781 1 1 18 GLN CB C 8.254 1.151 -2.508 1.00 . A A . 18 GLN CB 1 1 9 3782 1 1 18 GLN CD C 6.909 2.554 -4.179 1.00 . A A . 18 GLN CD 1 1 9 3783 1 1 18 GLN CG C 7.971 2.546 -3.081 1.00 . A A . 18 GLN CG 1 1 9 3784 1 1 18 GLN H H 6.128 1.989 -1.311 1.00 . A A . 18 GLN H 1 1 9 3785 1 1 18 GLN HA H 6.646 -0.118 -3.177 1.00 . A A . 18 GLN HA 1 1 9 3786 1 1 18 GLN HB2 H 8.817 1.288 -1.584 1.00 . A A . 18 GLN HB2 1 1 9 3787 1 1 18 GLN HB3 H 8.889 0.610 -3.211 1.00 . A A . 18 GLN HB3 1 1 9 3788 1 1 18 GLN HE21 H 5.687 3.757 -3.071 1.00 . A A . 18 GLN HE21 1 1 9 3789 1 1 18 GLN HE22 H 5.080 3.312 -4.651 1.00 . A A . 18 GLN HE22 1 1 9 3790 1 1 18 GLN HG2 H 7.671 3.199 -2.266 1.00 . A A . 18 GLN HG2 1 1 9 3791 1 1 18 GLN HG3 H 8.898 2.944 -3.493 1.00 . A A . 18 GLN HG3 1 1 9 3792 1 1 18 GLN N N 5.939 1.043 -1.613 1.00 . A A . 18 GLN N 1 1 9 3793 1 1 18 GLN NE2 N 5.806 3.271 -3.951 1.00 . A A . 18 GLN NE2 1 1 9 3794 1 1 18 GLN O O 7.626 -2.012 -1.858 1.00 . A A . 18 GLN O 1 1 9 3795 1 1 18 GLN OE1 O 7.084 1.924 -5.219 1.00 . A A . 18 GLN OE1 1 1 9 3796 1 1 19 ASP C C 6.744 -2.778 0.976 1.00 . A A . 19 ASP C 1 1 9 3797 1 1 19 ASP CA C 7.822 -1.695 0.954 1.00 . A A . 19 ASP CA 1 1 9 3798 1 1 19 ASP CB C 7.975 -1.021 2.321 1.00 . A A . 19 ASP CB 1 1 9 3799 1 1 19 ASP CG C 8.355 -2.025 3.406 1.00 . A A . 19 ASP CG 1 1 9 3800 1 1 19 ASP H H 7.273 0.241 0.298 1.00 . A A . 19 ASP H 1 1 9 3801 1 1 19 ASP HA H 8.777 -2.150 0.684 1.00 . A A . 19 ASP HA 1 1 9 3802 1 1 19 ASP HB2 H 8.758 -0.265 2.255 1.00 . A A . 19 ASP HB2 1 1 9 3803 1 1 19 ASP HB3 H 7.042 -0.528 2.596 1.00 . A A . 19 ASP HB3 1 1 9 3804 1 1 19 ASP N N 7.491 -0.686 -0.038 1.00 . A A . 19 ASP N 1 1 9 3805 1 1 19 ASP O O 7.060 -3.966 0.982 1.00 . A A . 19 ASP O 1 1 9 3806 1 1 19 ASP OD1 O 9.566 -2.317 3.512 1.00 . A A . 19 ASP OD1 1 1 9 3807 1 1 19 ASP OD2 O 7.429 -2.481 4.111 1.00 . A A . 19 ASP OD2 1 1 9 3808 1 1 20 PHE C C 4.411 -4.107 -0.397 1.00 . A A . 20 PHE C 1 1 9 3809 1 1 20 PHE CA C 4.343 -3.277 0.885 1.00 . A A . 20 PHE CA 1 1 9 3810 1 1 20 PHE CB C 3.035 -2.489 0.969 1.00 . A A . 20 PHE CB 1 1 9 3811 1 1 20 PHE CD1 C 1.230 -3.858 2.096 1.00 . A A . 20 PHE CD1 1 1 9 3812 1 1 20 PHE CD2 C 1.139 -3.563 -0.320 1.00 . A A . 20 PHE CD2 1 1 9 3813 1 1 20 PHE CE1 C 0.020 -4.572 2.053 1.00 . A A . 20 PHE CE1 1 1 9 3814 1 1 20 PHE CE2 C -0.072 -4.274 -0.362 1.00 . A A . 20 PHE CE2 1 1 9 3815 1 1 20 PHE CG C 1.787 -3.345 0.910 1.00 . A A . 20 PHE CG 1 1 9 3816 1 1 20 PHE CZ C -0.635 -4.774 0.825 1.00 . A A . 20 PHE CZ 1 1 9 3817 1 1 20 PHE H H 5.273 -1.374 0.999 1.00 . A A . 20 PHE H 1 1 9 3818 1 1 20 PHE HA H 4.380 -3.951 1.743 1.00 . A A . 20 PHE HA 1 1 9 3819 1 1 20 PHE HB2 H 3.025 -1.936 1.909 1.00 . A A . 20 PHE HB2 1 1 9 3820 1 1 20 PHE HB3 H 3.008 -1.765 0.155 1.00 . A A . 20 PHE HB3 1 1 9 3821 1 1 20 PHE HD1 H 1.726 -3.693 3.042 1.00 . A A . 20 PHE HD1 1 1 9 3822 1 1 20 PHE HD2 H 1.564 -3.168 -1.232 1.00 . A A . 20 PHE HD2 1 1 9 3823 1 1 20 PHE HE1 H -0.409 -4.963 2.964 1.00 . A A . 20 PHE HE1 1 1 9 3824 1 1 20 PHE HE2 H -0.577 -4.427 -1.304 1.00 . A A . 20 PHE HE2 1 1 9 3825 1 1 20 PHE HZ H -1.570 -5.314 0.794 1.00 . A A . 20 PHE HZ 1 1 9 3826 1 1 20 PHE N N 5.471 -2.366 0.972 1.00 . A A . 20 PHE N 1 1 9 3827 1 1 20 PHE O O 4.169 -5.308 -0.354 1.00 . A A . 20 PHE O 1 1 9 3828 1 1 21 VAL C C 5.974 -5.264 -2.708 1.00 . A A . 21 VAL C 1 1 9 3829 1 1 21 VAL CA C 4.846 -4.235 -2.791 1.00 . A A . 21 VAL CA 1 1 9 3830 1 1 21 VAL CB C 4.979 -3.263 -3.978 1.00 . A A . 21 VAL CB 1 1 9 3831 1 1 21 VAL CG1 C 5.438 -3.969 -5.260 1.00 . A A . 21 VAL CG1 1 1 9 3832 1 1 21 VAL CG2 C 3.624 -2.597 -4.255 1.00 . A A . 21 VAL CG2 1 1 9 3833 1 1 21 VAL H H 4.964 -2.504 -1.544 1.00 . A A . 21 VAL H 1 1 9 3834 1 1 21 VAL HA H 3.930 -4.811 -2.911 1.00 . A A . 21 VAL HA 1 1 9 3835 1 1 21 VAL HB H 5.711 -2.492 -3.735 1.00 . A A . 21 VAL HB 1 1 9 3836 1 1 21 VAL HG11 H 5.403 -3.271 -6.097 1.00 . A A . 21 VAL HG11 1 1 9 3837 1 1 21 VAL HG12 H 6.466 -4.315 -5.151 1.00 . A A . 21 VAL HG12 1 1 9 3838 1 1 21 VAL HG13 H 4.789 -4.818 -5.476 1.00 . A A . 21 VAL HG13 1 1 9 3839 1 1 21 VAL HG21 H 2.910 -3.341 -4.609 1.00 . A A . 21 VAL HG21 1 1 9 3840 1 1 21 VAL HG22 H 3.226 -2.138 -3.352 1.00 . A A . 21 VAL HG22 1 1 9 3841 1 1 21 VAL HG23 H 3.742 -1.827 -5.017 1.00 . A A . 21 VAL HG23 1 1 9 3842 1 1 21 VAL N N 4.747 -3.495 -1.539 1.00 . A A . 21 VAL N 1 1 9 3843 1 1 21 VAL O O 5.772 -6.422 -3.066 1.00 . A A . 21 VAL O 1 1 9 3844 1 1 22 GLN C C 7.891 -6.912 -1.080 1.00 . A A . 22 GLN C 1 1 9 3845 1 1 22 GLN CA C 8.276 -5.742 -1.993 1.00 . A A . 22 GLN CA 1 1 9 3846 1 1 22 GLN CB C 9.438 -4.936 -1.398 1.00 . A A . 22 GLN CB 1 1 9 3847 1 1 22 GLN CD C 11.249 -6.168 -2.685 1.00 . A A . 22 GLN CD 1 1 9 3848 1 1 22 GLN CG C 10.734 -5.749 -1.309 1.00 . A A . 22 GLN CG 1 1 9 3849 1 1 22 GLN H H 7.249 -3.884 -1.944 1.00 . A A . 22 GLN H 1 1 9 3850 1 1 22 GLN HA H 8.576 -6.137 -2.964 1.00 . A A . 22 GLN HA 1 1 9 3851 1 1 22 GLN HB2 H 9.616 -4.053 -2.013 1.00 . A A . 22 GLN HB2 1 1 9 3852 1 1 22 GLN HB3 H 9.171 -4.606 -0.394 1.00 . A A . 22 GLN HB3 1 1 9 3853 1 1 22 GLN HE21 H 11.689 -4.239 -3.175 1.00 . A A . 22 GLN HE21 1 1 9 3854 1 1 22 GLN HE22 H 12.046 -5.435 -4.404 1.00 . A A . 22 GLN HE22 1 1 9 3855 1 1 22 GLN HG2 H 11.491 -5.134 -0.821 1.00 . A A . 22 GLN HG2 1 1 9 3856 1 1 22 GLN HG3 H 10.571 -6.633 -0.691 1.00 . A A . 22 GLN HG3 1 1 9 3857 1 1 22 GLN N N 7.146 -4.854 -2.213 1.00 . A A . 22 GLN N 1 1 9 3858 1 1 22 GLN NE2 N 11.698 -5.200 -3.486 1.00 . A A . 22 GLN NE2 1 1 9 3859 1 1 22 GLN O O 8.338 -8.036 -1.297 1.00 . A A . 22 GLN O 1 1 9 3860 1 1 22 GLN OE1 O 11.243 -7.348 -3.024 1.00 . A A . 22 GLN OE1 1 1 9 3861 1 1 23 TRP C C 5.767 -8.693 0.172 1.00 . A A . 23 TRP C 1 1 9 3862 1 1 23 TRP CA C 6.643 -7.671 0.885 1.00 . A A . 23 TRP CA 1 1 9 3863 1 1 23 TRP CB C 5.874 -7.019 2.037 1.00 . A A . 23 TRP CB 1 1 9 3864 1 1 23 TRP CD1 C 5.403 -8.972 3.552 1.00 . A A . 23 TRP CD1 1 1 9 3865 1 1 23 TRP CD2 C 3.550 -8.157 2.609 1.00 . A A . 23 TRP CD2 1 1 9 3866 1 1 23 TRP CE2 C 3.151 -9.263 3.410 1.00 . A A . 23 TRP CE2 1 1 9 3867 1 1 23 TRP CE3 C 2.563 -7.542 1.815 1.00 . A A . 23 TRP CE3 1 1 9 3868 1 1 23 TRP CG C 4.982 -7.967 2.764 1.00 . A A . 23 TRP CG 1 1 9 3869 1 1 23 TRP CH2 C 0.852 -9.044 2.693 1.00 . A A . 23 TRP CH2 1 1 9 3870 1 1 23 TRP CZ2 C 1.821 -9.701 3.467 1.00 . A A . 23 TRP CZ2 1 1 9 3871 1 1 23 TRP CZ3 C 1.225 -7.975 1.857 1.00 . A A . 23 TRP CZ3 1 1 9 3872 1 1 23 TRP H H 6.618 -5.750 0.009 1.00 . A A . 23 TRP H 1 1 9 3873 1 1 23 TRP HA H 7.519 -8.177 1.294 1.00 . A A . 23 TRP HA 1 1 9 3874 1 1 23 TRP HB2 H 6.577 -6.569 2.737 1.00 . A A . 23 TRP HB2 1 1 9 3875 1 1 23 TRP HB3 H 5.237 -6.226 1.654 1.00 . A A . 23 TRP HB3 1 1 9 3876 1 1 23 TRP HD1 H 6.445 -9.158 3.744 1.00 . A A . 23 TRP HD1 1 1 9 3877 1 1 23 TRP HE1 H 4.357 -10.523 4.590 1.00 . A A . 23 TRP HE1 1 1 9 3878 1 1 23 TRP HE3 H 2.873 -6.754 1.144 1.00 . A A . 23 TRP HE3 1 1 9 3879 1 1 23 TRP HH2 H -0.174 -9.373 2.732 1.00 . A A . 23 TRP HH2 1 1 9 3880 1 1 23 TRP HZ2 H 1.548 -10.543 4.087 1.00 . A A . 23 TRP HZ2 1 1 9 3881 1 1 23 TRP HZ3 H 0.484 -7.494 1.237 1.00 . A A . 23 TRP HZ3 1 1 9 3882 1 1 23 TRP N N 7.058 -6.658 -0.065 1.00 . A A . 23 TRP N 1 1 9 3883 1 1 23 TRP NE1 N 4.323 -9.719 3.981 1.00 . A A . 23 TRP NE1 1 1 9 3884 1 1 23 TRP O O 6.027 -9.891 0.246 1.00 . A A . 23 TRP O 1 1 9 3885 1 1 24 LEU C C 4.521 -9.893 -2.238 1.00 . A A . 24 LEU C 1 1 9 3886 1 1 24 LEU CA C 3.771 -8.965 -1.276 1.00 . A A . 24 LEU CA 1 1 9 3887 1 1 24 LEU CB C 2.847 -7.978 -2.006 1.00 . A A . 24 LEU CB 1 1 9 3888 1 1 24 LEU CD1 C 0.610 -7.394 -2.928 1.00 . A A . 24 LEU CD1 1 1 9 3889 1 1 24 LEU CD2 C 1.423 -9.748 -3.189 1.00 . A A . 24 LEU CD2 1 1 9 3890 1 1 24 LEU CG C 1.433 -8.513 -2.283 1.00 . A A . 24 LEU CG 1 1 9 3891 1 1 24 LEU H H 4.601 -7.190 -0.482 1.00 . A A . 24 LEU H 1 1 9 3892 1 1 24 LEU HA H 3.172 -9.551 -0.578 1.00 . A A . 24 LEU HA 1 1 9 3893 1 1 24 LEU HB2 H 2.714 -7.106 -1.366 1.00 . A A . 24 LEU HB2 1 1 9 3894 1 1 24 LEU HB3 H 3.321 -7.641 -2.928 1.00 . A A . 24 LEU HB3 1 1 9 3895 1 1 24 LEU HD11 H -0.415 -7.730 -3.084 1.00 . A A . 24 LEU HD11 1 1 9 3896 1 1 24 LEU HD12 H 0.597 -6.522 -2.274 1.00 . A A . 24 LEU HD12 1 1 9 3897 1 1 24 LEU HD13 H 1.048 -7.115 -3.887 1.00 . A A . 24 LEU HD13 1 1 9 3898 1 1 24 LEU HD21 H 1.778 -10.615 -2.636 1.00 . A A . 24 LEU HD21 1 1 9 3899 1 1 24 LEU HD22 H 0.404 -9.955 -3.516 1.00 . A A . 24 LEU HD22 1 1 9 3900 1 1 24 LEU HD23 H 2.054 -9.581 -4.063 1.00 . A A . 24 LEU HD23 1 1 9 3901 1 1 24 LEU HG H 0.960 -8.775 -1.335 1.00 . A A . 24 LEU HG 1 1 9 3902 1 1 24 LEU N N 4.730 -8.193 -0.505 1.00 . A A . 24 LEU N 1 1 9 3903 1 1 24 LEU O O 4.202 -11.074 -2.351 1.00 . A A . 24 LEU O 1 1 9 3904 1 1 25 MET C C 7.116 -11.237 -3.098 1.00 . A A . 25 MET C 1 1 9 3905 1 1 25 MET CA C 6.402 -10.091 -3.820 1.00 . A A . 25 MET CA 1 1 9 3906 1 1 25 MET CB C 7.419 -9.153 -4.484 1.00 . A A . 25 MET CB 1 1 9 3907 1 1 25 MET CE C 9.276 -7.703 -6.655 1.00 . A A . 25 MET CE 1 1 9 3908 1 1 25 MET CG C 6.773 -8.267 -5.553 1.00 . A A . 25 MET CG 1 1 9 3909 1 1 25 MET H H 5.749 -8.372 -2.714 1.00 . A A . 25 MET H 1 1 9 3910 1 1 25 MET HA H 5.780 -10.525 -4.605 1.00 . A A . 25 MET HA 1 1 9 3911 1 1 25 MET HB2 H 7.888 -8.526 -3.728 1.00 . A A . 25 MET HB2 1 1 9 3912 1 1 25 MET HB3 H 8.193 -9.755 -4.962 1.00 . A A . 25 MET HB3 1 1 9 3913 1 1 25 MET HE1 H 9.778 -8.188 -5.819 1.00 . A A . 25 MET HE1 1 1 9 3914 1 1 25 MET HE2 H 9.007 -8.447 -7.405 1.00 . A A . 25 MET HE2 1 1 9 3915 1 1 25 MET HE3 H 9.952 -6.972 -7.099 1.00 . A A . 25 MET HE3 1 1 9 3916 1 1 25 MET HG2 H 6.551 -8.879 -6.428 1.00 . A A . 25 MET HG2 1 1 9 3917 1 1 25 MET HG3 H 5.831 -7.870 -5.177 1.00 . A A . 25 MET HG3 1 1 9 3918 1 1 25 MET N N 5.544 -9.347 -2.904 1.00 . A A . 25 MET N 1 1 9 3919 1 1 25 MET O O 7.050 -12.377 -3.554 1.00 . A A . 25 MET O 1 1 9 3920 1 1 25 MET SD S 7.785 -6.854 -6.072 1.00 . A A . 25 MET SD 1 1 9 3921 1 1 26 ASN C C 7.668 -13.056 -0.699 1.00 . A A . 26 ASN C 1 1 9 3922 1 1 26 ASN CA C 8.561 -11.932 -1.232 1.00 . A A . 26 ASN CA 1 1 9 3923 1 1 26 ASN CB C 9.345 -11.268 -0.089 1.00 . A A . 26 ASN CB 1 1 9 3924 1 1 26 ASN CG C 10.689 -10.717 -0.563 1.00 . A A . 26 ASN CG 1 1 9 3925 1 1 26 ASN H H 7.797 -9.986 -1.649 1.00 . A A . 26 ASN H 1 1 9 3926 1 1 26 ASN HA H 9.283 -12.392 -1.909 1.00 . A A . 26 ASN HA 1 1 9 3927 1 1 26 ASN HB2 H 8.754 -10.476 0.372 1.00 . A A . 26 ASN HB2 1 1 9 3928 1 1 26 ASN HB3 H 9.555 -12.020 0.674 1.00 . A A . 26 ASN HB3 1 1 9 3929 1 1 26 ASN HD21 H 9.787 -9.221 -1.609 1.00 . A A . 26 ASN HD21 1 1 9 3930 1 1 26 ASN HD22 H 11.530 -9.254 -1.707 1.00 . A A . 26 ASN HD22 1 1 9 3931 1 1 26 ASN N N 7.796 -10.941 -1.983 1.00 . A A . 26 ASN N 1 1 9 3932 1 1 26 ASN ND2 N 10.668 -9.648 -1.358 1.00 . A A . 26 ASN ND2 1 1 9 3933 1 1 26 ASN O O 7.976 -14.228 -0.910 1.00 . A A . 26 ASN O 1 1 9 3934 1 1 26 ASN OD1 O 11.738 -11.253 -0.216 1.00 . A A . 26 ASN OD1 1 1 9 3935 1 1 27 THR C C 4.940 -14.510 -0.442 1.00 . A A . 27 THR C 1 1 9 3936 1 1 27 THR CA C 5.696 -13.699 0.612 1.00 . A A . 27 THR CA 1 1 9 3937 1 1 27 THR CB C 4.751 -13.025 1.620 1.00 . A A . 27 THR CB 1 1 9 3938 1 1 27 THR CG2 C 3.603 -12.240 0.979 1.00 . A A . 27 THR CG2 1 1 9 3939 1 1 27 THR H H 6.361 -11.734 0.121 1.00 . A A . 27 THR H 1 1 9 3940 1 1 27 THR HA H 6.326 -14.388 1.179 1.00 . A A . 27 THR HA 1 1 9 3941 1 1 27 THR HB H 5.342 -12.331 2.212 1.00 . A A . 27 THR HB 1 1 9 3942 1 1 27 THR HG1 H 3.725 -14.641 1.977 1.00 . A A . 27 THR HG1 1 1 9 3943 1 1 27 THR HG21 H 3.063 -11.696 1.753 1.00 . A A . 27 THR HG21 1 1 9 3944 1 1 27 THR HG22 H 4.001 -11.530 0.261 1.00 . A A . 27 THR HG22 1 1 9 3945 1 1 27 THR HG23 H 2.904 -12.910 0.478 1.00 . A A . 27 THR HG23 1 1 9 3946 1 1 27 THR N N 6.576 -12.713 -0.005 1.00 . A A . 27 THR N 1 1 9 3947 1 1 27 THR O O 4.735 -15.709 -0.271 1.00 . A A . 27 THR O 1 1 9 3948 1 1 27 THR OG1 O 4.209 -13.993 2.494 1.00 . A A . 27 THR OG1 1 1 9 3949 1 1 28 NH2 HN1 H 4.695 -12.874 -1.648 1.00 . A A . 28 NH2 HN1 1 1 9 3950 1 1 28 NH2 HN2 H 3.997 -14.367 -2.228 1.00 . A A . 28 NH2 HN2 1 1 9 3951 1 1 28 NH2 N N 4.516 -13.863 -1.530 1.00 . A A . 28 NH2 N 1 1 10 3952 1 1 1 SER C C -14.627 1.475 -1.072 1.00 . A A . 1 SER C 1 1 10 3953 1 1 1 SER CA C -15.474 0.924 -2.221 1.00 . A A . 1 SER CA 1 1 10 3954 1 1 1 SER CB C -14.661 0.009 -3.147 1.00 . A A . 1 SER CB 1 1 10 3955 1 1 1 SER H1 H -15.380 2.575 -3.418 1.00 . A A . 1 SER H1 1 1 10 3956 1 1 1 SER H2 H -16.692 1.620 -3.710 1.00 . A A . 1 SER H2 1 1 10 3957 1 1 1 SER H3 H -16.658 2.587 -2.374 1.00 . A A . 1 SER H3 1 1 10 3958 1 1 1 SER HA H -16.273 0.324 -1.784 1.00 . A A . 1 SER HA 1 1 10 3959 1 1 1 SER HB2 H -14.212 -0.799 -2.569 1.00 . A A . 1 SER HB2 1 1 10 3960 1 1 1 SER HB3 H -15.324 -0.430 -3.894 1.00 . A A . 1 SER HB3 1 1 10 3961 1 1 1 SER HG H -13.099 1.182 -3.162 1.00 . A A . 1 SER HG 1 1 10 3962 1 1 1 SER N N -16.102 2.012 -2.991 1.00 . A A . 1 SER N 1 1 10 3963 1 1 1 SER O O -13.412 1.289 -1.050 1.00 . A A . 1 SER O 1 1 10 3964 1 1 1 SER OG O -13.649 0.737 -3.816 1.00 . A A . 1 SER OG 1 1 10 3965 1 1 2 GLN C C -13.742 1.806 1.780 1.00 . A A . 2 GLN C 1 1 10 3966 1 1 2 GLN CA C -14.616 2.800 1.013 1.00 . A A . 2 GLN CA 1 1 10 3967 1 1 2 GLN CB C -15.666 3.455 1.919 1.00 . A A . 2 GLN CB 1 1 10 3968 1 1 2 GLN CD C -16.025 4.992 3.920 1.00 . A A . 2 GLN CD 1 1 10 3969 1 1 2 GLN CG C -15.006 4.269 3.041 1.00 . A A . 2 GLN CG 1 1 10 3970 1 1 2 GLN H H -16.278 2.258 -0.190 1.00 . A A . 2 GLN H 1 1 10 3971 1 1 2 GLN HA H -13.975 3.589 0.615 1.00 . A A . 2 GLN HA 1 1 10 3972 1 1 2 GLN HB2 H -16.279 4.125 1.314 1.00 . A A . 2 GLN HB2 1 1 10 3973 1 1 2 GLN HB3 H -16.309 2.687 2.352 1.00 . A A . 2 GLN HB3 1 1 10 3974 1 1 2 GLN HE21 H -14.537 5.894 4.980 1.00 . A A . 2 GLN HE21 1 1 10 3975 1 1 2 GLN HE22 H -16.169 6.291 5.477 1.00 . A A . 2 GLN HE22 1 1 10 3976 1 1 2 GLN HG2 H -14.417 3.610 3.678 1.00 . A A . 2 GLN HG2 1 1 10 3977 1 1 2 GLN HG3 H -14.343 5.012 2.596 1.00 . A A . 2 GLN HG3 1 1 10 3978 1 1 2 GLN N N -15.276 2.155 -0.116 1.00 . A A . 2 GLN N 1 1 10 3979 1 1 2 GLN NE2 N -15.535 5.791 4.870 1.00 . A A . 2 GLN NE2 1 1 10 3980 1 1 2 GLN O O -12.561 2.073 2.000 1.00 . A A . 2 GLN O 1 1 10 3981 1 1 2 GLN OE1 O -17.233 4.838 3.753 1.00 . A A . 2 GLN OE1 1 1 10 3982 1 1 3 GLY C C -12.712 -1.239 1.950 1.00 . A A . 3 GLY C 1 1 10 3983 1 1 3 GLY CA C -13.612 -0.409 2.871 1.00 . A A . 3 GLY CA 1 1 10 3984 1 1 3 GLY H H -15.282 0.497 1.925 1.00 . A A . 3 GLY H 1 1 10 3985 1 1 3 GLY HA2 H -13.003 0.023 3.666 1.00 . A A . 3 GLY HA2 1 1 10 3986 1 1 3 GLY HA3 H -14.355 -1.064 3.327 1.00 . A A . 3 GLY HA3 1 1 10 3987 1 1 3 GLY N N -14.312 0.653 2.157 1.00 . A A . 3 GLY N 1 1 10 3988 1 1 3 GLY O O -12.706 -2.467 2.029 1.00 . A A . 3 GLY O 1 1 10 3989 1 1 4 THR C C -9.944 -0.014 -0.106 1.00 . A A . 4 THR C 1 1 10 3990 1 1 4 THR CA C -10.929 -1.129 0.216 1.00 . A A . 4 THR CA 1 1 10 3991 1 1 4 THR CB C -11.536 -1.734 -1.067 1.00 . A A . 4 THR CB 1 1 10 3992 1 1 4 THR CG2 C -10.504 -2.612 -1.781 1.00 . A A . 4 THR CG2 1 1 10 3993 1 1 4 THR H H -12.008 0.445 1.104 1.00 . A A . 4 THR H 1 1 10 3994 1 1 4 THR HA H -10.395 -1.893 0.759 1.00 . A A . 4 THR HA 1 1 10 3995 1 1 4 THR HB H -11.837 -0.945 -1.756 1.00 . A A . 4 THR HB 1 1 10 3996 1 1 4 THR HG1 H -12.518 -2.999 0.039 1.00 . A A . 4 THR HG1 1 1 10 3997 1 1 4 THR HG21 H -10.947 -3.028 -2.687 1.00 . A A . 4 THR HG21 1 1 10 3998 1 1 4 THR HG22 H -9.631 -2.020 -2.056 1.00 . A A . 4 THR HG22 1 1 10 3999 1 1 4 THR HG23 H -10.193 -3.430 -1.130 1.00 . A A . 4 THR HG23 1 1 10 4000 1 1 4 THR N N -11.942 -0.562 1.092 1.00 . A A . 4 THR N 1 1 10 4001 1 1 4 THR O O -8.755 -0.107 0.185 1.00 . A A . 4 THR O 1 1 10 4002 1 1 4 THR OG1 O -12.675 -2.517 -0.778 1.00 . A A . 4 THR OG1 1 1 10 4003 1 1 5 THR C C -9.072 2.915 0.040 1.00 . A A . 5 THR C 1 1 10 4004 1 1 5 THR CA C -9.806 2.252 -1.128 1.00 . A A . 5 THR CA 1 1 10 4005 1 1 5 THR CB C -10.824 3.203 -1.776 1.00 . A A . 5 THR CB 1 1 10 4006 1 1 5 THR CG2 C -10.145 4.439 -2.374 1.00 . A A . 5 THR CG2 1 1 10 4007 1 1 5 THR H H -11.483 0.974 -0.858 1.00 . A A . 5 THR H 1 1 10 4008 1 1 5 THR HA H -9.076 1.971 -1.888 1.00 . A A . 5 THR HA 1 1 10 4009 1 1 5 THR HB H -11.552 3.525 -1.030 1.00 . A A . 5 THR HB 1 1 10 4010 1 1 5 THR HG1 H -10.878 2.252 -3.475 1.00 . A A . 5 THR HG1 1 1 10 4011 1 1 5 THR HG21 H -9.390 4.138 -3.100 1.00 . A A . 5 THR HG21 1 1 10 4012 1 1 5 THR HG22 H -10.893 5.057 -2.872 1.00 . A A . 5 THR HG22 1 1 10 4013 1 1 5 THR HG23 H -9.673 5.031 -1.589 1.00 . A A . 5 THR HG23 1 1 10 4014 1 1 5 THR N N -10.491 1.046 -0.697 1.00 . A A . 5 THR N 1 1 10 4015 1 1 5 THR O O -7.903 3.267 -0.100 1.00 . A A . 5 THR O 1 1 10 4016 1 1 5 THR OG1 O -11.512 2.519 -2.805 1.00 . A A . 5 THR OG1 1 1 10 4017 1 1 6 SER C C -7.926 3.013 2.896 1.00 . A A . 6 SER C 1 1 10 4018 1 1 6 SER CA C -9.170 3.733 2.360 1.00 . A A . 6 SER CA 1 1 10 4019 1 1 6 SER CB C -10.237 3.854 3.452 1.00 . A A . 6 SER CB 1 1 10 4020 1 1 6 SER H H -10.704 2.770 1.253 1.00 . A A . 6 SER H 1 1 10 4021 1 1 6 SER HA H -8.874 4.744 2.074 1.00 . A A . 6 SER HA 1 1 10 4022 1 1 6 SER HB2 H -10.571 2.862 3.760 1.00 . A A . 6 SER HB2 1 1 10 4023 1 1 6 SER HB3 H -9.816 4.369 4.317 1.00 . A A . 6 SER HB3 1 1 10 4024 1 1 6 SER HG H -11.036 5.461 2.700 1.00 . A A . 6 SER HG 1 1 10 4025 1 1 6 SER N N -9.743 3.082 1.187 1.00 . A A . 6 SER N 1 1 10 4026 1 1 6 SER O O -7.070 3.657 3.499 1.00 . A A . 6 SER O 1 1 10 4027 1 1 6 SER OG O -11.342 4.594 2.974 1.00 . A A . 6 SER OG 1 1 10 4028 1 1 7 GLU C C -5.613 0.867 2.056 1.00 . A A . 7 GLU C 1 1 10 4029 1 1 7 GLU CA C -6.695 0.888 3.138 1.00 . A A . 7 GLU CA 1 1 10 4030 1 1 7 GLU CB C -7.206 -0.520 3.480 1.00 . A A . 7 GLU CB 1 1 10 4031 1 1 7 GLU CD C -5.360 -0.925 5.178 1.00 . A A . 7 GLU CD 1 1 10 4032 1 1 7 GLU CG C -6.097 -1.465 3.954 1.00 . A A . 7 GLU CG 1 1 10 4033 1 1 7 GLU H H -8.519 1.231 2.119 1.00 . A A . 7 GLU H 1 1 10 4034 1 1 7 GLU HA H -6.278 1.330 4.044 1.00 . A A . 7 GLU HA 1 1 10 4035 1 1 7 GLU HB2 H -7.955 -0.438 4.269 1.00 . A A . 7 GLU HB2 1 1 10 4036 1 1 7 GLU HB3 H -7.680 -0.961 2.601 1.00 . A A . 7 GLU HB3 1 1 10 4037 1 1 7 GLU HG2 H -6.544 -2.427 4.209 1.00 . A A . 7 GLU HG2 1 1 10 4038 1 1 7 GLU HG3 H -5.394 -1.627 3.139 1.00 . A A . 7 GLU HG3 1 1 10 4039 1 1 7 GLU N N -7.818 1.695 2.680 1.00 . A A . 7 GLU N 1 1 10 4040 1 1 7 GLU O O -4.446 1.140 2.327 1.00 . A A . 7 GLU O 1 1 10 4041 1 1 7 GLU OE1 O -5.930 -1.047 6.283 1.00 . A A . 7 GLU OE1 1 1 10 4042 1 1 7 GLU OE2 O -4.242 -0.397 4.988 1.00 . A A . 7 GLU OE2 1 1 10 4043 1 1 8 TYR C C -4.386 1.821 -0.521 1.00 . A A . 8 TYR C 1 1 10 4044 1 1 8 TYR CA C -5.197 0.533 -0.369 1.00 . A A . 8 TYR CA 1 1 10 4045 1 1 8 TYR CB C -6.112 0.320 -1.577 1.00 . A A . 8 TYR CB 1 1 10 4046 1 1 8 TYR CD1 C -4.612 -0.566 -3.405 1.00 . A A . 8 TYR CD1 1 1 10 4047 1 1 8 TYR CD2 C -5.560 1.664 -3.646 1.00 . A A . 8 TYR CD2 1 1 10 4048 1 1 8 TYR CE1 C -3.996 -0.439 -4.660 1.00 . A A . 8 TYR CE1 1 1 10 4049 1 1 8 TYR CE2 C -4.942 1.792 -4.900 1.00 . A A . 8 TYR CE2 1 1 10 4050 1 1 8 TYR CG C -5.422 0.471 -2.913 1.00 . A A . 8 TYR CG 1 1 10 4051 1 1 8 TYR CZ C -4.165 0.737 -5.412 1.00 . A A . 8 TYR CZ 1 1 10 4052 1 1 8 TYR H H -7.001 0.327 0.701 1.00 . A A . 8 TYR H 1 1 10 4053 1 1 8 TYR HA H -4.508 -0.307 -0.304 1.00 . A A . 8 TYR HA 1 1 10 4054 1 1 8 TYR HB2 H -6.548 -0.679 -1.517 1.00 . A A . 8 TYR HB2 1 1 10 4055 1 1 8 TYR HB3 H -6.927 1.041 -1.530 1.00 . A A . 8 TYR HB3 1 1 10 4056 1 1 8 TYR HD1 H -4.465 -1.464 -2.823 1.00 . A A . 8 TYR HD1 1 1 10 4057 1 1 8 TYR HD2 H -6.139 2.486 -3.251 1.00 . A A . 8 TYR HD2 1 1 10 4058 1 1 8 TYR HE1 H -3.399 -1.253 -5.041 1.00 . A A . 8 TYR HE1 1 1 10 4059 1 1 8 TYR HE2 H -5.078 2.704 -5.462 1.00 . A A . 8 TYR HE2 1 1 10 4060 1 1 8 TYR HH H -3.749 1.693 -7.065 1.00 . A A . 8 TYR HH 1 1 10 4061 1 1 8 TYR N N -6.024 0.550 0.825 1.00 . A A . 8 TYR N 1 1 10 4062 1 1 8 TYR O O -3.185 1.760 -0.775 1.00 . A A . 8 TYR O 1 1 10 4063 1 1 8 TYR OH O -3.576 0.851 -6.638 1.00 . A A . 8 TYR OH 1 1 10 4064 1 1 9 SER C C -3.258 4.550 0.382 1.00 . A A . 9 SER C 1 1 10 4065 1 1 9 SER CA C -4.475 4.304 -0.516 1.00 . A A . 9 SER CA 1 1 10 4066 1 1 9 SER CB C -5.552 5.369 -0.284 1.00 . A A . 9 SER CB 1 1 10 4067 1 1 9 SER H H -6.037 2.925 -0.149 1.00 . A A . 9 SER H 1 1 10 4068 1 1 9 SER HA H -4.150 4.403 -1.552 1.00 . A A . 9 SER HA 1 1 10 4069 1 1 9 SER HB2 H -5.104 6.361 -0.352 1.00 . A A . 9 SER HB2 1 1 10 4070 1 1 9 SER HB3 H -6.324 5.283 -1.049 1.00 . A A . 9 SER HB3 1 1 10 4071 1 1 9 SER HG H -6.685 4.420 0.977 1.00 . A A . 9 SER HG 1 1 10 4072 1 1 9 SER N N -5.051 2.973 -0.364 1.00 . A A . 9 SER N 1 1 10 4073 1 1 9 SER O O -2.480 5.461 0.104 1.00 . A A . 9 SER O 1 1 10 4074 1 1 9 SER OG O -6.145 5.215 0.988 1.00 . A A . 9 SER OG 1 1 10 4075 1 1 10 LYS C C -0.707 3.275 1.437 1.00 . A A . 10 LYS C 1 1 10 4076 1 1 10 LYS CA C -1.874 3.821 2.256 1.00 . A A . 10 LYS CA 1 1 10 4077 1 1 10 LYS CB C -2.079 3.064 3.574 1.00 . A A . 10 LYS CB 1 1 10 4078 1 1 10 LYS CD C -3.359 4.981 4.770 1.00 . A A . 10 LYS CD 1 1 10 4079 1 1 10 LYS CE C -4.061 5.888 3.746 1.00 . A A . 10 LYS CE 1 1 10 4080 1 1 10 LYS CG C -3.328 3.499 4.361 1.00 . A A . 10 LYS CG 1 1 10 4081 1 1 10 LYS H H -3.719 3.007 1.647 1.00 . A A . 10 LYS H 1 1 10 4082 1 1 10 LYS HA H -1.650 4.860 2.498 1.00 . A A . 10 LYS HA 1 1 10 4083 1 1 10 LYS HB2 H -2.165 1.997 3.368 1.00 . A A . 10 LYS HB2 1 1 10 4084 1 1 10 LYS HB3 H -1.201 3.214 4.202 1.00 . A A . 10 LYS HB3 1 1 10 4085 1 1 10 LYS HD2 H -3.931 5.044 5.698 1.00 . A A . 10 LYS HD2 1 1 10 4086 1 1 10 LYS HD3 H -2.349 5.341 4.968 1.00 . A A . 10 LYS HD3 1 1 10 4087 1 1 10 LYS HE2 H -3.463 6.012 2.847 1.00 . A A . 10 LYS HE2 1 1 10 4088 1 1 10 LYS HE3 H -5.021 5.456 3.468 1.00 . A A . 10 LYS HE3 1 1 10 4089 1 1 10 LYS HG2 H -4.236 3.256 3.810 1.00 . A A . 10 LYS HG2 1 1 10 4090 1 1 10 LYS HG3 H -3.336 2.904 5.276 1.00 . A A . 10 LYS HG3 1 1 10 4091 1 1 10 LYS HZ1 H -4.886 7.153 5.124 1.00 . A A . 10 LYS HZ1 1 1 10 4092 1 1 10 LYS HZ2 H -3.423 7.656 4.551 1.00 . A A . 10 LYS HZ2 1 1 10 4093 1 1 10 LYS HZ3 H -4.771 7.798 3.611 1.00 . A A . 10 LYS HZ3 1 1 10 4094 1 1 10 LYS N N -3.067 3.748 1.438 1.00 . A A . 10 LYS N 1 1 10 4095 1 1 10 LYS NZ N -4.304 7.228 4.302 1.00 . A A . 10 LYS NZ 1 1 10 4096 1 1 10 LYS O O 0.231 4.014 1.149 1.00 . A A . 10 LYS O 1 1 10 4097 1 1 11 TYR C C 0.074 1.612 -1.218 1.00 . A A . 11 TYR C 1 1 10 4098 1 1 11 TYR CA C 0.279 1.344 0.269 1.00 . A A . 11 TYR CA 1 1 10 4099 1 1 11 TYR CB C 0.352 -0.138 0.636 1.00 . A A . 11 TYR CB 1 1 10 4100 1 1 11 TYR CD1 C -1.523 -1.531 -0.369 1.00 . A A . 11 TYR CD1 1 1 10 4101 1 1 11 TYR CD2 C -1.555 -1.052 2.016 1.00 . A A . 11 TYR CD2 1 1 10 4102 1 1 11 TYR CE1 C -2.662 -2.341 -0.222 1.00 . A A . 11 TYR CE1 1 1 10 4103 1 1 11 TYR CE2 C -2.675 -1.886 2.167 1.00 . A A . 11 TYR CE2 1 1 10 4104 1 1 11 TYR CG C -0.966 -0.883 0.749 1.00 . A A . 11 TYR CG 1 1 10 4105 1 1 11 TYR CZ C -3.236 -2.522 1.048 1.00 . A A . 11 TYR CZ 1 1 10 4106 1 1 11 TYR H H -1.637 1.499 1.110 1.00 . A A . 11 TYR H 1 1 10 4107 1 1 11 TYR HA H 1.241 1.777 0.546 1.00 . A A . 11 TYR HA 1 1 10 4108 1 1 11 TYR HB2 H 0.985 -0.636 -0.094 1.00 . A A . 11 TYR HB2 1 1 10 4109 1 1 11 TYR HB3 H 0.850 -0.190 1.604 1.00 . A A . 11 TYR HB3 1 1 10 4110 1 1 11 TYR HD1 H -1.066 -1.439 -1.342 1.00 . A A . 11 TYR HD1 1 1 10 4111 1 1 11 TYR HD2 H -1.137 -0.556 2.880 1.00 . A A . 11 TYR HD2 1 1 10 4112 1 1 11 TYR HE1 H -3.083 -2.835 -1.086 1.00 . A A . 11 TYR HE1 1 1 10 4113 1 1 11 TYR HE2 H -3.092 -2.047 3.150 1.00 . A A . 11 TYR HE2 1 1 10 4114 1 1 11 TYR HH H -4.635 -3.704 0.370 1.00 . A A . 11 TYR HH 1 1 10 4115 1 1 11 TYR N N -0.772 2.004 1.022 1.00 . A A . 11 TYR N 1 1 10 4116 1 1 11 TYR O O -0.021 0.708 -2.045 1.00 . A A . 11 TYR O 1 1 10 4117 1 1 11 TYR OH O -4.335 -3.316 1.195 1.00 . A A . 11 TYR OH 1 1 10 4118 1 1 12 LEU C C 0.795 4.675 -2.936 1.00 . A A . 12 LEU C 1 1 10 4119 1 1 12 LEU CA C -0.162 3.484 -2.834 1.00 . A A . 12 LEU CA 1 1 10 4120 1 1 12 LEU CB C -1.640 3.873 -2.955 1.00 . A A . 12 LEU CB 1 1 10 4121 1 1 12 LEU CD1 C -1.735 5.998 -4.398 1.00 . A A . 12 LEU CD1 1 1 10 4122 1 1 12 LEU CD2 C -1.676 3.725 -5.492 1.00 . A A . 12 LEU CD2 1 1 10 4123 1 1 12 LEU CG C -2.123 4.520 -4.262 1.00 . A A . 12 LEU CG 1 1 10 4124 1 1 12 LEU H H 0.130 3.551 -0.754 1.00 . A A . 12 LEU H 1 1 10 4125 1 1 12 LEU HA H 0.078 2.723 -3.570 1.00 . A A . 12 LEU HA 1 1 10 4126 1 1 12 LEU HB2 H -2.214 2.954 -2.827 1.00 . A A . 12 LEU HB2 1 1 10 4127 1 1 12 LEU HB3 H -1.884 4.539 -2.133 1.00 . A A . 12 LEU HB3 1 1 10 4128 1 1 12 LEU HD11 H -0.674 6.113 -4.610 1.00 . A A . 12 LEU HD11 1 1 10 4129 1 1 12 LEU HD12 H -2.296 6.439 -5.223 1.00 . A A . 12 LEU HD12 1 1 10 4130 1 1 12 LEU HD13 H -1.982 6.535 -3.482 1.00 . A A . 12 LEU HD13 1 1 10 4131 1 1 12 LEU HD21 H -2.182 4.107 -6.379 1.00 . A A . 12 LEU HD21 1 1 10 4132 1 1 12 LEU HD22 H -0.599 3.817 -5.633 1.00 . A A . 12 LEU HD22 1 1 10 4133 1 1 12 LEU HD23 H -1.930 2.673 -5.362 1.00 . A A . 12 LEU HD23 1 1 10 4134 1 1 12 LEU HG H -3.213 4.493 -4.210 1.00 . A A . 12 LEU HG 1 1 10 4135 1 1 12 LEU N N 0.022 2.905 -1.523 1.00 . A A . 12 LEU N 1 1 10 4136 1 1 12 LEU O O 1.485 4.834 -3.939 1.00 . A A . 12 LEU O 1 1 10 4137 1 1 13 ASP C C 3.075 6.581 -2.135 1.00 . A A . 13 ASP C 1 1 10 4138 1 1 13 ASP CA C 1.628 6.672 -1.639 1.00 . A A . 13 ASP CA 1 1 10 4139 1 1 13 ASP CB C 1.503 7.029 -0.149 1.00 . A A . 13 ASP CB 1 1 10 4140 1 1 13 ASP CG C 2.276 8.292 0.227 1.00 . A A . 13 ASP CG 1 1 10 4141 1 1 13 ASP H H 0.195 5.250 -1.109 1.00 . A A . 13 ASP H 1 1 10 4142 1 1 13 ASP HA H 1.190 7.481 -2.203 1.00 . A A . 13 ASP HA 1 1 10 4143 1 1 13 ASP HB2 H 0.448 7.189 0.081 1.00 . A A . 13 ASP HB2 1 1 10 4144 1 1 13 ASP HB3 H 1.845 6.188 0.458 1.00 . A A . 13 ASP HB3 1 1 10 4145 1 1 13 ASP N N 0.826 5.480 -1.863 1.00 . A A . 13 ASP N 1 1 10 4146 1 1 13 ASP O O 3.354 6.922 -3.283 1.00 . A A . 13 ASP O 1 1 10 4147 1 1 13 ASP OD1 O 1.958 9.351 -0.356 1.00 . A A . 13 ASP OD1 1 1 10 4148 1 1 13 ASP OD2 O 3.172 8.174 1.090 1.00 . A A . 13 ASP OD2 1 1 10 4149 1 1 14 SER C C 6.147 5.058 -0.777 1.00 . A A . 14 SER C 1 1 10 4150 1 1 14 SER CA C 5.427 6.178 -1.534 1.00 . A A . 14 SER CA 1 1 10 4151 1 1 14 SER CB C 6.009 7.576 -1.272 1.00 . A A . 14 SER CB 1 1 10 4152 1 1 14 SER H H 3.661 5.937 -0.341 1.00 . A A . 14 SER H 1 1 10 4153 1 1 14 SER HA H 5.582 5.966 -2.593 1.00 . A A . 14 SER HA 1 1 10 4154 1 1 14 SER HB2 H 7.077 7.573 -1.495 1.00 . A A . 14 SER HB2 1 1 10 4155 1 1 14 SER HB3 H 5.524 8.301 -1.927 1.00 . A A . 14 SER HB3 1 1 10 4156 1 1 14 SER HG H 4.875 8.060 0.239 1.00 . A A . 14 SER HG 1 1 10 4157 1 1 14 SER N N 3.994 6.168 -1.261 1.00 . A A . 14 SER N 1 1 10 4158 1 1 14 SER O O 6.067 3.910 -1.204 1.00 . A A . 14 SER O 1 1 10 4159 1 1 14 SER OG O 5.818 7.978 0.070 1.00 . A A . 14 SER OG 1 1 10 4160 1 1 15 ARG C C 6.925 3.176 1.406 1.00 . A A . 15 ARG C 1 1 10 4161 1 1 15 ARG CA C 7.703 4.441 1.056 1.00 . A A . 15 ARG CA 1 1 10 4162 1 1 15 ARG CB C 8.271 5.136 2.306 1.00 . A A . 15 ARG CB 1 1 10 4163 1 1 15 ARG CD C 8.863 3.085 3.776 1.00 . A A . 15 ARG CD 1 1 10 4164 1 1 15 ARG CG C 9.362 4.344 3.047 1.00 . A A . 15 ARG CG 1 1 10 4165 1 1 15 ARG CZ C 10.027 3.087 5.991 1.00 . A A . 15 ARG CZ 1 1 10 4166 1 1 15 ARG H H 6.849 6.341 0.617 1.00 . A A . 15 ARG H 1 1 10 4167 1 1 15 ARG HA H 8.541 4.168 0.412 1.00 . A A . 15 ARG HA 1 1 10 4168 1 1 15 ARG HB2 H 8.728 6.072 1.981 1.00 . A A . 15 ARG HB2 1 1 10 4169 1 1 15 ARG HB3 H 7.468 5.382 3.001 1.00 . A A . 15 ARG HB3 1 1 10 4170 1 1 15 ARG HD2 H 7.912 3.281 4.275 1.00 . A A . 15 ARG HD2 1 1 10 4171 1 1 15 ARG HD3 H 8.716 2.277 3.062 1.00 . A A . 15 ARG HD3 1 1 10 4172 1 1 15 ARG HE H 10.431 1.827 4.456 1.00 . A A . 15 ARG HE 1 1 10 4173 1 1 15 ARG HG2 H 10.153 4.066 2.349 1.00 . A A . 15 ARG HG2 1 1 10 4174 1 1 15 ARG HG3 H 9.790 5.020 3.788 1.00 . A A . 15 ARG HG3 1 1 10 4175 1 1 15 ARG HH11 H 8.597 4.544 5.856 1.00 . A A . 15 ARG HH11 1 1 10 4176 1 1 15 ARG HH12 H 9.444 4.464 7.383 1.00 . A A . 15 ARG HH12 1 1 10 4177 1 1 15 ARG HH21 H 11.512 1.763 6.455 1.00 . A A . 15 ARG HH21 1 1 10 4178 1 1 15 ARG HH22 H 11.096 2.896 7.720 1.00 . A A . 15 ARG HH22 1 1 10 4179 1 1 15 ARG N N 6.860 5.376 0.314 1.00 . A A . 15 ARG N 1 1 10 4180 1 1 15 ARG NE N 9.849 2.600 4.751 1.00 . A A . 15 ARG NE 1 1 10 4181 1 1 15 ARG NH1 N 9.295 4.115 6.447 1.00 . A A . 15 ARG NH1 1 1 10 4182 1 1 15 ARG NH2 N 10.954 2.537 6.787 1.00 . A A . 15 ARG NH2 1 1 10 4183 1 1 15 ARG O O 7.290 2.086 0.969 1.00 . A A . 15 ARG O 1 1 10 4184 1 1 16 ARG C C 4.461 1.436 1.407 1.00 . A A . 16 ARG C 1 1 10 4185 1 1 16 ARG CA C 4.981 2.244 2.600 1.00 . A A . 16 ARG CA 1 1 10 4186 1 1 16 ARG CB C 3.843 2.767 3.489 1.00 . A A . 16 ARG CB 1 1 10 4187 1 1 16 ARG CD C 1.856 4.285 3.752 1.00 . A A . 16 ARG CD 1 1 10 4188 1 1 16 ARG CG C 3.030 3.898 2.847 1.00 . A A . 16 ARG CG 1 1 10 4189 1 1 16 ARG CZ C 1.502 6.765 3.609 1.00 . A A . 16 ARG CZ 1 1 10 4190 1 1 16 ARG H H 5.625 4.265 2.506 1.00 . A A . 16 ARG H 1 1 10 4191 1 1 16 ARG HA H 5.576 1.567 3.215 1.00 . A A . 16 ARG HA 1 1 10 4192 1 1 16 ARG HB2 H 3.177 1.936 3.727 1.00 . A A . 16 ARG HB2 1 1 10 4193 1 1 16 ARG HB3 H 4.274 3.138 4.420 1.00 . A A . 16 ARG HB3 1 1 10 4194 1 1 16 ARG HD2 H 1.130 3.471 3.744 1.00 . A A . 16 ARG HD2 1 1 10 4195 1 1 16 ARG HD3 H 2.191 4.422 4.780 1.00 . A A . 16 ARG HD3 1 1 10 4196 1 1 16 ARG HE H 0.447 5.360 2.602 1.00 . A A . 16 ARG HE 1 1 10 4197 1 1 16 ARG HG2 H 3.663 4.772 2.699 1.00 . A A . 16 ARG HG2 1 1 10 4198 1 1 16 ARG HG3 H 2.644 3.573 1.882 1.00 . A A . 16 ARG HG3 1 1 10 4199 1 1 16 ARG HH11 H 3.120 6.291 4.768 1.00 . A A . 16 ARG HH11 1 1 10 4200 1 1 16 ARG HH12 H 2.756 7.995 4.651 1.00 . A A . 16 ARG HH12 1 1 10 4201 1 1 16 ARG HH21 H -0.026 7.579 2.524 1.00 . A A . 16 ARG HH21 1 1 10 4202 1 1 16 ARG HH22 H 0.983 8.726 3.374 1.00 . A A . 16 ARG HH22 1 1 10 4203 1 1 16 ARG N N 5.849 3.335 2.185 1.00 . A A . 16 ARG N 1 1 10 4204 1 1 16 ARG NE N 1.191 5.503 3.271 1.00 . A A . 16 ARG NE 1 1 10 4205 1 1 16 ARG NH1 N 2.543 7.038 4.410 1.00 . A A . 16 ARG NH1 1 1 10 4206 1 1 16 ARG NH2 N 0.758 7.772 3.132 1.00 . A A . 16 ARG NH2 1 1 10 4207 1 1 16 ARG O O 4.279 0.229 1.534 1.00 . A A . 16 ARG O 1 1 10 4208 1 1 17 ALA C C 4.872 0.509 -1.538 1.00 . A A . 17 ALA C 1 1 10 4209 1 1 17 ALA CA C 3.782 1.409 -0.953 1.00 . A A . 17 ALA CA 1 1 10 4210 1 1 17 ALA CB C 3.283 2.441 -1.966 1.00 . A A . 17 ALA CB 1 1 10 4211 1 1 17 ALA H H 4.439 3.067 0.193 1.00 . A A . 17 ALA H 1 1 10 4212 1 1 17 ALA HA H 2.934 0.776 -0.693 1.00 . A A . 17 ALA HA 1 1 10 4213 1 1 17 ALA HB1 H 2.731 1.939 -2.761 1.00 . A A . 17 ALA HB1 1 1 10 4214 1 1 17 ALA HB2 H 2.633 3.151 -1.460 1.00 . A A . 17 ALA HB2 1 1 10 4215 1 1 17 ALA HB3 H 4.108 2.989 -2.407 1.00 . A A . 17 ALA HB3 1 1 10 4216 1 1 17 ALA N N 4.240 2.079 0.254 1.00 . A A . 17 ALA N 1 1 10 4217 1 1 17 ALA O O 4.589 -0.635 -1.887 1.00 . A A . 17 ALA O 1 1 10 4218 1 1 18 GLN C C 7.566 -0.941 -1.235 1.00 . A A . 18 GLN C 1 1 10 4219 1 1 18 GLN CA C 7.221 0.219 -2.172 1.00 . A A . 18 GLN CA 1 1 10 4220 1 1 18 GLN CB C 8.479 1.069 -2.421 1.00 . A A . 18 GLN CB 1 1 10 4221 1 1 18 GLN CD C 7.205 2.360 -4.244 1.00 . A A . 18 GLN CD 1 1 10 4222 1 1 18 GLN CG C 8.281 2.399 -3.161 1.00 . A A . 18 GLN CG 1 1 10 4223 1 1 18 GLN H H 6.297 1.951 -1.326 1.00 . A A . 18 GLN H 1 1 10 4224 1 1 18 GLN HA H 6.895 -0.201 -3.122 1.00 . A A . 18 GLN HA 1 1 10 4225 1 1 18 GLN HB2 H 8.960 1.291 -1.468 1.00 . A A . 18 GLN HB2 1 1 10 4226 1 1 18 GLN HB3 H 9.167 0.458 -3.008 1.00 . A A . 18 GLN HB3 1 1 10 4227 1 1 18 GLN HE21 H 6.063 3.680 -3.205 1.00 . A A . 18 GLN HE21 1 1 10 4228 1 1 18 GLN HE22 H 5.393 3.166 -4.739 1.00 . A A . 18 GLN HE22 1 1 10 4229 1 1 18 GLN HG2 H 8.046 3.170 -2.431 1.00 . A A . 18 GLN HG2 1 1 10 4230 1 1 18 GLN HG3 H 9.228 2.678 -3.625 1.00 . A A . 18 GLN HG3 1 1 10 4231 1 1 18 GLN N N 6.114 1.006 -1.638 1.00 . A A . 18 GLN N 1 1 10 4232 1 1 18 GLN NE2 N 6.136 3.137 -4.056 1.00 . A A . 18 GLN NE2 1 1 10 4233 1 1 18 GLN O O 7.865 -2.044 -1.689 1.00 . A A . 18 GLN O 1 1 10 4234 1 1 18 GLN OE1 O 7.340 1.647 -5.235 1.00 . A A . 18 GLN OE1 1 1 10 4235 1 1 19 ASP C C 6.728 -2.768 1.039 1.00 . A A . 19 ASP C 1 1 10 4236 1 1 19 ASP CA C 7.792 -1.676 1.104 1.00 . A A . 19 ASP CA 1 1 10 4237 1 1 19 ASP CB C 7.811 -0.987 2.473 1.00 . A A . 19 ASP CB 1 1 10 4238 1 1 19 ASP CG C 8.084 -1.981 3.598 1.00 . A A . 19 ASP CG 1 1 10 4239 1 1 19 ASP H H 7.228 0.233 0.372 1.00 . A A . 19 ASP H 1 1 10 4240 1 1 19 ASP HA H 8.773 -2.118 0.922 1.00 . A A . 19 ASP HA 1 1 10 4241 1 1 19 ASP HB2 H 8.593 -0.226 2.478 1.00 . A A . 19 ASP HB2 1 1 10 4242 1 1 19 ASP HB3 H 6.854 -0.497 2.652 1.00 . A A . 19 ASP HB3 1 1 10 4243 1 1 19 ASP N N 7.522 -0.686 0.075 1.00 . A A . 19 ASP N 1 1 10 4244 1 1 19 ASP O O 7.051 -3.954 1.033 1.00 . A A . 19 ASP O 1 1 10 4245 1 1 19 ASP OD1 O 9.278 -2.279 3.817 1.00 . A A . 19 ASP OD1 1 1 10 4246 1 1 19 ASP OD2 O 7.093 -2.428 4.216 1.00 . A A . 19 ASP OD2 1 1 10 4247 1 1 20 PHE C C 4.423 -4.104 -0.403 1.00 . A A . 20 PHE C 1 1 10 4248 1 1 20 PHE CA C 4.326 -3.252 0.860 1.00 . A A . 20 PHE CA 1 1 10 4249 1 1 20 PHE CB C 3.021 -2.453 0.888 1.00 . A A . 20 PHE CB 1 1 10 4250 1 1 20 PHE CD1 C 1.167 -3.793 1.969 1.00 . A A . 20 PHE CD1 1 1 10 4251 1 1 20 PHE CD2 C 1.226 -3.625 -0.460 1.00 . A A . 20 PHE CD2 1 1 10 4252 1 1 20 PHE CE1 C 0.015 -4.594 1.885 1.00 . A A . 20 PHE CE1 1 1 10 4253 1 1 20 PHE CE2 C 0.083 -4.438 -0.544 1.00 . A A . 20 PHE CE2 1 1 10 4254 1 1 20 PHE CG C 1.772 -3.305 0.797 1.00 . A A . 20 PHE CG 1 1 10 4255 1 1 20 PHE CZ C -0.523 -4.922 0.628 1.00 . A A . 20 PHE CZ 1 1 10 4256 1 1 20 PHE H H 5.265 -1.362 1.000 1.00 . A A . 20 PHE H 1 1 10 4257 1 1 20 PHE HA H 4.328 -3.913 1.728 1.00 . A A . 20 PHE HA 1 1 10 4258 1 1 20 PHE HB2 H 2.976 -1.893 1.821 1.00 . A A . 20 PHE HB2 1 1 10 4259 1 1 20 PHE HB3 H 3.029 -1.742 0.062 1.00 . A A . 20 PHE HB3 1 1 10 4260 1 1 20 PHE HD1 H 1.586 -3.551 2.936 1.00 . A A . 20 PHE HD1 1 1 10 4261 1 1 20 PHE HD2 H 1.685 -3.243 -1.361 1.00 . A A . 20 PHE HD2 1 1 10 4262 1 1 20 PHE HE1 H -0.454 -4.963 2.786 1.00 . A A . 20 PHE HE1 1 1 10 4263 1 1 20 PHE HE2 H -0.337 -4.679 -1.509 1.00 . A A . 20 PHE HE2 1 1 10 4264 1 1 20 PHE HZ H -1.406 -5.541 0.564 1.00 . A A . 20 PHE HZ 1 1 10 4265 1 1 20 PHE N N 5.458 -2.354 0.975 1.00 . A A . 20 PHE N 1 1 10 4266 1 1 20 PHE O O 4.198 -5.308 -0.322 1.00 . A A . 20 PHE O 1 1 10 4267 1 1 21 VAL C C 5.916 -5.293 -2.795 1.00 . A A . 21 VAL C 1 1 10 4268 1 1 21 VAL CA C 4.739 -4.318 -2.790 1.00 . A A . 21 VAL CA 1 1 10 4269 1 1 21 VAL CB C 4.617 -3.457 -4.061 1.00 . A A . 21 VAL CB 1 1 10 4270 1 1 21 VAL CG1 C 5.932 -2.793 -4.472 1.00 . A A . 21 VAL CG1 1 1 10 4271 1 1 21 VAL CG2 C 4.106 -4.304 -5.234 1.00 . A A . 21 VAL CG2 1 1 10 4272 1 1 21 VAL H H 4.992 -2.532 -1.610 1.00 . A A . 21 VAL H 1 1 10 4273 1 1 21 VAL HA H 3.837 -4.928 -2.751 1.00 . A A . 21 VAL HA 1 1 10 4274 1 1 21 VAL HB H 3.879 -2.675 -3.872 1.00 . A A . 21 VAL HB 1 1 10 4275 1 1 21 VAL HG11 H 6.331 -2.250 -3.625 1.00 . A A . 21 VAL HG11 1 1 10 4276 1 1 21 VAL HG12 H 6.659 -3.537 -4.799 1.00 . A A . 21 VAL HG12 1 1 10 4277 1 1 21 VAL HG13 H 5.752 -2.093 -5.288 1.00 . A A . 21 VAL HG13 1 1 10 4278 1 1 21 VAL HG21 H 3.140 -4.743 -4.985 1.00 . A A . 21 VAL HG21 1 1 10 4279 1 1 21 VAL HG22 H 3.986 -3.674 -6.115 1.00 . A A . 21 VAL HG22 1 1 10 4280 1 1 21 VAL HG23 H 4.813 -5.102 -5.463 1.00 . A A . 21 VAL HG23 1 1 10 4281 1 1 21 VAL N N 4.744 -3.519 -1.567 1.00 . A A . 21 VAL N 1 1 10 4282 1 1 21 VAL O O 5.754 -6.446 -3.186 1.00 . A A . 21 VAL O 1 1 10 4283 1 1 22 GLN C C 7.884 -6.891 -1.221 1.00 . A A . 22 GLN C 1 1 10 4284 1 1 22 GLN CA C 8.241 -5.715 -2.135 1.00 . A A . 22 GLN CA 1 1 10 4285 1 1 22 GLN CB C 9.406 -4.890 -1.567 1.00 . A A . 22 GLN CB 1 1 10 4286 1 1 22 GLN CD C 11.228 -6.361 -2.573 1.00 . A A . 22 GLN CD 1 1 10 4287 1 1 22 GLN CG C 10.681 -5.704 -1.307 1.00 . A A . 22 GLN CG 1 1 10 4288 1 1 22 GLN H H 7.173 -3.883 -2.034 1.00 . A A . 22 GLN H 1 1 10 4289 1 1 22 GLN HA H 8.527 -6.101 -3.114 1.00 . A A . 22 GLN HA 1 1 10 4290 1 1 22 GLN HB2 H 9.644 -4.090 -2.269 1.00 . A A . 22 GLN HB2 1 1 10 4291 1 1 22 GLN HB3 H 9.097 -4.439 -0.623 1.00 . A A . 22 GLN HB3 1 1 10 4292 1 1 22 GLN HE21 H 10.130 -8.044 -2.245 1.00 . A A . 22 GLN HE21 1 1 10 4293 1 1 22 GLN HE22 H 11.135 -8.063 -3.683 1.00 . A A . 22 GLN HE22 1 1 10 4294 1 1 22 GLN HG2 H 11.441 -5.024 -0.920 1.00 . A A . 22 GLN HG2 1 1 10 4295 1 1 22 GLN HG3 H 10.494 -6.459 -0.545 1.00 . A A . 22 GLN HG3 1 1 10 4296 1 1 22 GLN N N 7.088 -4.849 -2.325 1.00 . A A . 22 GLN N 1 1 10 4297 1 1 22 GLN NE2 N 10.800 -7.593 -2.855 1.00 . A A . 22 GLN NE2 1 1 10 4298 1 1 22 GLN O O 8.266 -8.024 -1.504 1.00 . A A . 22 GLN O 1 1 10 4299 1 1 22 GLN OE1 O 12.032 -5.766 -3.286 1.00 . A A . 22 GLN OE1 1 1 10 4300 1 1 23 TRP C C 5.859 -8.658 0.218 1.00 . A A . 23 TRP C 1 1 10 4301 1 1 23 TRP CA C 6.795 -7.633 0.848 1.00 . A A . 23 TRP CA 1 1 10 4302 1 1 23 TRP CB C 6.124 -6.957 2.045 1.00 . A A . 23 TRP CB 1 1 10 4303 1 1 23 TRP CD1 C 5.797 -8.855 3.667 1.00 . A A . 23 TRP CD1 1 1 10 4304 1 1 23 TRP CD2 C 3.869 -8.104 2.821 1.00 . A A . 23 TRP CD2 1 1 10 4305 1 1 23 TRP CE2 C 3.546 -9.193 3.678 1.00 . A A . 23 TRP CE2 1 1 10 4306 1 1 23 TRP CE3 C 2.819 -7.521 2.086 1.00 . A A . 23 TRP CE3 1 1 10 4307 1 1 23 TRP CG C 5.305 -7.891 2.868 1.00 . A A . 23 TRP CG 1 1 10 4308 1 1 23 TRP CH2 C 1.200 -9.031 3.114 1.00 . A A . 23 TRP CH2 1 1 10 4309 1 1 23 TRP CZ2 C 2.231 -9.651 3.837 1.00 . A A . 23 TRP CZ2 1 1 10 4310 1 1 23 TRP CZ3 C 1.495 -7.975 2.231 1.00 . A A . 23 TRP CZ3 1 1 10 4311 1 1 23 TRP H H 6.727 -5.714 -0.014 1.00 . A A . 23 TRP H 1 1 10 4312 1 1 23 TRP HA H 7.699 -8.140 1.192 1.00 . A A . 23 TRP HA 1 1 10 4313 1 1 23 TRP HB2 H 6.880 -6.486 2.672 1.00 . A A . 23 TRP HB2 1 1 10 4314 1 1 23 TRP HB3 H 5.449 -6.177 1.695 1.00 . A A . 23 TRP HB3 1 1 10 4315 1 1 23 TRP HD1 H 6.853 -9.013 3.804 1.00 . A A . 23 TRP HD1 1 1 10 4316 1 1 23 TRP HE1 H 4.851 -10.386 4.822 1.00 . A A . 23 TRP HE1 1 1 10 4317 1 1 23 TRP HE3 H 3.068 -6.739 1.382 1.00 . A A . 23 TRP HE3 1 1 10 4318 1 1 23 TRP HH2 H 0.186 -9.377 3.230 1.00 . A A . 23 TRP HH2 1 1 10 4319 1 1 23 TRP HZ2 H 2.015 -10.479 4.498 1.00 . A A . 23 TRP HZ2 1 1 10 4320 1 1 23 TRP HZ3 H 0.704 -7.518 1.656 1.00 . A A . 23 TRP HZ3 1 1 10 4321 1 1 23 TRP N N 7.142 -6.629 -0.138 1.00 . A A . 23 TRP N 1 1 10 4322 1 1 23 TRP NE1 N 4.761 -9.607 4.187 1.00 . A A . 23 TRP NE1 1 1 10 4323 1 1 23 TRP O O 6.117 -9.857 0.278 1.00 . A A . 23 TRP O 1 1 10 4324 1 1 24 LEU C C 4.416 -9.864 -2.094 1.00 . A A . 24 LEU C 1 1 10 4325 1 1 24 LEU CA C 3.761 -8.921 -1.084 1.00 . A A . 24 LEU CA 1 1 10 4326 1 1 24 LEU CB C 2.811 -7.933 -1.770 1.00 . A A . 24 LEU CB 1 1 10 4327 1 1 24 LEU CD1 C 0.754 -9.425 -1.630 1.00 . A A . 24 LEU CD1 1 1 10 4328 1 1 24 LEU CD2 C 0.833 -7.509 -3.235 1.00 . A A . 24 LEU CD2 1 1 10 4329 1 1 24 LEU CG C 1.663 -8.598 -2.547 1.00 . A A . 24 LEU CG 1 1 10 4330 1 1 24 LEU H H 4.644 -7.156 -0.327 1.00 . A A . 24 LEU H 1 1 10 4331 1 1 24 LEU HA H 3.205 -9.497 -0.345 1.00 . A A . 24 LEU HA 1 1 10 4332 1 1 24 LEU HB2 H 2.392 -7.270 -1.012 1.00 . A A . 24 LEU HB2 1 1 10 4333 1 1 24 LEU HB3 H 3.394 -7.326 -2.463 1.00 . A A . 24 LEU HB3 1 1 10 4334 1 1 24 LEU HD11 H 1.292 -10.287 -1.236 1.00 . A A . 24 LEU HD11 1 1 10 4335 1 1 24 LEU HD12 H 0.398 -8.811 -0.802 1.00 . A A . 24 LEU HD12 1 1 10 4336 1 1 24 LEU HD13 H -0.103 -9.789 -2.197 1.00 . A A . 24 LEU HD13 1 1 10 4337 1 1 24 LEU HD21 H 0.390 -6.851 -2.488 1.00 . A A . 24 LEU HD21 1 1 10 4338 1 1 24 LEU HD22 H 1.469 -6.921 -3.898 1.00 . A A . 24 LEU HD22 1 1 10 4339 1 1 24 LEU HD23 H 0.038 -7.966 -3.825 1.00 . A A . 24 LEU HD23 1 1 10 4340 1 1 24 LEU HG H 2.069 -9.248 -3.323 1.00 . A A . 24 LEU HG 1 1 10 4341 1 1 24 LEU N N 4.773 -8.156 -0.376 1.00 . A A . 24 LEU N 1 1 10 4342 1 1 24 LEU O O 4.014 -11.020 -2.218 1.00 . A A . 24 LEU O 1 1 10 4343 1 1 25 MET C C 7.015 -11.230 -3.095 1.00 . A A . 25 MET C 1 1 10 4344 1 1 25 MET CA C 6.188 -10.136 -3.777 1.00 . A A . 25 MET CA 1 1 10 4345 1 1 25 MET CB C 7.070 -9.215 -4.631 1.00 . A A . 25 MET CB 1 1 10 4346 1 1 25 MET CE C 4.677 -8.044 -7.886 1.00 . A A . 25 MET CE 1 1 10 4347 1 1 25 MET CG C 6.245 -8.404 -5.639 1.00 . A A . 25 MET CG 1 1 10 4348 1 1 25 MET H H 5.709 -8.406 -2.609 1.00 . A A . 25 MET H 1 1 10 4349 1 1 25 MET HA H 5.477 -10.634 -4.438 1.00 . A A . 25 MET HA 1 1 10 4350 1 1 25 MET HB2 H 7.622 -8.534 -3.985 1.00 . A A . 25 MET HB2 1 1 10 4351 1 1 25 MET HB3 H 7.789 -9.816 -5.189 1.00 . A A . 25 MET HB3 1 1 10 4352 1 1 25 MET HE1 H 4.188 -8.458 -8.767 1.00 . A A . 25 MET HE1 1 1 10 4353 1 1 25 MET HE2 H 3.926 -7.605 -7.229 1.00 . A A . 25 MET HE2 1 1 10 4354 1 1 25 MET HE3 H 5.386 -7.275 -8.193 1.00 . A A . 25 MET HE3 1 1 10 4355 1 1 25 MET HG2 H 5.418 -7.915 -5.128 1.00 . A A . 25 MET HG2 1 1 10 4356 1 1 25 MET HG3 H 6.890 -7.635 -6.065 1.00 . A A . 25 MET HG3 1 1 10 4357 1 1 25 MET N N 5.435 -9.363 -2.799 1.00 . A A . 25 MET N 1 1 10 4358 1 1 25 MET O O 7.005 -12.368 -3.558 1.00 . A A . 25 MET O 1 1 10 4359 1 1 25 MET SD S 5.553 -9.366 -7.010 1.00 . A A . 25 MET SD 1 1 10 4360 1 1 26 ASN C C 7.686 -13.018 -0.730 1.00 . A A . 26 ASN C 1 1 10 4361 1 1 26 ASN CA C 8.538 -11.869 -1.276 1.00 . A A . 26 ASN CA 1 1 10 4362 1 1 26 ASN CB C 9.317 -11.203 -0.130 1.00 . A A . 26 ASN CB 1 1 10 4363 1 1 26 ASN CG C 10.355 -10.178 -0.589 1.00 . A A . 26 ASN CG 1 1 10 4364 1 1 26 ASN H H 7.698 -9.947 -1.667 1.00 . A A . 26 ASN H 1 1 10 4365 1 1 26 ASN HA H 9.252 -12.306 -1.975 1.00 . A A . 26 ASN HA 1 1 10 4366 1 1 26 ASN HB2 H 8.619 -10.719 0.554 1.00 . A A . 26 ASN HB2 1 1 10 4367 1 1 26 ASN HB3 H 9.848 -11.979 0.423 1.00 . A A . 26 ASN HB3 1 1 10 4368 1 1 26 ASN HD21 H 11.114 -11.437 -2.004 1.00 . A A . 26 ASN HD21 1 1 10 4369 1 1 26 ASN HD22 H 11.873 -9.864 -1.898 1.00 . A A . 26 ASN HD22 1 1 10 4370 1 1 26 ASN N N 7.724 -10.901 -2.005 1.00 . A A . 26 ASN N 1 1 10 4371 1 1 26 ASN ND2 N 11.178 -10.524 -1.580 1.00 . A A . 26 ASN ND2 1 1 10 4372 1 1 26 ASN O O 8.013 -14.181 -0.959 1.00 . A A . 26 ASN O 1 1 10 4373 1 1 26 ASN OD1 O 10.423 -9.080 -0.042 1.00 . A A . 26 ASN OD1 1 1 10 4374 1 1 27 THR C C 4.969 -14.493 -0.430 1.00 . A A . 27 THR C 1 1 10 4375 1 1 27 THR CA C 5.754 -13.706 0.621 1.00 . A A . 27 THR CA 1 1 10 4376 1 1 27 THR CB C 4.848 -13.061 1.683 1.00 . A A . 27 THR CB 1 1 10 4377 1 1 27 THR CG2 C 3.707 -12.213 1.115 1.00 . A A . 27 THR CG2 1 1 10 4378 1 1 27 THR H H 6.379 -11.727 0.137 1.00 . A A . 27 THR H 1 1 10 4379 1 1 27 THR HA H 6.406 -14.407 1.147 1.00 . A A . 27 THR HA 1 1 10 4380 1 1 27 THR HB H 5.472 -12.415 2.295 1.00 . A A . 27 THR HB 1 1 10 4381 1 1 27 THR HG1 H 3.778 -13.639 3.202 1.00 . A A . 27 THR HG1 1 1 10 4382 1 1 27 THR HG21 H 4.105 -11.486 0.413 1.00 . A A . 27 THR HG21 1 1 10 4383 1 1 27 THR HG22 H 2.972 -12.840 0.611 1.00 . A A . 27 THR HG22 1 1 10 4384 1 1 27 THR HG23 H 3.211 -11.683 1.927 1.00 . A A . 27 THR HG23 1 1 10 4385 1 1 27 THR N N 6.606 -12.701 -0.003 1.00 . A A . 27 THR N 1 1 10 4386 1 1 27 THR O O 4.841 -15.710 -0.329 1.00 . A A . 27 THR O 1 1 10 4387 1 1 27 THR OG1 O 4.301 -14.061 2.516 1.00 . A A . 27 THR OG1 1 1 10 4388 1 1 28 NH2 HN1 H 4.565 -12.803 -1.512 1.00 . A A . 28 NH2 HN1 1 1 10 4389 1 1 28 NH2 HN2 H 3.904 -14.293 -2.141 1.00 . A A . 28 NH2 HN2 1 1 10 4390 1 1 28 NH2 N N 4.442 -13.805 -1.445 1.00 . A A . 28 NH2 N 1 1 11 4391 1 1 1 SER C C -10.825 -1.962 9.963 1.00 . A A . 1 SER C 1 1 11 4392 1 1 1 SER CA C -11.138 -0.521 10.386 1.00 . A A . 1 SER CA 1 1 11 4393 1 1 1 SER CB C -9.899 0.390 10.418 1.00 . A A . 1 SER CB 1 1 11 4394 1 1 1 SER H1 H -11.209 -0.845 12.404 1.00 . A A . 1 SER H1 1 1 11 4395 1 1 1 SER H2 H -12.083 0.465 11.912 1.00 . A A . 1 SER H2 1 1 11 4396 1 1 1 SER H3 H -12.655 -1.060 11.643 1.00 . A A . 1 SER H3 1 1 11 4397 1 1 1 SER HA H -11.832 -0.110 9.652 1.00 . A A . 1 SER HA 1 1 11 4398 1 1 1 SER HB2 H -10.186 1.365 10.814 1.00 . A A . 1 SER HB2 1 1 11 4399 1 1 1 SER HB3 H -9.136 -0.041 11.067 1.00 . A A . 1 SER HB3 1 1 11 4400 1 1 1 SER HG H -10.071 0.781 8.512 1.00 . A A . 1 SER HG 1 1 11 4401 1 1 1 SER N N -11.825 -0.486 11.689 1.00 . A A . 1 SER N 1 1 11 4402 1 1 1 SER O O -11.445 -2.904 10.455 1.00 . A A . 1 SER O 1 1 11 4403 1 1 1 SER OG O -9.357 0.593 9.127 1.00 . A A . 1 SER OG 1 1 11 4404 1 1 2 GLN C C -8.120 -3.256 7.795 1.00 . A A . 2 GLN C 1 1 11 4405 1 1 2 GLN CA C -9.515 -3.388 8.408 1.00 . A A . 2 GLN CA 1 1 11 4406 1 1 2 GLN CB C -10.571 -3.787 7.359 1.00 . A A . 2 GLN CB 1 1 11 4407 1 1 2 GLN CD C -11.201 -1.437 6.539 1.00 . A A . 2 GLN CD 1 1 11 4408 1 1 2 GLN CG C -10.689 -2.828 6.161 1.00 . A A . 2 GLN CG 1 1 11 4409 1 1 2 GLN H H -9.392 -1.306 8.694 1.00 . A A . 2 GLN H 1 1 11 4410 1 1 2 GLN HA H -9.475 -4.164 9.175 1.00 . A A . 2 GLN HA 1 1 11 4411 1 1 2 GLN HB2 H -10.306 -4.771 6.971 1.00 . A A . 2 GLN HB2 1 1 11 4412 1 1 2 GLN HB3 H -11.545 -3.874 7.842 1.00 . A A . 2 GLN HB3 1 1 11 4413 1 1 2 GLN HE21 H -13.089 -2.144 6.825 1.00 . A A . 2 GLN HE21 1 1 11 4414 1 1 2 GLN HE22 H -12.873 -0.427 7.096 1.00 . A A . 2 GLN HE22 1 1 11 4415 1 1 2 GLN HG2 H -9.723 -2.737 5.671 1.00 . A A . 2 GLN HG2 1 1 11 4416 1 1 2 GLN HG3 H -11.384 -3.261 5.442 1.00 . A A . 2 GLN HG3 1 1 11 4417 1 1 2 GLN N N -9.876 -2.128 9.035 1.00 . A A . 2 GLN N 1 1 11 4418 1 1 2 GLN NE2 N -12.494 -1.329 6.846 1.00 . A A . 2 GLN NE2 1 1 11 4419 1 1 2 GLN O O -7.617 -2.145 7.637 1.00 . A A . 2 GLN O 1 1 11 4420 1 1 2 GLN OE1 O -10.440 -0.472 6.558 1.00 . A A . 2 GLN OE1 1 1 11 4421 1 1 3 GLY C C -6.089 -4.083 5.398 1.00 . A A . 3 GLY C 1 1 11 4422 1 1 3 GLY CA C -6.140 -4.413 6.893 1.00 . A A . 3 GLY CA 1 1 11 4423 1 1 3 GLY H H -7.963 -5.268 7.574 1.00 . A A . 3 GLY H 1 1 11 4424 1 1 3 GLY HA2 H -5.509 -3.707 7.433 1.00 . A A . 3 GLY HA2 1 1 11 4425 1 1 3 GLY HA3 H -5.733 -5.413 7.045 1.00 . A A . 3 GLY HA3 1 1 11 4426 1 1 3 GLY N N -7.494 -4.385 7.437 1.00 . A A . 3 GLY N 1 1 11 4427 1 1 3 GLY O O -5.282 -4.662 4.671 1.00 . A A . 3 GLY O 1 1 11 4428 1 1 4 THR C C -7.885 -1.410 3.538 1.00 . A A . 4 THR C 1 1 11 4429 1 1 4 THR CA C -7.018 -2.680 3.570 1.00 . A A . 4 THR CA 1 1 11 4430 1 1 4 THR CB C -7.522 -3.797 2.633 1.00 . A A . 4 THR CB 1 1 11 4431 1 1 4 THR CG2 C -8.933 -4.273 2.993 1.00 . A A . 4 THR CG2 1 1 11 4432 1 1 4 THR H H -7.537 -2.682 5.607 1.00 . A A . 4 THR H 1 1 11 4433 1 1 4 THR HA H -6.005 -2.413 3.274 1.00 . A A . 4 THR HA 1 1 11 4434 1 1 4 THR HB H -6.853 -4.655 2.700 1.00 . A A . 4 THR HB 1 1 11 4435 1 1 4 THR HG1 H -7.736 -4.110 0.724 1.00 . A A . 4 THR HG1 1 1 11 4436 1 1 4 THR HG21 H -9.245 -5.040 2.285 1.00 . A A . 4 THR HG21 1 1 11 4437 1 1 4 THR HG22 H -8.937 -4.699 3.996 1.00 . A A . 4 THR HG22 1 1 11 4438 1 1 4 THR HG23 H -9.638 -3.445 2.953 1.00 . A A . 4 THR HG23 1 1 11 4439 1 1 4 THR N N -6.939 -3.155 4.943 1.00 . A A . 4 THR N 1 1 11 4440 1 1 4 THR O O -8.239 -0.887 4.592 1.00 . A A . 4 THR O 1 1 11 4441 1 1 4 THR OG1 O -7.492 -3.371 1.286 1.00 . A A . 4 THR OG1 1 1 11 4442 1 1 5 THR C C -8.452 1.512 2.844 1.00 . A A . 5 THR C 1 1 11 4443 1 1 5 THR CA C -8.989 0.300 2.071 1.00 . A A . 5 THR CA 1 1 11 4444 1 1 5 THR CB C -10.505 0.073 2.237 1.00 . A A . 5 THR CB 1 1 11 4445 1 1 5 THR CG2 C -11.021 -0.980 1.252 1.00 . A A . 5 THR CG2 1 1 11 4446 1 1 5 THR H H -7.908 -1.441 1.532 1.00 . A A . 5 THR H 1 1 11 4447 1 1 5 THR HA H -8.830 0.531 1.016 1.00 . A A . 5 THR HA 1 1 11 4448 1 1 5 THR HB H -11.020 1.009 2.015 1.00 . A A . 5 THR HB 1 1 11 4449 1 1 5 THR HG1 H -10.222 -0.964 3.868 1.00 . A A . 5 THR HG1 1 1 11 4450 1 1 5 THR HG21 H -12.100 -1.086 1.368 1.00 . A A . 5 THR HG21 1 1 11 4451 1 1 5 THR HG22 H -10.807 -0.667 0.230 1.00 . A A . 5 THR HG22 1 1 11 4452 1 1 5 THR HG23 H -10.551 -1.945 1.434 1.00 . A A . 5 THR HG23 1 1 11 4453 1 1 5 THR N N -8.222 -0.917 2.339 1.00 . A A . 5 THR N 1 1 11 4454 1 1 5 THR O O -7.504 2.153 2.396 1.00 . A A . 5 THR O 1 1 11 4455 1 1 5 THR OG1 O -10.850 -0.308 3.554 1.00 . A A . 5 THR OG1 1 1 11 4456 1 1 6 SER C C -7.163 2.737 5.333 1.00 . A A . 6 SER C 1 1 11 4457 1 1 6 SER CA C -8.615 2.911 4.875 1.00 . A A . 6 SER CA 1 1 11 4458 1 1 6 SER CB C -9.547 2.975 6.088 1.00 . A A . 6 SER CB 1 1 11 4459 1 1 6 SER H H -9.820 1.256 4.315 1.00 . A A . 6 SER H 1 1 11 4460 1 1 6 SER HA H -8.699 3.850 4.325 1.00 . A A . 6 SER HA 1 1 11 4461 1 1 6 SER HB2 H -9.417 2.082 6.699 1.00 . A A . 6 SER HB2 1 1 11 4462 1 1 6 SER HB3 H -9.306 3.853 6.690 1.00 . A A . 6 SER HB3 1 1 11 4463 1 1 6 SER HG H -11.002 3.828 5.117 1.00 . A A . 6 SER HG 1 1 11 4464 1 1 6 SER N N -9.043 1.825 4.002 1.00 . A A . 6 SER N 1 1 11 4465 1 1 6 SER O O -6.468 3.724 5.566 1.00 . A A . 6 SER O 1 1 11 4466 1 1 6 SER OG O -10.894 3.049 5.669 1.00 . A A . 6 SER OG 1 1 11 4467 1 1 7 GLU C C -4.465 1.021 4.665 1.00 . A A . 7 GLU C 1 1 11 4468 1 1 7 GLU CA C -5.372 1.122 5.889 1.00 . A A . 7 GLU CA 1 1 11 4469 1 1 7 GLU CB C -5.454 -0.204 6.653 1.00 . A A . 7 GLU CB 1 1 11 4470 1 1 7 GLU CD C -3.393 0.329 8.042 1.00 . A A . 7 GLU CD 1 1 11 4471 1 1 7 GLU CG C -4.097 -0.697 7.158 1.00 . A A . 7 GLU CG 1 1 11 4472 1 1 7 GLU H H -7.311 0.722 5.166 1.00 . A A . 7 GLU H 1 1 11 4473 1 1 7 GLU HA H -4.987 1.892 6.559 1.00 . A A . 7 GLU HA 1 1 11 4474 1 1 7 GLU HB2 H -6.124 -0.078 7.503 1.00 . A A . 7 GLU HB2 1 1 11 4475 1 1 7 GLU HB3 H -5.864 -0.966 5.993 1.00 . A A . 7 GLU HB3 1 1 11 4476 1 1 7 GLU HG2 H -4.243 -1.614 7.729 1.00 . A A . 7 GLU HG2 1 1 11 4477 1 1 7 GLU HG3 H -3.477 -0.932 6.298 1.00 . A A . 7 GLU HG3 1 1 11 4478 1 1 7 GLU N N -6.712 1.483 5.458 1.00 . A A . 7 GLU N 1 1 11 4479 1 1 7 GLU O O -3.315 1.454 4.703 1.00 . A A . 7 GLU O 1 1 11 4480 1 1 7 GLU OE1 O -3.897 0.554 9.163 1.00 . A A . 7 GLU OE1 1 1 11 4481 1 1 7 GLU OE2 O -2.365 0.872 7.581 1.00 . A A . 7 GLU OE2 1 1 11 4482 1 1 8 TYR C C -3.864 1.792 1.834 1.00 . A A . 8 TYR C 1 1 11 4483 1 1 8 TYR CA C -4.328 0.407 2.285 1.00 . A A . 8 TYR CA 1 1 11 4484 1 1 8 TYR CB C -5.262 -0.217 1.247 1.00 . A A . 8 TYR CB 1 1 11 4485 1 1 8 TYR CD1 C -3.603 -1.180 -0.375 1.00 . A A . 8 TYR CD1 1 1 11 4486 1 1 8 TYR CD2 C -5.063 0.616 -1.123 1.00 . A A . 8 TYR CD2 1 1 11 4487 1 1 8 TYR CE1 C -2.927 -1.147 -1.601 1.00 . A A . 8 TYR CE1 1 1 11 4488 1 1 8 TYR CE2 C -4.419 0.618 -2.368 1.00 . A A . 8 TYR CE2 1 1 11 4489 1 1 8 TYR CG C -4.658 -0.288 -0.129 1.00 . A A . 8 TYR CG 1 1 11 4490 1 1 8 TYR CZ C -3.333 -0.247 -2.602 1.00 . A A . 8 TYR CZ 1 1 11 4491 1 1 8 TYR H H -5.948 0.128 3.617 1.00 . A A . 8 TYR H 1 1 11 4492 1 1 8 TYR HA H -3.452 -0.228 2.390 1.00 . A A . 8 TYR HA 1 1 11 4493 1 1 8 TYR HB2 H -5.509 -1.233 1.542 1.00 . A A . 8 TYR HB2 1 1 11 4494 1 1 8 TYR HB3 H -6.180 0.363 1.194 1.00 . A A . 8 TYR HB3 1 1 11 4495 1 1 8 TYR HD1 H -3.303 -1.887 0.381 1.00 . A A . 8 TYR HD1 1 1 11 4496 1 1 8 TYR HD2 H -5.863 1.317 -0.934 1.00 . A A . 8 TYR HD2 1 1 11 4497 1 1 8 TYR HE1 H -2.099 -1.821 -1.749 1.00 . A A . 8 TYR HE1 1 1 11 4498 1 1 8 TYR HE2 H -4.776 1.297 -3.123 1.00 . A A . 8 TYR HE2 1 1 11 4499 1 1 8 TYR HH H -3.030 0.434 -4.408 1.00 . A A . 8 TYR HH 1 1 11 4500 1 1 8 TYR N N -4.999 0.466 3.571 1.00 . A A . 8 TYR N 1 1 11 4501 1 1 8 TYR O O -2.784 1.912 1.262 1.00 . A A . 8 TYR O 1 1 11 4502 1 1 8 TYR OH O -2.676 -0.217 -3.798 1.00 . A A . 8 TYR OH 1 1 11 4503 1 1 9 SER C C -2.998 4.672 2.306 1.00 . A A . 9 SER C 1 1 11 4504 1 1 9 SER CA C -4.372 4.219 1.797 1.00 . A A . 9 SER CA 1 1 11 4505 1 1 9 SER CB C -5.475 5.123 2.357 1.00 . A A . 9 SER CB 1 1 11 4506 1 1 9 SER H H -5.563 2.633 2.544 1.00 . A A . 9 SER H 1 1 11 4507 1 1 9 SER HA H -4.381 4.324 0.713 1.00 . A A . 9 SER HA 1 1 11 4508 1 1 9 SER HB2 H -5.554 4.993 3.436 1.00 . A A . 9 SER HB2 1 1 11 4509 1 1 9 SER HB3 H -5.232 6.165 2.144 1.00 . A A . 9 SER HB3 1 1 11 4510 1 1 9 SER HG H -6.949 3.911 1.952 1.00 . A A . 9 SER HG 1 1 11 4511 1 1 9 SER N N -4.672 2.826 2.105 1.00 . A A . 9 SER N 1 1 11 4512 1 1 9 SER O O -2.420 5.598 1.740 1.00 . A A . 9 SER O 1 1 11 4513 1 1 9 SER OG O -6.717 4.823 1.755 1.00 . A A . 9 SER OG 1 1 11 4514 1 1 10 LYS C C -0.099 3.757 2.902 1.00 . A A . 10 LYS C 1 1 11 4515 1 1 10 LYS CA C -1.137 4.327 3.866 1.00 . A A . 10 LYS CA 1 1 11 4516 1 1 10 LYS CB C -0.980 3.762 5.281 1.00 . A A . 10 LYS CB 1 1 11 4517 1 1 10 LYS CD C -2.298 5.674 6.463 1.00 . A A . 10 LYS CD 1 1 11 4518 1 1 10 LYS CE C -3.230 6.336 5.435 1.00 . A A . 10 LYS CE 1 1 11 4519 1 1 10 LYS CG C -2.103 4.162 6.255 1.00 . A A . 10 LYS CG 1 1 11 4520 1 1 10 LYS H H -2.960 3.273 3.798 1.00 . A A . 10 LYS H 1 1 11 4521 1 1 10 LYS HA H -0.974 5.404 3.914 1.00 . A A . 10 LYS HA 1 1 11 4522 1 1 10 LYS HB2 H -0.950 2.672 5.228 1.00 . A A . 10 LYS HB2 1 1 11 4523 1 1 10 LYS HB3 H -0.028 4.104 5.684 1.00 . A A . 10 LYS HB3 1 1 11 4524 1 1 10 LYS HD2 H -2.763 5.794 7.443 1.00 . A A . 10 LYS HD2 1 1 11 4525 1 1 10 LYS HD3 H -1.333 6.182 6.481 1.00 . A A . 10 LYS HD3 1 1 11 4526 1 1 10 LYS HE2 H -2.715 6.526 4.496 1.00 . A A . 10 LYS HE2 1 1 11 4527 1 1 10 LYS HE3 H -4.088 5.694 5.240 1.00 . A A . 10 LYS HE3 1 1 11 4528 1 1 10 LYS HG2 H -3.050 3.713 5.958 1.00 . A A . 10 LYS HG2 1 1 11 4529 1 1 10 LYS HG3 H -1.834 3.733 7.221 1.00 . A A . 10 LYS HG3 1 1 11 4530 1 1 10 LYS HZ1 H -4.339 8.041 5.232 1.00 . A A . 10 LYS HZ1 1 1 11 4531 1 1 10 LYS HZ2 H -4.244 7.492 6.783 1.00 . A A . 10 LYS HZ2 1 1 11 4532 1 1 10 LYS HZ3 H -2.950 8.250 6.096 1.00 . A A . 10 LYS HZ3 1 1 11 4533 1 1 10 LYS N N -2.466 4.037 3.360 1.00 . A A . 10 LYS N 1 1 11 4534 1 1 10 LYS NZ N -3.730 7.631 5.925 1.00 . A A . 10 LYS NZ 1 1 11 4535 1 1 10 LYS O O 0.750 4.495 2.407 1.00 . A A . 10 LYS O 1 1 11 4536 1 1 11 TYR C C 0.128 1.801 0.287 1.00 . A A . 11 TYR C 1 1 11 4537 1 1 11 TYR CA C 0.704 1.760 1.695 1.00 . A A . 11 TYR CA 1 1 11 4538 1 1 11 TYR CB C 1.027 0.367 2.225 1.00 . A A . 11 TYR CB 1 1 11 4539 1 1 11 TYR CD1 C -0.298 -0.371 4.232 1.00 . A A . 11 TYR CD1 1 1 11 4540 1 1 11 TYR CD2 C -0.826 -1.365 2.075 1.00 . A A . 11 TYR CD2 1 1 11 4541 1 1 11 TYR CE1 C -1.172 -1.269 4.862 1.00 . A A . 11 TYR CE1 1 1 11 4542 1 1 11 TYR CE2 C -1.717 -2.253 2.707 1.00 . A A . 11 TYR CE2 1 1 11 4543 1 1 11 TYR CG C -0.108 -0.427 2.840 1.00 . A A . 11 TYR CG 1 1 11 4544 1 1 11 TYR CZ C -1.903 -2.194 4.099 1.00 . A A . 11 TYR CZ 1 1 11 4545 1 1 11 TYR H H -0.987 1.927 2.911 1.00 . A A . 11 TYR H 1 1 11 4546 1 1 11 TYR HA H 1.649 2.293 1.631 1.00 . A A . 11 TYR HA 1 1 11 4547 1 1 11 TYR HB2 H 1.490 -0.195 1.422 1.00 . A A . 11 TYR HB2 1 1 11 4548 1 1 11 TYR HB3 H 1.767 0.511 3.010 1.00 . A A . 11 TYR HB3 1 1 11 4549 1 1 11 TYR HD1 H 0.249 0.347 4.827 1.00 . A A . 11 TYR HD1 1 1 11 4550 1 1 11 TYR HD2 H -0.679 -1.417 1.007 1.00 . A A . 11 TYR HD2 1 1 11 4551 1 1 11 TYR HE1 H -1.267 -1.252 5.938 1.00 . A A . 11 TYR HE1 1 1 11 4552 1 1 11 TYR HE2 H -2.252 -2.987 2.124 1.00 . A A . 11 TYR HE2 1 1 11 4553 1 1 11 TYR HH H -3.275 -3.604 4.115 1.00 . A A . 11 TYR HH 1 1 11 4554 1 1 11 TYR N N -0.187 2.454 2.606 1.00 . A A . 11 TYR N 1 1 11 4555 1 1 11 TYR O O -0.023 0.794 -0.403 1.00 . A A . 11 TYR O 1 1 11 4556 1 1 11 TYR OH O -2.788 -3.033 4.714 1.00 . A A . 11 TYR OH 1 1 11 4557 1 1 12 LEU C C 0.198 4.763 -1.770 1.00 . A A . 12 LEU C 1 1 11 4558 1 1 12 LEU CA C -0.590 3.490 -1.405 1.00 . A A . 12 LEU CA 1 1 11 4559 1 1 12 LEU CB C -2.106 3.705 -1.334 1.00 . A A . 12 LEU CB 1 1 11 4560 1 1 12 LEU CD1 C -2.506 3.701 -3.847 1.00 . A A . 12 LEU CD1 1 1 11 4561 1 1 12 LEU CD2 C -4.236 4.619 -2.295 1.00 . A A . 12 LEU CD2 1 1 11 4562 1 1 12 LEU CG C -2.731 4.446 -2.525 1.00 . A A . 12 LEU CG 1 1 11 4563 1 1 12 LEU H H -0.041 3.756 0.594 1.00 . A A . 12 LEU H 1 1 11 4564 1 1 12 LEU HA H -0.374 2.699 -2.116 1.00 . A A . 12 LEU HA 1 1 11 4565 1 1 12 LEU HB2 H -2.573 2.725 -1.225 1.00 . A A . 12 LEU HB2 1 1 11 4566 1 1 12 LEU HB3 H -2.308 4.282 -0.435 1.00 . A A . 12 LEU HB3 1 1 11 4567 1 1 12 LEU HD11 H -2.940 2.705 -3.792 1.00 . A A . 12 LEU HD11 1 1 11 4568 1 1 12 LEU HD12 H -2.979 4.249 -4.662 1.00 . A A . 12 LEU HD12 1 1 11 4569 1 1 12 LEU HD13 H -1.444 3.608 -4.067 1.00 . A A . 12 LEU HD13 1 1 11 4570 1 1 12 LEU HD21 H -4.405 5.245 -1.419 1.00 . A A . 12 LEU HD21 1 1 11 4571 1 1 12 LEU HD22 H -4.689 5.106 -3.159 1.00 . A A . 12 LEU HD22 1 1 11 4572 1 1 12 LEU HD23 H -4.711 3.650 -2.141 1.00 . A A . 12 LEU HD23 1 1 11 4573 1 1 12 LEU HG H -2.302 5.447 -2.578 1.00 . A A . 12 LEU HG 1 1 11 4574 1 1 12 LEU N N -0.157 3.039 -0.104 1.00 . A A . 12 LEU N 1 1 11 4575 1 1 12 LEU O O 0.294 5.111 -2.945 1.00 . A A . 12 LEU O 1 1 11 4576 1 1 13 ASP C C 2.973 6.346 -1.398 1.00 . A A . 13 ASP C 1 1 11 4577 1 1 13 ASP CA C 1.551 6.666 -0.905 1.00 . A A . 13 ASP CA 1 1 11 4578 1 1 13 ASP CB C 1.492 7.389 0.452 1.00 . A A . 13 ASP CB 1 1 11 4579 1 1 13 ASP CG C 2.045 8.813 0.396 1.00 . A A . 13 ASP CG 1 1 11 4580 1 1 13 ASP H H 0.663 5.121 0.181 1.00 . A A . 13 ASP H 1 1 11 4581 1 1 13 ASP HA H 1.074 7.303 -1.650 1.00 . A A . 13 ASP HA 1 1 11 4582 1 1 13 ASP HB2 H 0.449 7.450 0.768 1.00 . A A . 13 ASP HB2 1 1 11 4583 1 1 13 ASP HB3 H 2.027 6.798 1.198 1.00 . A A . 13 ASP HB3 1 1 11 4584 1 1 13 ASP N N 0.773 5.447 -0.767 1.00 . A A . 13 ASP N 1 1 11 4585 1 1 13 ASP O O 3.126 5.734 -2.453 1.00 . A A . 13 ASP O 1 1 11 4586 1 1 13 ASP OD1 O 1.394 9.653 -0.262 1.00 . A A . 13 ASP OD1 1 1 11 4587 1 1 13 ASP OD2 O 3.109 9.035 1.014 1.00 . A A . 13 ASP OD2 1 1 11 4588 1 1 14 SER C C 6.041 5.391 -0.510 1.00 . A A . 14 SER C 1 1 11 4589 1 1 14 SER CA C 5.405 6.667 -1.074 1.00 . A A . 14 SER CA 1 1 11 4590 1 1 14 SER CB C 6.136 7.959 -0.681 1.00 . A A . 14 SER CB 1 1 11 4591 1 1 14 SER H H 3.828 7.270 0.192 1.00 . A A . 14 SER H 1 1 11 4592 1 1 14 SER HA H 5.462 6.596 -2.162 1.00 . A A . 14 SER HA 1 1 11 4593 1 1 14 SER HB2 H 6.094 8.112 0.398 1.00 . A A . 14 SER HB2 1 1 11 4594 1 1 14 SER HB3 H 7.178 7.911 -1.003 1.00 . A A . 14 SER HB3 1 1 11 4595 1 1 14 SER HG H 5.519 8.928 -2.254 1.00 . A A . 14 SER HG 1 1 11 4596 1 1 14 SER N N 4.011 6.772 -0.666 1.00 . A A . 14 SER N 1 1 11 4597 1 1 14 SER O O 5.688 4.304 -0.962 1.00 . A A . 14 SER O 1 1 11 4598 1 1 14 SER OG O 5.519 9.067 -1.303 1.00 . A A . 14 SER OG 1 1 11 4599 1 1 15 ARG C C 6.931 3.212 1.341 1.00 . A A . 15 ARG C 1 1 11 4600 1 1 15 ARG CA C 7.780 4.436 1.012 1.00 . A A . 15 ARG CA 1 1 11 4601 1 1 15 ARG CB C 8.530 4.953 2.252 1.00 . A A . 15 ARG CB 1 1 11 4602 1 1 15 ARG CD C 9.030 2.826 3.645 1.00 . A A . 15 ARG CD 1 1 11 4603 1 1 15 ARG CG C 9.592 3.989 2.811 1.00 . A A . 15 ARG CG 1 1 11 4604 1 1 15 ARG CZ C 10.960 1.246 3.853 1.00 . A A . 15 ARG CZ 1 1 11 4605 1 1 15 ARG H H 7.193 6.446 0.782 1.00 . A A . 15 ARG H 1 1 11 4606 1 1 15 ARG HA H 8.523 4.153 0.265 1.00 . A A . 15 ARG HA 1 1 11 4607 1 1 15 ARG HB2 H 9.055 5.863 1.957 1.00 . A A . 15 ARG HB2 1 1 11 4608 1 1 15 ARG HB3 H 7.823 5.216 3.040 1.00 . A A . 15 ARG HB3 1 1 11 4609 1 1 15 ARG HD2 H 8.312 3.212 4.369 1.00 . A A . 15 ARG HD2 1 1 11 4610 1 1 15 ARG HD3 H 8.520 2.095 3.023 1.00 . A A . 15 ARG HD3 1 1 11 4611 1 1 15 ARG HE H 10.150 2.313 5.373 1.00 . A A . 15 ARG HE 1 1 11 4612 1 1 15 ARG HG2 H 10.202 3.607 1.993 1.00 . A A . 15 ARG HG2 1 1 11 4613 1 1 15 ARG HG3 H 10.238 4.575 3.468 1.00 . A A . 15 ARG HG3 1 1 11 4614 1 1 15 ARG HH11 H 10.280 1.396 1.928 1.00 . A A . 15 ARG HH11 1 1 11 4615 1 1 15 ARG HH12 H 11.613 0.292 2.168 1.00 . A A . 15 ARG HH12 1 1 11 4616 1 1 15 ARG HH21 H 11.871 0.853 5.638 1.00 . A A . 15 ARG HH21 1 1 11 4617 1 1 15 ARG HH22 H 12.510 -0.019 4.263 1.00 . A A . 15 ARG HH22 1 1 11 4618 1 1 15 ARG N N 6.977 5.520 0.447 1.00 . A A . 15 ARG N 1 1 11 4619 1 1 15 ARG NE N 10.090 2.125 4.382 1.00 . A A . 15 ARG NE 1 1 11 4620 1 1 15 ARG NH1 N 10.951 0.957 2.542 1.00 . A A . 15 ARG NH1 1 1 11 4621 1 1 15 ARG NH2 N 11.854 0.645 4.650 1.00 . A A . 15 ARG NH2 1 1 11 4622 1 1 15 ARG O O 7.247 2.111 0.900 1.00 . A A . 15 ARG O 1 1 11 4623 1 1 16 ARG C C 4.478 1.491 1.423 1.00 . A A . 16 ARG C 1 1 11 4624 1 1 16 ARG CA C 4.951 2.377 2.568 1.00 . A A . 16 ARG CA 1 1 11 4625 1 1 16 ARG CB C 3.751 3.035 3.244 1.00 . A A . 16 ARG CB 1 1 11 4626 1 1 16 ARG CD C 2.970 4.358 5.219 1.00 . A A . 16 ARG CD 1 1 11 4627 1 1 16 ARG CG C 4.178 3.702 4.545 1.00 . A A . 16 ARG CG 1 1 11 4628 1 1 16 ARG CZ C 2.986 6.763 4.521 1.00 . A A . 16 ARG CZ 1 1 11 4629 1 1 16 ARG H H 5.665 4.359 2.420 1.00 . A A . 16 ARG H 1 1 11 4630 1 1 16 ARG HA H 5.471 1.750 3.294 1.00 . A A . 16 ARG HA 1 1 11 4631 1 1 16 ARG HB2 H 3.308 3.768 2.569 1.00 . A A . 16 ARG HB2 1 1 11 4632 1 1 16 ARG HB3 H 3.016 2.274 3.493 1.00 . A A . 16 ARG HB3 1 1 11 4633 1 1 16 ARG HD2 H 2.169 3.622 5.280 1.00 . A A . 16 ARG HD2 1 1 11 4634 1 1 16 ARG HD3 H 3.231 4.661 6.232 1.00 . A A . 16 ARG HD3 1 1 11 4635 1 1 16 ARG HE H 1.704 5.353 3.836 1.00 . A A . 16 ARG HE 1 1 11 4636 1 1 16 ARG HG2 H 4.583 2.921 5.189 1.00 . A A . 16 ARG HG2 1 1 11 4637 1 1 16 ARG HG3 H 4.950 4.442 4.342 1.00 . A A . 16 ARG HG3 1 1 11 4638 1 1 16 ARG HH11 H 4.510 6.317 5.810 1.00 . A A . 16 ARG HH11 1 1 11 4639 1 1 16 ARG HH12 H 4.415 7.989 5.311 1.00 . A A . 16 ARG HH12 1 1 11 4640 1 1 16 ARG HH21 H 1.594 7.541 3.245 1.00 . A A . 16 ARG HH21 1 1 11 4641 1 1 16 ARG HH22 H 2.775 8.680 3.848 1.00 . A A . 16 ARG HH22 1 1 11 4642 1 1 16 ARG N N 5.860 3.417 2.113 1.00 . A A . 16 ARG N 1 1 11 4643 1 1 16 ARG NE N 2.484 5.518 4.459 1.00 . A A . 16 ARG NE 1 1 11 4644 1 1 16 ARG NH1 N 4.057 7.045 5.277 1.00 . A A . 16 ARG NH1 1 1 11 4645 1 1 16 ARG NH2 N 2.404 7.741 3.814 1.00 . A A . 16 ARG NH2 1 1 11 4646 1 1 16 ARG O O 4.503 0.269 1.542 1.00 . A A . 16 ARG O 1 1 11 4647 1 1 17 ALA C C 4.749 0.551 -1.447 1.00 . A A . 17 ALA C 1 1 11 4648 1 1 17 ALA CA C 3.612 1.386 -0.863 1.00 . A A . 17 ALA CA 1 1 11 4649 1 1 17 ALA CB C 3.072 2.368 -1.900 1.00 . A A . 17 ALA CB 1 1 11 4650 1 1 17 ALA H H 4.086 3.117 0.268 1.00 . A A . 17 ALA H 1 1 11 4651 1 1 17 ALA HA H 2.797 0.719 -0.579 1.00 . A A . 17 ALA HA 1 1 11 4652 1 1 17 ALA HB1 H 2.296 2.980 -1.448 1.00 . A A . 17 ALA HB1 1 1 11 4653 1 1 17 ALA HB2 H 3.870 3.014 -2.257 1.00 . A A . 17 ALA HB2 1 1 11 4654 1 1 17 ALA HB3 H 2.656 1.815 -2.742 1.00 . A A . 17 ALA HB3 1 1 11 4655 1 1 17 ALA N N 4.052 2.108 0.316 1.00 . A A . 17 ALA N 1 1 11 4656 1 1 17 ALA O O 4.506 -0.561 -1.907 1.00 . A A . 17 ALA O 1 1 11 4657 1 1 18 GLN C C 7.453 -0.868 -1.168 1.00 . A A . 18 GLN C 1 1 11 4658 1 1 18 GLN CA C 7.122 0.365 -2.005 1.00 . A A . 18 GLN CA 1 1 11 4659 1 1 18 GLN CB C 8.368 1.258 -2.132 1.00 . A A . 18 GLN CB 1 1 11 4660 1 1 18 GLN CD C 7.186 2.670 -3.906 1.00 . A A . 18 GLN CD 1 1 11 4661 1 1 18 GLN CG C 8.120 2.660 -2.700 1.00 . A A . 18 GLN CG 1 1 11 4662 1 1 18 GLN H H 6.143 1.938 -0.919 1.00 . A A . 18 GLN H 1 1 11 4663 1 1 18 GLN HA H 6.836 0.030 -3.000 1.00 . A A . 18 GLN HA 1 1 11 4664 1 1 18 GLN HB2 H 8.840 1.377 -1.156 1.00 . A A . 18 GLN HB2 1 1 11 4665 1 1 18 GLN HB3 H 9.075 0.743 -2.784 1.00 . A A . 18 GLN HB3 1 1 11 4666 1 1 18 GLN HE21 H 5.837 3.826 -2.909 1.00 . A A . 18 GLN HE21 1 1 11 4667 1 1 18 GLN HE22 H 5.399 3.401 -4.554 1.00 . A A . 18 GLN HE22 1 1 11 4668 1 1 18 GLN HG2 H 7.715 3.284 -1.909 1.00 . A A . 18 GLN HG2 1 1 11 4669 1 1 18 GLN HG3 H 9.078 3.088 -2.997 1.00 . A A . 18 GLN HG3 1 1 11 4670 1 1 18 GLN N N 5.984 1.071 -1.424 1.00 . A A . 18 GLN N 1 1 11 4671 1 1 18 GLN NE2 N 6.050 3.360 -3.783 1.00 . A A . 18 GLN NE2 1 1 11 4672 1 1 18 GLN O O 7.662 -1.955 -1.700 1.00 . A A . 18 GLN O 1 1 11 4673 1 1 18 GLN OE1 O 7.485 2.068 -4.934 1.00 . A A . 18 GLN OE1 1 1 11 4674 1 1 19 ASP C C 6.749 -2.814 1.020 1.00 . A A . 19 ASP C 1 1 11 4675 1 1 19 ASP CA C 7.802 -1.717 1.119 1.00 . A A . 19 ASP CA 1 1 11 4676 1 1 19 ASP CB C 7.841 -1.101 2.521 1.00 . A A . 19 ASP CB 1 1 11 4677 1 1 19 ASP CG C 8.298 -2.111 3.569 1.00 . A A . 19 ASP CG 1 1 11 4678 1 1 19 ASP H H 7.186 0.219 0.496 1.00 . A A . 19 ASP H 1 1 11 4679 1 1 19 ASP HA H 8.785 -2.131 0.885 1.00 . A A . 19 ASP HA 1 1 11 4680 1 1 19 ASP HB2 H 8.537 -0.264 2.517 1.00 . A A . 19 ASP HB2 1 1 11 4681 1 1 19 ASP HB3 H 6.854 -0.721 2.789 1.00 . A A . 19 ASP HB3 1 1 11 4682 1 1 19 ASP N N 7.486 -0.681 0.152 1.00 . A A . 19 ASP N 1 1 11 4683 1 1 19 ASP O O 7.075 -3.999 0.996 1.00 . A A . 19 ASP O 1 1 11 4684 1 1 19 ASP OD1 O 7.414 -2.808 4.114 1.00 . A A . 19 ASP OD1 1 1 11 4685 1 1 19 ASP OD2 O 9.524 -2.169 3.806 1.00 . A A . 19 ASP OD2 1 1 11 4686 1 1 20 PHE C C 4.458 -4.104 -0.494 1.00 . A A . 20 PHE C 1 1 11 4687 1 1 20 PHE CA C 4.345 -3.265 0.778 1.00 . A A . 20 PHE CA 1 1 11 4688 1 1 20 PHE CB C 3.061 -2.435 0.806 1.00 . A A . 20 PHE CB 1 1 11 4689 1 1 20 PHE CD1 C 1.311 -4.002 1.733 1.00 . A A . 20 PHE CD1 1 1 11 4690 1 1 20 PHE CD2 C 1.129 -3.285 -0.588 1.00 . A A . 20 PHE CD2 1 1 11 4691 1 1 20 PHE CE1 C 0.151 -4.781 1.583 1.00 . A A . 20 PHE CE1 1 1 11 4692 1 1 20 PHE CE2 C -0.028 -4.069 -0.739 1.00 . A A . 20 PHE CE2 1 1 11 4693 1 1 20 PHE CG C 1.798 -3.250 0.649 1.00 . A A . 20 PHE CG 1 1 11 4694 1 1 20 PHE CZ C -0.516 -4.818 0.346 1.00 . A A . 20 PHE CZ 1 1 11 4695 1 1 20 PHE H H 5.302 -1.399 0.988 1.00 . A A . 20 PHE H 1 1 11 4696 1 1 20 PHE HA H 4.318 -3.942 1.633 1.00 . A A . 20 PHE HA 1 1 11 4697 1 1 20 PHE HB2 H 3.015 -1.921 1.767 1.00 . A A . 20 PHE HB2 1 1 11 4698 1 1 20 PHE HB3 H 3.102 -1.683 0.019 1.00 . A A . 20 PHE HB3 1 1 11 4699 1 1 20 PHE HD1 H 1.826 -3.978 2.683 1.00 . A A . 20 PHE HD1 1 1 11 4700 1 1 20 PHE HD2 H 1.503 -2.710 -1.423 1.00 . A A . 20 PHE HD2 1 1 11 4701 1 1 20 PHE HE1 H -0.229 -5.348 2.420 1.00 . A A . 20 PHE HE1 1 1 11 4702 1 1 20 PHE HE2 H -0.540 -4.098 -1.690 1.00 . A A . 20 PHE HE2 1 1 11 4703 1 1 20 PHE HZ H -1.405 -5.421 0.229 1.00 . A A . 20 PHE HZ 1 1 11 4704 1 1 20 PHE N N 5.484 -2.392 0.941 1.00 . A A . 20 PHE N 1 1 11 4705 1 1 20 PHE O O 4.214 -5.305 -0.421 1.00 . A A . 20 PHE O 1 1 11 4706 1 1 21 VAL C C 6.030 -5.325 -2.847 1.00 . A A . 21 VAL C 1 1 11 4707 1 1 21 VAL CA C 4.856 -4.347 -2.865 1.00 . A A . 21 VAL CA 1 1 11 4708 1 1 21 VAL CB C 4.755 -3.553 -4.179 1.00 . A A . 21 VAL CB 1 1 11 4709 1 1 21 VAL CG1 C 3.404 -2.834 -4.279 1.00 . A A . 21 VAL CG1 1 1 11 4710 1 1 21 VAL CG2 C 5.909 -2.575 -4.398 1.00 . A A . 21 VAL CG2 1 1 11 4711 1 1 21 VAL H H 5.087 -2.540 -1.687 1.00 . A A . 21 VAL H 1 1 11 4712 1 1 21 VAL HA H 3.969 -4.978 -2.843 1.00 . A A . 21 VAL HA 1 1 11 4713 1 1 21 VAL HB H 4.789 -4.275 -4.998 1.00 . A A . 21 VAL HB 1 1 11 4714 1 1 21 VAL HG11 H 3.334 -2.314 -5.235 1.00 . A A . 21 VAL HG11 1 1 11 4715 1 1 21 VAL HG12 H 2.595 -3.562 -4.218 1.00 . A A . 21 VAL HG12 1 1 11 4716 1 1 21 VAL HG13 H 3.289 -2.112 -3.474 1.00 . A A . 21 VAL HG13 1 1 11 4717 1 1 21 VAL HG21 H 5.794 -2.079 -5.362 1.00 . A A . 21 VAL HG21 1 1 11 4718 1 1 21 VAL HG22 H 5.895 -1.827 -3.615 1.00 . A A . 21 VAL HG22 1 1 11 4719 1 1 21 VAL HG23 H 6.865 -3.097 -4.388 1.00 . A A . 21 VAL HG23 1 1 11 4720 1 1 21 VAL N N 4.820 -3.524 -1.652 1.00 . A A . 21 VAL N 1 1 11 4721 1 1 21 VAL O O 5.866 -6.476 -3.246 1.00 . A A . 21 VAL O 1 1 11 4722 1 1 22 GLN C C 7.938 -6.958 -1.267 1.00 . A A . 22 GLN C 1 1 11 4723 1 1 22 GLN CA C 8.335 -5.785 -2.157 1.00 . A A . 22 GLN CA 1 1 11 4724 1 1 22 GLN CB C 9.489 -5.022 -1.501 1.00 . A A . 22 GLN CB 1 1 11 4725 1 1 22 GLN CD C 10.880 -4.606 -3.582 1.00 . A A . 22 GLN CD 1 1 11 4726 1 1 22 GLN CG C 10.084 -3.976 -2.442 1.00 . A A . 22 GLN CG 1 1 11 4727 1 1 22 GLN H H 7.284 -3.933 -2.054 1.00 . A A . 22 GLN H 1 1 11 4728 1 1 22 GLN HA H 8.658 -6.176 -3.123 1.00 . A A . 22 GLN HA 1 1 11 4729 1 1 22 GLN HB2 H 9.125 -4.519 -0.605 1.00 . A A . 22 GLN HB2 1 1 11 4730 1 1 22 GLN HB3 H 10.270 -5.724 -1.203 1.00 . A A . 22 GLN HB3 1 1 11 4731 1 1 22 GLN HE21 H 12.364 -5.182 -2.310 1.00 . A A . 22 GLN HE21 1 1 11 4732 1 1 22 GLN HE22 H 12.602 -5.604 -3.993 1.00 . A A . 22 GLN HE22 1 1 11 4733 1 1 22 GLN HG2 H 9.281 -3.378 -2.865 1.00 . A A . 22 GLN HG2 1 1 11 4734 1 1 22 GLN HG3 H 10.731 -3.329 -1.853 1.00 . A A . 22 GLN HG3 1 1 11 4735 1 1 22 GLN N N 7.198 -4.895 -2.356 1.00 . A A . 22 GLN N 1 1 11 4736 1 1 22 GLN NE2 N 12.045 -5.177 -3.268 1.00 . A A . 22 GLN NE2 1 1 11 4737 1 1 22 GLN O O 8.269 -8.102 -1.567 1.00 . A A . 22 GLN O 1 1 11 4738 1 1 22 GLN OE1 O 10.452 -4.577 -4.733 1.00 . A A . 22 GLN OE1 1 1 11 4739 1 1 23 TRP C C 5.898 -8.663 0.205 1.00 . A A . 23 TRP C 1 1 11 4740 1 1 23 TRP CA C 6.855 -7.648 0.821 1.00 . A A . 23 TRP CA 1 1 11 4741 1 1 23 TRP CB C 6.202 -6.942 2.011 1.00 . A A . 23 TRP CB 1 1 11 4742 1 1 23 TRP CD1 C 5.873 -8.814 3.662 1.00 . A A . 23 TRP CD1 1 1 11 4743 1 1 23 TRP CD2 C 3.949 -8.077 2.800 1.00 . A A . 23 TRP CD2 1 1 11 4744 1 1 23 TRP CE2 C 3.624 -9.160 3.664 1.00 . A A . 23 TRP CE2 1 1 11 4745 1 1 23 TRP CE3 C 2.905 -7.508 2.048 1.00 . A A . 23 TRP CE3 1 1 11 4746 1 1 23 TRP CG C 5.383 -7.857 2.853 1.00 . A A . 23 TRP CG 1 1 11 4747 1 1 23 TRP CH2 C 1.286 -9.026 3.064 1.00 . A A . 23 TRP CH2 1 1 11 4748 1 1 23 TRP CZ2 C 2.311 -9.626 3.813 1.00 . A A . 23 TRP CZ2 1 1 11 4749 1 1 23 TRP CZ3 C 1.585 -7.981 2.171 1.00 . A A . 23 TRP CZ3 1 1 11 4750 1 1 23 TRP H H 6.860 -5.724 -0.069 1.00 . A A . 23 TRP H 1 1 11 4751 1 1 23 TRP HA H 7.748 -8.169 1.170 1.00 . A A . 23 TRP HA 1 1 11 4752 1 1 23 TRP HB2 H 6.969 -6.469 2.622 1.00 . A A . 23 TRP HB2 1 1 11 4753 1 1 23 TRP HB3 H 5.532 -6.163 1.649 1.00 . A A . 23 TRP HB3 1 1 11 4754 1 1 23 TRP HD1 H 6.929 -8.975 3.797 1.00 . A A . 23 TRP HD1 1 1 11 4755 1 1 23 TRP HE1 H 4.926 -10.337 4.827 1.00 . A A . 23 TRP HE1 1 1 11 4756 1 1 23 TRP HE3 H 3.161 -6.726 1.345 1.00 . A A . 23 TRP HE3 1 1 11 4757 1 1 23 TRP HH2 H 0.274 -9.384 3.166 1.00 . A A . 23 TRP HH2 1 1 11 4758 1 1 23 TRP HZ2 H 2.093 -10.447 4.480 1.00 . A A . 23 TRP HZ2 1 1 11 4759 1 1 23 TRP HZ3 H 0.800 -7.551 1.568 1.00 . A A . 23 TRP HZ3 1 1 11 4760 1 1 23 TRP N N 7.224 -6.664 -0.178 1.00 . A A . 23 TRP N 1 1 11 4761 1 1 23 TRP NE1 N 4.837 -9.563 4.187 1.00 . A A . 23 TRP NE1 1 1 11 4762 1 1 23 TRP O O 6.126 -9.866 0.284 1.00 . A A . 23 TRP O 1 1 11 4763 1 1 24 LEU C C 4.416 -9.864 -2.094 1.00 . A A . 24 LEU C 1 1 11 4764 1 1 24 LEU CA C 3.792 -8.892 -1.092 1.00 . A A . 24 LEU CA 1 1 11 4765 1 1 24 LEU CB C 2.870 -7.883 -1.786 1.00 . A A . 24 LEU CB 1 1 11 4766 1 1 24 LEU CD1 C 0.782 -9.332 -1.640 1.00 . A A . 24 LEU CD1 1 1 11 4767 1 1 24 LEU CD2 C 0.884 -7.389 -3.212 1.00 . A A . 24 LEU CD2 1 1 11 4768 1 1 24 LEU CG C 1.697 -8.511 -2.556 1.00 . A A . 24 LEU CG 1 1 11 4769 1 1 24 LEU H H 4.721 -7.141 -0.357 1.00 . A A . 24 LEU H 1 1 11 4770 1 1 24 LEU HA H 3.223 -9.444 -0.346 1.00 . A A . 24 LEU HA 1 1 11 4771 1 1 24 LEU HB2 H 2.474 -7.204 -1.031 1.00 . A A . 24 LEU HB2 1 1 11 4772 1 1 24 LEU HB3 H 3.473 -7.300 -2.484 1.00 . A A . 24 LEU HB3 1 1 11 4773 1 1 24 LEU HD11 H -0.089 -9.671 -2.203 1.00 . A A . 24 LEU HD11 1 1 11 4774 1 1 24 LEU HD12 H 1.306 -10.210 -1.264 1.00 . A A . 24 LEU HD12 1 1 11 4775 1 1 24 LEU HD13 H 0.447 -8.723 -0.801 1.00 . A A . 24 LEU HD13 1 1 11 4776 1 1 24 LEU HD21 H 0.472 -6.729 -2.447 1.00 . A A . 24 LEU HD21 1 1 11 4777 1 1 24 LEU HD22 H 1.523 -6.809 -3.878 1.00 . A A . 24 LEU HD22 1 1 11 4778 1 1 24 LEU HD23 H 0.066 -7.816 -3.793 1.00 . A A . 24 LEU HD23 1 1 11 4779 1 1 24 LEU HG H 2.080 -9.158 -3.346 1.00 . A A . 24 LEU HG 1 1 11 4780 1 1 24 LEU N N 4.826 -8.145 -0.397 1.00 . A A . 24 LEU N 1 1 11 4781 1 1 24 LEU O O 3.977 -11.007 -2.206 1.00 . A A . 24 LEU O 1 1 11 4782 1 1 25 MET C C 6.995 -11.301 -3.071 1.00 . A A . 25 MET C 1 1 11 4783 1 1 25 MET CA C 6.174 -10.215 -3.773 1.00 . A A . 25 MET CA 1 1 11 4784 1 1 25 MET CB C 7.058 -9.331 -4.664 1.00 . A A . 25 MET CB 1 1 11 4785 1 1 25 MET CE C 4.610 -8.181 -7.885 1.00 . A A . 25 MET CE 1 1 11 4786 1 1 25 MET CG C 6.230 -8.523 -5.671 1.00 . A A . 25 MET CG 1 1 11 4787 1 1 25 MET H H 5.763 -8.457 -2.625 1.00 . A A . 25 MET H 1 1 11 4788 1 1 25 MET HA H 5.445 -10.718 -4.409 1.00 . A A . 25 MET HA 1 1 11 4789 1 1 25 MET HB2 H 7.638 -8.649 -4.043 1.00 . A A . 25 MET HB2 1 1 11 4790 1 1 25 MET HB3 H 7.752 -9.960 -5.223 1.00 . A A . 25 MET HB3 1 1 11 4791 1 1 25 MET HE1 H 5.328 -7.436 -8.228 1.00 . A A . 25 MET HE1 1 1 11 4792 1 1 25 MET HE2 H 4.090 -8.604 -8.744 1.00 . A A . 25 MET HE2 1 1 11 4793 1 1 25 MET HE3 H 3.886 -7.709 -7.221 1.00 . A A . 25 MET HE3 1 1 11 4794 1 1 25 MET HG2 H 5.431 -7.998 -5.151 1.00 . A A . 25 MET HG2 1 1 11 4795 1 1 25 MET HG3 H 6.884 -7.784 -6.132 1.00 . A A . 25 MET HG3 1 1 11 4796 1 1 25 MET N N 5.450 -9.404 -2.805 1.00 . A A . 25 MET N 1 1 11 4797 1 1 25 MET O O 6.978 -12.449 -3.513 1.00 . A A . 25 MET O 1 1 11 4798 1 1 25 MET SD S 5.478 -9.501 -6.999 1.00 . A A . 25 MET SD 1 1 11 4799 1 1 26 ASN C C 7.665 -13.049 -0.680 1.00 . A A . 26 ASN C 1 1 11 4800 1 1 26 ASN CA C 8.519 -11.906 -1.238 1.00 . A A . 26 ASN CA 1 1 11 4801 1 1 26 ASN CB C 9.287 -11.216 -0.096 1.00 . A A . 26 ASN CB 1 1 11 4802 1 1 26 ASN CG C 10.243 -10.108 -0.540 1.00 . A A . 26 ASN CG 1 1 11 4803 1 1 26 ASN H H 7.684 -9.993 -1.673 1.00 . A A . 26 ASN H 1 1 11 4804 1 1 26 ASN HA H 9.242 -12.351 -1.923 1.00 . A A . 26 ASN HA 1 1 11 4805 1 1 26 ASN HB2 H 8.577 -10.797 0.617 1.00 . A A . 26 ASN HB2 1 1 11 4806 1 1 26 ASN HB3 H 9.878 -11.972 0.424 1.00 . A A . 26 ASN HB3 1 1 11 4807 1 1 26 ASN HD21 H 10.818 -11.125 -2.216 1.00 . A A . 26 ASN HD21 1 1 11 4808 1 1 26 ASN HD22 H 11.564 -9.561 -1.981 1.00 . A A . 26 ASN HD22 1 1 11 4809 1 1 26 ASN N N 7.705 -10.955 -1.988 1.00 . A A . 26 ASN N 1 1 11 4810 1 1 26 ASN ND2 N 10.930 -10.283 -1.671 1.00 . A A . 26 ASN ND2 1 1 11 4811 1 1 26 ASN O O 8.002 -14.214 -0.878 1.00 . A A . 26 ASN O 1 1 11 4812 1 1 26 ASN OD1 O 10.368 -9.095 0.144 1.00 . A A . 26 ASN OD1 1 1 11 4813 1 1 27 THR C C 4.923 -14.497 -0.434 1.00 . A A . 27 THR C 1 1 11 4814 1 1 27 THR CA C 5.698 -13.718 0.630 1.00 . A A . 27 THR CA 1 1 11 4815 1 1 27 THR CB C 4.782 -13.065 1.678 1.00 . A A . 27 THR CB 1 1 11 4816 1 1 27 THR CG2 C 3.665 -12.195 1.095 1.00 . A A . 27 THR CG2 1 1 11 4817 1 1 27 THR H H 6.337 -11.745 0.136 1.00 . A A . 27 THR H 1 1 11 4818 1 1 27 THR HA H 6.334 -14.426 1.166 1.00 . A A . 27 THR HA 1 1 11 4819 1 1 27 THR HB H 5.404 -12.434 2.306 1.00 . A A . 27 THR HB 1 1 11 4820 1 1 27 THR HG1 H 3.673 -13.636 3.171 1.00 . A A . 27 THR HG1 1 1 11 4821 1 1 27 THR HG21 H 2.933 -12.806 0.567 1.00 . A A . 27 THR HG21 1 1 11 4822 1 1 27 THR HG22 H 3.158 -11.669 1.903 1.00 . A A . 27 THR HG22 1 1 11 4823 1 1 27 THR HG23 H 4.087 -11.463 0.412 1.00 . A A . 27 THR HG23 1 1 11 4824 1 1 27 THR N N 6.569 -12.722 0.017 1.00 . A A . 27 THR N 1 1 11 4825 1 1 27 THR O O 4.791 -15.715 -0.342 1.00 . A A . 27 THR O 1 1 11 4826 1 1 27 THR OG1 O 4.203 -14.062 2.493 1.00 . A A . 27 THR OG1 1 1 11 4827 1 1 28 NH2 HN1 H 4.535 -12.800 -1.511 1.00 . A A . 28 NH2 HN1 1 1 11 4828 1 1 28 NH2 HN2 H 3.879 -14.285 -2.156 1.00 . A A . 28 NH2 HN2 1 1 11 4829 1 1 28 NH2 N N 4.410 -13.802 -1.452 1.00 . A A . 28 NH2 N 1 1 12 4830 1 1 1 SER C C -10.629 -3.690 4.996 1.00 . A A . 1 SER C 1 1 12 4831 1 1 1 SER CA C -11.615 -2.545 4.739 1.00 . A A . 1 SER CA 1 1 12 4832 1 1 1 SER CB C -13.012 -3.028 4.317 1.00 . A A . 1 SER CB 1 1 12 4833 1 1 1 SER H1 H -10.180 -1.237 4.088 1.00 . A A . 1 SER H1 1 1 12 4834 1 1 1 SER H2 H -10.955 -2.035 2.872 1.00 . A A . 1 SER H2 1 1 12 4835 1 1 1 SER H3 H -11.714 -0.805 3.667 1.00 . A A . 1 SER H3 1 1 12 4836 1 1 1 SER HA H -11.736 -2.008 5.680 1.00 . A A . 1 SER HA 1 1 12 4837 1 1 1 SER HB2 H -13.393 -3.732 5.058 1.00 . A A . 1 SER HB2 1 1 12 4838 1 1 1 SER HB3 H -13.686 -2.172 4.275 1.00 . A A . 1 SER HB3 1 1 12 4839 1 1 1 SER HG H -12.560 -3.079 2.413 1.00 . A A . 1 SER HG 1 1 12 4840 1 1 1 SER N N -11.075 -1.580 3.767 1.00 . A A . 1 SER N 1 1 12 4841 1 1 1 SER O O -9.776 -3.574 5.874 1.00 . A A . 1 SER O 1 1 12 4842 1 1 1 SER OG O -13.000 -3.653 3.047 1.00 . A A . 1 SER OG 1 1 12 4843 1 1 2 GLN C C -8.594 -5.747 3.532 1.00 . A A . 2 GLN C 1 1 12 4844 1 1 2 GLN CA C -9.886 -5.961 4.328 1.00 . A A . 2 GLN CA 1 1 12 4845 1 1 2 GLN CB C -10.662 -7.213 3.885 1.00 . A A . 2 GLN CB 1 1 12 4846 1 1 2 GLN CD C -11.810 -8.436 1.992 1.00 . A A . 2 GLN CD 1 1 12 4847 1 1 2 GLN CG C -11.335 -7.081 2.508 1.00 . A A . 2 GLN CG 1 1 12 4848 1 1 2 GLN H H -11.476 -4.792 3.535 1.00 . A A . 2 GLN H 1 1 12 4849 1 1 2 GLN HA H -9.605 -6.118 5.370 1.00 . A A . 2 GLN HA 1 1 12 4850 1 1 2 GLN HB2 H -9.973 -8.059 3.880 1.00 . A A . 2 GLN HB2 1 1 12 4851 1 1 2 GLN HB3 H -11.440 -7.422 4.621 1.00 . A A . 2 GLN HB3 1 1 12 4852 1 1 2 GLN HE21 H -9.898 -9.011 1.593 1.00 . A A . 2 GLN HE21 1 1 12 4853 1 1 2 GLN HE22 H -11.138 -10.189 1.212 1.00 . A A . 2 GLN HE22 1 1 12 4854 1 1 2 GLN HG2 H -12.198 -6.420 2.586 1.00 . A A . 2 GLN HG2 1 1 12 4855 1 1 2 GLN HG3 H -10.647 -6.660 1.776 1.00 . A A . 2 GLN HG3 1 1 12 4856 1 1 2 GLN N N -10.741 -4.783 4.230 1.00 . A A . 2 GLN N 1 1 12 4857 1 1 2 GLN NE2 N -10.870 -9.281 1.563 1.00 . A A . 2 GLN NE2 1 1 12 4858 1 1 2 GLN O O -8.285 -6.497 2.608 1.00 . A A . 2 GLN O 1 1 12 4859 1 1 2 GLN OE1 O -13.006 -8.717 1.978 1.00 . A A . 2 GLN OE1 1 1 12 4860 1 1 3 GLY C C -7.010 -3.684 1.828 1.00 . A A . 3 GLY C 1 1 12 4861 1 1 3 GLY CA C -6.645 -4.292 3.181 1.00 . A A . 3 GLY CA 1 1 12 4862 1 1 3 GLY H H -8.140 -4.142 4.681 1.00 . A A . 3 GLY H 1 1 12 4863 1 1 3 GLY HA2 H -6.123 -3.546 3.775 1.00 . A A . 3 GLY HA2 1 1 12 4864 1 1 3 GLY HA3 H -5.985 -5.149 3.039 1.00 . A A . 3 GLY HA3 1 1 12 4865 1 1 3 GLY N N -7.839 -4.705 3.897 1.00 . A A . 3 GLY N 1 1 12 4866 1 1 3 GLY O O -6.352 -3.964 0.827 1.00 . A A . 3 GLY O 1 1 12 4867 1 1 4 THR C C -8.994 -0.804 0.868 1.00 . A A . 4 THR C 1 1 12 4868 1 1 4 THR CA C -8.648 -2.272 0.610 1.00 . A A . 4 THR CA 1 1 12 4869 1 1 4 THR CB C -9.905 -3.059 0.200 1.00 . A A . 4 THR CB 1 1 12 4870 1 1 4 THR CG2 C -9.558 -4.457 -0.323 1.00 . A A . 4 THR CG2 1 1 12 4871 1 1 4 THR H H -8.531 -2.652 2.681 1.00 . A A . 4 THR H 1 1 12 4872 1 1 4 THR HA H -7.937 -2.310 -0.214 1.00 . A A . 4 THR HA 1 1 12 4873 1 1 4 THR HB H -10.417 -2.523 -0.601 1.00 . A A . 4 THR HB 1 1 12 4874 1 1 4 THR HG1 H -10.384 -3.744 1.955 1.00 . A A . 4 THR HG1 1 1 12 4875 1 1 4 THR HG21 H -8.877 -4.376 -1.170 1.00 . A A . 4 THR HG21 1 1 12 4876 1 1 4 THR HG22 H -9.089 -5.055 0.457 1.00 . A A . 4 THR HG22 1 1 12 4877 1 1 4 THR HG23 H -10.470 -4.958 -0.649 1.00 . A A . 4 THR HG23 1 1 12 4878 1 1 4 THR N N -8.067 -2.862 1.809 1.00 . A A . 4 THR N 1 1 12 4879 1 1 4 THR O O -9.064 -0.375 2.019 1.00 . A A . 4 THR O 1 1 12 4880 1 1 4 THR OG1 O -10.792 -3.179 1.294 1.00 . A A . 4 THR OG1 1 1 12 4881 1 1 5 THR C C -8.947 2.234 0.744 1.00 . A A . 5 THR C 1 1 12 4882 1 1 5 THR CA C -9.687 1.327 -0.249 1.00 . A A . 5 THR CA 1 1 12 4883 1 1 5 THR CB C -11.223 1.356 -0.124 1.00 . A A . 5 THR CB 1 1 12 4884 1 1 5 THR CG2 C -11.797 2.754 -0.382 1.00 . A A . 5 THR CG2 1 1 12 4885 1 1 5 THR H H -9.120 -0.505 -1.117 1.00 . A A . 5 THR H 1 1 12 4886 1 1 5 THR HA H -9.443 1.700 -1.244 1.00 . A A . 5 THR HA 1 1 12 4887 1 1 5 THR HB H -11.531 1.013 0.864 1.00 . A A . 5 THR HB 1 1 12 4888 1 1 5 THR HG1 H -11.539 0.762 -1.951 1.00 . A A . 5 THR HG1 1 1 12 4889 1 1 5 THR HG21 H -11.449 3.463 0.368 1.00 . A A . 5 THR HG21 1 1 12 4890 1 1 5 THR HG22 H -11.496 3.104 -1.370 1.00 . A A . 5 THR HG22 1 1 12 4891 1 1 5 THR HG23 H -12.885 2.711 -0.339 1.00 . A A . 5 THR HG23 1 1 12 4892 1 1 5 THR N N -9.222 -0.056 -0.219 1.00 . A A . 5 THR N 1 1 12 4893 1 1 5 THR O O -7.862 2.719 0.433 1.00 . A A . 5 THR O 1 1 12 4894 1 1 5 THR OG1 O -11.783 0.468 -1.071 1.00 . A A . 5 THR OG1 1 1 12 4895 1 1 6 SER C C -7.627 2.858 3.487 1.00 . A A . 6 SER C 1 1 12 4896 1 1 6 SER CA C -8.971 3.357 2.949 1.00 . A A . 6 SER CA 1 1 12 4897 1 1 6 SER CB C -9.995 3.495 4.080 1.00 . A A . 6 SER CB 1 1 12 4898 1 1 6 SER H H -10.387 2.010 2.161 1.00 . A A . 6 SER H 1 1 12 4899 1 1 6 SER HA H -8.818 4.345 2.510 1.00 . A A . 6 SER HA 1 1 12 4900 1 1 6 SER HB2 H -9.573 4.084 4.895 1.00 . A A . 6 SER HB2 1 1 12 4901 1 1 6 SER HB3 H -10.882 4.004 3.702 1.00 . A A . 6 SER HB3 1 1 12 4902 1 1 6 SER HG H -9.611 1.794 4.952 1.00 . A A . 6 SER HG 1 1 12 4903 1 1 6 SER N N -9.520 2.473 1.930 1.00 . A A . 6 SER N 1 1 12 4904 1 1 6 SER O O -6.781 3.665 3.866 1.00 . A A . 6 SER O 1 1 12 4905 1 1 6 SER OG O -10.377 2.220 4.560 1.00 . A A . 6 SER OG 1 1 12 4906 1 1 7 GLU C C -5.221 0.812 2.868 1.00 . A A . 7 GLU C 1 1 12 4907 1 1 7 GLU CA C -6.226 0.900 4.013 1.00 . A A . 7 GLU CA 1 1 12 4908 1 1 7 GLU CB C -6.583 -0.481 4.579 1.00 . A A . 7 GLU CB 1 1 12 4909 1 1 7 GLU CD C -4.578 -0.415 6.147 1.00 . A A . 7 GLU CD 1 1 12 4910 1 1 7 GLU CG C -5.364 -1.232 5.126 1.00 . A A . 7 GLU CG 1 1 12 4911 1 1 7 GLU H H -8.129 0.933 3.095 1.00 . A A . 7 GLU H 1 1 12 4912 1 1 7 GLU HA H -5.805 1.509 4.813 1.00 . A A . 7 GLU HA 1 1 12 4913 1 1 7 GLU HB2 H -7.306 -0.351 5.384 1.00 . A A . 7 GLU HB2 1 1 12 4914 1 1 7 GLU HB3 H -7.041 -1.086 3.795 1.00 . A A . 7 GLU HB3 1 1 12 4915 1 1 7 GLU HG2 H -5.704 -2.149 5.608 1.00 . A A . 7 GLU HG2 1 1 12 4916 1 1 7 GLU HG3 H -4.718 -1.503 4.293 1.00 . A A . 7 GLU HG3 1 1 12 4917 1 1 7 GLU N N -7.436 1.535 3.521 1.00 . A A . 7 GLU N 1 1 12 4918 1 1 7 GLU O O -4.033 1.058 3.060 1.00 . A A . 7 GLU O 1 1 12 4919 1 1 7 GLU OE1 O -5.149 -0.155 7.229 1.00 . A A . 7 GLU OE1 1 1 12 4920 1 1 7 GLU OE2 O -3.421 -0.062 5.830 1.00 . A A . 7 GLU OE2 1 1 12 4921 1 1 8 TYR C C -4.248 1.856 0.236 1.00 . A A . 8 TYR C 1 1 12 4922 1 1 8 TYR CA C -4.926 0.500 0.453 1.00 . A A . 8 TYR CA 1 1 12 4923 1 1 8 TYR CB C -5.815 0.126 -0.732 1.00 . A A . 8 TYR CB 1 1 12 4924 1 1 8 TYR CD1 C -4.160 -0.814 -2.372 1.00 . A A . 8 TYR CD1 1 1 12 4925 1 1 8 TYR CD2 C -5.143 1.365 -2.824 1.00 . A A . 8 TYR CD2 1 1 12 4926 1 1 8 TYR CE1 C -3.313 -0.664 -3.478 1.00 . A A . 8 TYR CE1 1 1 12 4927 1 1 8 TYR CE2 C -4.313 1.506 -3.946 1.00 . A A . 8 TYR CE2 1 1 12 4928 1 1 8 TYR CG C -5.082 0.194 -2.049 1.00 . A A . 8 TYR CG 1 1 12 4929 1 1 8 TYR CZ C -3.398 0.489 -4.278 1.00 . A A . 8 TYR CZ 1 1 12 4930 1 1 8 TYR H H -6.701 0.286 1.587 1.00 . A A . 8 TYR H 1 1 12 4931 1 1 8 TYR HA H -4.148 -0.256 0.548 1.00 . A A . 8 TYR HA 1 1 12 4932 1 1 8 TYR HB2 H -6.181 -0.889 -0.588 1.00 . A A . 8 TYR HB2 1 1 12 4933 1 1 8 TYR HB3 H -6.670 0.798 -0.774 1.00 . A A . 8 TYR HB3 1 1 12 4934 1 1 8 TYR HD1 H -4.089 -1.698 -1.759 1.00 . A A . 8 TYR HD1 1 1 12 4935 1 1 8 TYR HD2 H -5.807 2.172 -2.548 1.00 . A A . 8 TYR HD2 1 1 12 4936 1 1 8 TYR HE1 H -2.598 -1.441 -3.695 1.00 . A A . 8 TYR HE1 1 1 12 4937 1 1 8 TYR HE2 H -4.386 2.409 -4.530 1.00 . A A . 8 TYR HE2 1 1 12 4938 1 1 8 TYR HH H -2.746 1.425 -5.864 1.00 . A A . 8 TYR HH 1 1 12 4939 1 1 8 TYR N N -5.716 0.490 1.669 1.00 . A A . 8 TYR N 1 1 12 4940 1 1 8 TYR O O -3.086 1.895 -0.161 1.00 . A A . 8 TYR O 1 1 12 4941 1 1 8 TYR OH O -2.595 0.615 -5.373 1.00 . A A . 8 TYR OH 1 1 12 4942 1 1 9 SER C C -3.180 4.575 1.167 1.00 . A A . 9 SER C 1 1 12 4943 1 1 9 SER CA C -4.472 4.323 0.380 1.00 . A A . 9 SER CA 1 1 12 4944 1 1 9 SER CB C -5.554 5.317 0.814 1.00 . A A . 9 SER CB 1 1 12 4945 1 1 9 SER H H -5.928 2.837 0.802 1.00 . A A . 9 SER H 1 1 12 4946 1 1 9 SER HA H -4.261 4.506 -0.674 1.00 . A A . 9 SER HA 1 1 12 4947 1 1 9 SER HB2 H -5.862 5.113 1.840 1.00 . A A . 9 SER HB2 1 1 12 4948 1 1 9 SER HB3 H -5.155 6.331 0.763 1.00 . A A . 9 SER HB3 1 1 12 4949 1 1 9 SER HG H -7.040 4.355 0.003 1.00 . A A . 9 SER HG 1 1 12 4950 1 1 9 SER N N -4.968 2.955 0.506 1.00 . A A . 9 SER N 1 1 12 4951 1 1 9 SER O O -2.460 5.521 0.852 1.00 . A A . 9 SER O 1 1 12 4952 1 1 9 SER OG O -6.671 5.241 -0.045 1.00 . A A . 9 SER OG 1 1 12 4953 1 1 10 LYS C C -0.510 3.313 1.946 1.00 . A A . 10 LYS C 1 1 12 4954 1 1 10 LYS CA C -1.606 3.825 2.877 1.00 . A A . 10 LYS CA 1 1 12 4955 1 1 10 LYS CB C -1.682 3.034 4.189 1.00 . A A . 10 LYS CB 1 1 12 4956 1 1 10 LYS CD C -2.934 4.867 5.542 1.00 . A A . 10 LYS CD 1 1 12 4957 1 1 10 LYS CE C -3.709 5.789 4.587 1.00 . A A . 10 LYS CE 1 1 12 4958 1 1 10 LYS CG C -2.879 3.401 5.083 1.00 . A A . 10 LYS CG 1 1 12 4959 1 1 10 LYS H H -3.470 2.970 2.407 1.00 . A A . 10 LYS H 1 1 12 4960 1 1 10 LYS HA H -1.376 4.861 3.119 1.00 . A A . 10 LYS HA 1 1 12 4961 1 1 10 LYS HB2 H -1.743 1.968 3.963 1.00 . A A . 10 LYS HB2 1 1 12 4962 1 1 10 LYS HB3 H -0.764 3.200 4.751 1.00 . A A . 10 LYS HB3 1 1 12 4963 1 1 10 LYS HD2 H -3.460 4.882 6.498 1.00 . A A . 10 LYS HD2 1 1 12 4964 1 1 10 LYS HD3 H -1.926 5.250 5.703 1.00 . A A . 10 LYS HD3 1 1 12 4965 1 1 10 LYS HE2 H -3.148 5.978 3.676 1.00 . A A . 10 LYS HE2 1 1 12 4966 1 1 10 LYS HE3 H -4.662 5.332 4.322 1.00 . A A . 10 LYS HE3 1 1 12 4967 1 1 10 LYS HG2 H -3.819 3.138 4.599 1.00 . A A . 10 LYS HG2 1 1 12 4968 1 1 10 LYS HG3 H -2.793 2.783 5.978 1.00 . A A . 10 LYS HG3 1 1 12 4969 1 1 10 LYS HZ1 H -4.529 6.960 6.048 1.00 . A A . 10 LYS HZ1 1 1 12 4970 1 1 10 LYS HZ2 H -3.107 7.541 5.448 1.00 . A A . 10 LYS HZ2 1 1 12 4971 1 1 10 LYS HZ3 H -4.492 7.676 4.563 1.00 . A A . 10 LYS HZ3 1 1 12 4972 1 1 10 LYS N N -2.866 3.743 2.168 1.00 . A A . 10 LYS N 1 1 12 4973 1 1 10 LYS NZ N -3.980 7.093 5.211 1.00 . A A . 10 LYS NZ 1 1 12 4974 1 1 10 LYS O O 0.396 4.065 1.594 1.00 . A A . 10 LYS O 1 1 12 4975 1 1 11 TYR C C 0.004 1.720 -0.802 1.00 . A A . 11 TYR C 1 1 12 4976 1 1 11 TYR CA C 0.364 1.412 0.646 1.00 . A A . 11 TYR CA 1 1 12 4977 1 1 11 TYR CB C 0.488 -0.077 0.970 1.00 . A A . 11 TYR CB 1 1 12 4978 1 1 11 TYR CD1 C -1.189 -0.995 2.611 1.00 . A A . 11 TYR CD1 1 1 12 4979 1 1 11 TYR CD2 C -1.451 -1.551 0.256 1.00 . A A . 11 TYR CD2 1 1 12 4980 1 1 11 TYR CE1 C -2.226 -1.880 2.937 1.00 . A A . 11 TYR CE1 1 1 12 4981 1 1 11 TYR CE2 C -2.503 -2.423 0.582 1.00 . A A . 11 TYR CE2 1 1 12 4982 1 1 11 TYR CG C -0.791 -0.833 1.271 1.00 . A A . 11 TYR CG 1 1 12 4983 1 1 11 TYR CZ C -2.889 -2.589 1.922 1.00 . A A . 11 TYR CZ 1 1 12 4984 1 1 11 TYR H H -1.465 1.544 1.645 1.00 . A A . 11 TYR H 1 1 12 4985 1 1 11 TYR HA H 1.342 1.852 0.841 1.00 . A A . 11 TYR HA 1 1 12 4986 1 1 11 TYR HB2 H 1.004 -0.565 0.148 1.00 . A A . 11 TYR HB2 1 1 12 4987 1 1 11 TYR HB3 H 1.119 -0.144 1.855 1.00 . A A . 11 TYR HB3 1 1 12 4988 1 1 11 TYR HD1 H -0.679 -0.460 3.399 1.00 . A A . 11 TYR HD1 1 1 12 4989 1 1 11 TYR HD2 H -1.135 -1.463 -0.773 1.00 . A A . 11 TYR HD2 1 1 12 4990 1 1 11 TYR HE1 H -2.499 -2.027 3.971 1.00 . A A . 11 TYR HE1 1 1 12 4991 1 1 11 TYR HE2 H -2.994 -2.992 -0.194 1.00 . A A . 11 TYR HE2 1 1 12 4992 1 1 11 TYR HH H -4.366 -3.795 1.478 1.00 . A A . 11 TYR HH 1 1 12 4993 1 1 11 TYR N N -0.608 2.051 1.509 1.00 . A A . 11 TYR N 1 1 12 4994 1 1 11 TYR O O -0.255 0.845 -1.625 1.00 . A A . 11 TYR O 1 1 12 4995 1 1 11 TYR OH O -3.901 -3.442 2.242 1.00 . A A . 11 TYR OH 1 1 12 4996 1 1 12 LEU C C 0.719 4.853 -2.439 1.00 . A A . 12 LEU C 1 1 12 4997 1 1 12 LEU CA C -0.254 3.674 -2.328 1.00 . A A . 12 LEU CA 1 1 12 4998 1 1 12 LEU CB C -1.731 4.088 -2.338 1.00 . A A . 12 LEU CB 1 1 12 4999 1 1 12 LEU CD1 C -1.903 6.394 -3.460 1.00 . A A . 12 LEU CD1 1 1 12 5000 1 1 12 LEU CD2 C -1.822 4.309 -4.877 1.00 . A A . 12 LEU CD2 1 1 12 5001 1 1 12 LEU CG C -2.254 4.903 -3.532 1.00 . A A . 12 LEU CG 1 1 12 5002 1 1 12 LEU H H 0.237 3.626 -0.289 1.00 . A A . 12 LEU H 1 1 12 5003 1 1 12 LEU HA H -0.073 2.944 -3.110 1.00 . A A . 12 LEU HA 1 1 12 5004 1 1 12 LEU HB2 H -2.311 3.164 -2.299 1.00 . A A . 12 LEU HB2 1 1 12 5005 1 1 12 LEU HB3 H -1.936 4.646 -1.429 1.00 . A A . 12 LEU HB3 1 1 12 5006 1 1 12 LEU HD11 H -0.849 6.568 -3.665 1.00 . A A . 12 LEU HD11 1 1 12 5007 1 1 12 LEU HD12 H -2.487 6.934 -4.205 1.00 . A A . 12 LEU HD12 1 1 12 5008 1 1 12 LEU HD13 H -2.149 6.788 -2.473 1.00 . A A . 12 LEU HD13 1 1 12 5009 1 1 12 LEU HD21 H -0.751 4.439 -5.028 1.00 . A A . 12 LEU HD21 1 1 12 5010 1 1 12 LEU HD22 H -2.058 3.248 -4.904 1.00 . A A . 12 LEU HD22 1 1 12 5011 1 1 12 LEU HD23 H -2.354 4.812 -5.685 1.00 . A A . 12 LEU HD23 1 1 12 5012 1 1 12 LEU HG H -3.342 4.845 -3.469 1.00 . A A . 12 LEU HG 1 1 12 5013 1 1 12 LEU N N 0.011 3.024 -1.067 1.00 . A A . 12 LEU N 1 1 12 5014 1 1 12 LEU O O 1.325 5.059 -3.487 1.00 . A A . 12 LEU O 1 1 12 5015 1 1 13 ASP C C 3.120 6.643 -1.734 1.00 . A A . 13 ASP C 1 1 12 5016 1 1 13 ASP CA C 1.725 6.747 -1.104 1.00 . A A . 13 ASP CA 1 1 12 5017 1 1 13 ASP CB C 1.742 7.016 0.410 1.00 . A A . 13 ASP CB 1 1 12 5018 1 1 13 ASP CG C 2.579 8.233 0.796 1.00 . A A . 13 ASP CG 1 1 12 5019 1 1 13 ASP H H 0.291 5.337 -0.537 1.00 . A A . 13 ASP H 1 1 12 5020 1 1 13 ASP HA H 1.269 7.607 -1.572 1.00 . A A . 13 ASP HA 1 1 12 5021 1 1 13 ASP HB2 H 0.717 7.189 0.744 1.00 . A A . 13 ASP HB2 1 1 12 5022 1 1 13 ASP HB3 H 2.115 6.133 0.929 1.00 . A A . 13 ASP HB3 1 1 12 5023 1 1 13 ASP N N 0.863 5.595 -1.329 1.00 . A A . 13 ASP N 1 1 12 5024 1 1 13 ASP O O 3.297 6.998 -2.898 1.00 . A A . 13 ASP O 1 1 12 5025 1 1 13 ASP OD1 O 2.278 9.326 0.270 1.00 . A A . 13 ASP OD1 1 1 12 5026 1 1 13 ASP OD2 O 3.508 8.046 1.612 1.00 . A A . 13 ASP OD2 1 1 12 5027 1 1 14 SER C C 6.301 5.078 -0.693 1.00 . A A . 14 SER C 1 1 12 5028 1 1 14 SER CA C 5.515 6.208 -1.364 1.00 . A A . 14 SER CA 1 1 12 5029 1 1 14 SER CB C 6.130 7.598 -1.133 1.00 . A A . 14 SER CB 1 1 12 5030 1 1 14 SER H H 3.871 5.969 -0.010 1.00 . A A . 14 SER H 1 1 12 5031 1 1 14 SER HA H 5.568 6.014 -2.437 1.00 . A A . 14 SER HA 1 1 12 5032 1 1 14 SER HB2 H 7.182 7.582 -1.421 1.00 . A A . 14 SER HB2 1 1 12 5033 1 1 14 SER HB3 H 5.613 8.331 -1.754 1.00 . A A . 14 SER HB3 1 1 12 5034 1 1 14 SER HG H 5.094 8.084 0.448 1.00 . A A . 14 SER HG 1 1 12 5035 1 1 14 SER N N 4.114 6.208 -0.956 1.00 . A A . 14 SER N 1 1 12 5036 1 1 14 SER O O 6.328 3.966 -1.216 1.00 . A A . 14 SER O 1 1 12 5037 1 1 14 SER OG O 6.024 7.998 0.219 1.00 . A A . 14 SER OG 1 1 12 5038 1 1 15 ARG C C 7.033 3.133 1.450 1.00 . A A . 15 ARG C 1 1 12 5039 1 1 15 ARG CA C 7.816 4.404 1.140 1.00 . A A . 15 ARG CA 1 1 12 5040 1 1 15 ARG CB C 8.399 5.053 2.407 1.00 . A A . 15 ARG CB 1 1 12 5041 1 1 15 ARG CD C 8.973 2.944 3.800 1.00 . A A . 15 ARG CD 1 1 12 5042 1 1 15 ARG CG C 9.483 4.224 3.119 1.00 . A A . 15 ARG CG 1 1 12 5043 1 1 15 ARG CZ C 9.805 1.283 5.456 1.00 . A A . 15 ARG CZ 1 1 12 5044 1 1 15 ARG H H 6.876 6.291 0.821 1.00 . A A . 15 ARG H 1 1 12 5045 1 1 15 ARG HA H 8.645 4.153 0.475 1.00 . A A . 15 ARG HA 1 1 12 5046 1 1 15 ARG HB2 H 8.864 5.994 2.109 1.00 . A A . 15 ARG HB2 1 1 12 5047 1 1 15 ARG HB3 H 7.602 5.288 3.114 1.00 . A A . 15 ARG HB3 1 1 12 5048 1 1 15 ARG HD2 H 8.051 3.155 4.345 1.00 . A A . 15 ARG HD2 1 1 12 5049 1 1 15 ARG HD3 H 8.784 2.172 3.056 1.00 . A A . 15 ARG HD3 1 1 12 5050 1 1 15 ARG HE H 10.841 2.907 4.817 1.00 . A A . 15 ARG HE 1 1 12 5051 1 1 15 ARG HG2 H 10.271 3.967 2.410 1.00 . A A . 15 ARG HG2 1 1 12 5052 1 1 15 ARG HG3 H 9.914 4.863 3.890 1.00 . A A . 15 ARG HG3 1 1 12 5053 1 1 15 ARG HH11 H 7.916 0.880 4.781 1.00 . A A . 15 ARG HH11 1 1 12 5054 1 1 15 ARG HH12 H 8.559 -0.264 5.934 1.00 . A A . 15 ARG HH12 1 1 12 5055 1 1 15 ARG HH21 H 11.653 1.388 6.318 1.00 . A A . 15 ARG HH21 1 1 12 5056 1 1 15 ARG HH22 H 10.676 0.023 6.806 1.00 . A A . 15 ARG HH22 1 1 12 5057 1 1 15 ARG N N 6.953 5.354 0.446 1.00 . A A . 15 ARG N 1 1 12 5058 1 1 15 ARG NE N 9.970 2.403 4.732 1.00 . A A . 15 ARG NE 1 1 12 5059 1 1 15 ARG NH1 N 8.666 0.577 5.386 1.00 . A A . 15 ARG NH1 1 1 12 5060 1 1 15 ARG NH2 N 10.792 0.864 6.259 1.00 . A A . 15 ARG NH2 1 1 12 5061 1 1 15 ARG O O 7.368 2.063 0.950 1.00 . A A . 15 ARG O 1 1 12 5062 1 1 16 ARG C C 4.499 1.424 1.506 1.00 . A A . 16 ARG C 1 1 12 5063 1 1 16 ARG CA C 5.135 2.163 2.689 1.00 . A A . 16 ARG CA 1 1 12 5064 1 1 16 ARG CB C 4.087 2.656 3.697 1.00 . A A . 16 ARG CB 1 1 12 5065 1 1 16 ARG CD C 2.168 4.199 4.199 1.00 . A A . 16 ARG CD 1 1 12 5066 1 1 16 ARG CG C 3.250 3.832 3.179 1.00 . A A . 16 ARG CG 1 1 12 5067 1 1 16 ARG CZ C 0.796 6.272 4.562 1.00 . A A . 16 ARG CZ 1 1 12 5068 1 1 16 ARG H H 5.784 4.183 2.638 1.00 . A A . 16 ARG H 1 1 12 5069 1 1 16 ARG HA H 5.763 1.447 3.219 1.00 . A A . 16 ARG HA 1 1 12 5070 1 1 16 ARG HB2 H 3.425 1.825 3.948 1.00 . A A . 16 ARG HB2 1 1 12 5071 1 1 16 ARG HB3 H 4.601 2.970 4.607 1.00 . A A . 16 ARG HB3 1 1 12 5072 1 1 16 ARG HD2 H 1.473 3.364 4.292 1.00 . A A . 16 ARG HD2 1 1 12 5073 1 1 16 ARG HD3 H 2.639 4.379 5.164 1.00 . A A . 16 ARG HD3 1 1 12 5074 1 1 16 ARG HE H 1.323 5.501 2.767 1.00 . A A . 16 ARG HE 1 1 12 5075 1 1 16 ARG HG2 H 3.885 4.703 3.021 1.00 . A A . 16 ARG HG2 1 1 12 5076 1 1 16 ARG HG3 H 2.788 3.557 2.233 1.00 . A A . 16 ARG HG3 1 1 12 5077 1 1 16 ARG HH11 H 1.298 5.379 6.335 1.00 . A A . 16 ARG HH11 1 1 12 5078 1 1 16 ARG HH12 H 0.336 6.830 6.471 1.00 . A A . 16 ARG HH12 1 1 12 5079 1 1 16 ARG HH21 H 0.110 7.395 3.000 1.00 . A A . 16 ARG HH21 1 1 12 5080 1 1 16 ARG HH22 H -0.346 7.965 4.589 1.00 . A A . 16 ARG HH22 1 1 12 5081 1 1 16 ARG N N 5.986 3.266 2.271 1.00 . A A . 16 ARG N 1 1 12 5082 1 1 16 ARG NE N 1.424 5.389 3.767 1.00 . A A . 16 ARG NE 1 1 12 5083 1 1 16 ARG NH1 N 0.814 6.150 5.898 1.00 . A A . 16 ARG NH1 1 1 12 5084 1 1 16 ARG NH2 N 0.132 7.294 4.005 1.00 . A A . 16 ARG NH2 1 1 12 5085 1 1 16 ARG O O 4.197 0.241 1.633 1.00 . A A . 16 ARG O 1 1 12 5086 1 1 17 ALA C C 4.688 0.544 -1.485 1.00 . A A . 17 ALA C 1 1 12 5087 1 1 17 ALA CA C 3.698 1.490 -0.816 1.00 . A A . 17 ALA CA 1 1 12 5088 1 1 17 ALA CB C 3.226 2.594 -1.763 1.00 . A A . 17 ALA CB 1 1 12 5089 1 1 17 ALA H H 4.645 3.039 0.270 1.00 . A A . 17 ALA H 1 1 12 5090 1 1 17 ALA HA H 2.830 0.904 -0.521 1.00 . A A . 17 ALA HA 1 1 12 5091 1 1 17 ALA HB1 H 2.616 3.299 -1.202 1.00 . A A . 17 ALA HB1 1 1 12 5092 1 1 17 ALA HB2 H 4.070 3.137 -2.180 1.00 . A A . 17 ALA HB2 1 1 12 5093 1 1 17 ALA HB3 H 2.641 2.163 -2.576 1.00 . A A . 17 ALA HB3 1 1 12 5094 1 1 17 ALA N N 4.304 2.092 0.361 1.00 . A A . 17 ALA N 1 1 12 5095 1 1 17 ALA O O 4.389 -0.629 -1.690 1.00 . A A . 17 ALA O 1 1 12 5096 1 1 18 GLN C C 7.345 -0.869 -1.442 1.00 . A A . 18 GLN C 1 1 12 5097 1 1 18 GLN CA C 6.973 0.291 -2.368 1.00 . A A . 18 GLN CA 1 1 12 5098 1 1 18 GLN CB C 8.159 1.239 -2.592 1.00 . A A . 18 GLN CB 1 1 12 5099 1 1 18 GLN CD C 6.698 2.314 -4.461 1.00 . A A . 18 GLN CD 1 1 12 5100 1 1 18 GLN CG C 8.098 2.038 -3.905 1.00 . A A . 18 GLN CG 1 1 12 5101 1 1 18 GLN H H 6.046 2.036 -1.598 1.00 . A A . 18 GLN H 1 1 12 5102 1 1 18 GLN HA H 6.661 -0.146 -3.317 1.00 . A A . 18 GLN HA 1 1 12 5103 1 1 18 GLN HB2 H 8.225 1.933 -1.752 1.00 . A A . 18 GLN HB2 1 1 12 5104 1 1 18 GLN HB3 H 9.082 0.657 -2.609 1.00 . A A . 18 GLN HB3 1 1 12 5105 1 1 18 GLN HE21 H 6.372 3.868 -3.171 1.00 . A A . 18 GLN HE21 1 1 12 5106 1 1 18 GLN HE22 H 5.093 3.544 -4.319 1.00 . A A . 18 GLN HE22 1 1 12 5107 1 1 18 GLN HG2 H 8.622 2.984 -3.759 1.00 . A A . 18 GLN HG2 1 1 12 5108 1 1 18 GLN HG3 H 8.634 1.463 -4.659 1.00 . A A . 18 GLN HG3 1 1 12 5109 1 1 18 GLN N N 5.877 1.058 -1.801 1.00 . A A . 18 GLN N 1 1 12 5110 1 1 18 GLN NE2 N 6.009 3.335 -3.950 1.00 . A A . 18 GLN NE2 1 1 12 5111 1 1 18 GLN O O 7.486 -1.998 -1.901 1.00 . A A . 18 GLN O 1 1 12 5112 1 1 18 GLN OE1 O 6.244 1.614 -5.363 1.00 . A A . 18 GLN OE1 1 1 12 5113 1 1 19 ASP C C 6.756 -2.706 0.874 1.00 . A A . 19 ASP C 1 1 12 5114 1 1 19 ASP CA C 7.806 -1.595 0.868 1.00 . A A . 19 ASP CA 1 1 12 5115 1 1 19 ASP CB C 7.915 -0.917 2.238 1.00 . A A . 19 ASP CB 1 1 12 5116 1 1 19 ASP CG C 8.279 -1.915 3.333 1.00 . A A . 19 ASP CG 1 1 12 5117 1 1 19 ASP H H 7.317 0.351 0.167 1.00 . A A . 19 ASP H 1 1 12 5118 1 1 19 ASP HA H 8.777 -2.029 0.623 1.00 . A A . 19 ASP HA 1 1 12 5119 1 1 19 ASP HB2 H 8.687 -0.147 2.194 1.00 . A A . 19 ASP HB2 1 1 12 5120 1 1 19 ASP HB3 H 6.966 -0.443 2.486 1.00 . A A . 19 ASP HB3 1 1 12 5121 1 1 19 ASP N N 7.483 -0.596 -0.141 1.00 . A A . 19 ASP N 1 1 12 5122 1 1 19 ASP O O 7.104 -3.885 0.848 1.00 . A A . 19 ASP O 1 1 12 5123 1 1 19 ASP OD1 O 9.489 -2.198 3.467 1.00 . A A . 19 ASP OD1 1 1 12 5124 1 1 19 ASP OD2 O 7.341 -2.378 4.018 1.00 . A A . 19 ASP OD2 1 1 12 5125 1 1 20 PHE C C 4.444 -4.101 -0.474 1.00 . A A . 20 PHE C 1 1 12 5126 1 1 20 PHE CA C 4.363 -3.263 0.806 1.00 . A A . 20 PHE CA 1 1 12 5127 1 1 20 PHE CB C 3.038 -2.503 0.903 1.00 . A A . 20 PHE CB 1 1 12 5128 1 1 20 PHE CD1 C 1.232 -3.737 -0.367 1.00 . A A . 20 PHE CD1 1 1 12 5129 1 1 20 PHE CD2 C 1.217 -3.818 2.068 1.00 . A A . 20 PHE CD2 1 1 12 5130 1 1 20 PHE CE1 C 0.091 -4.558 -0.401 1.00 . A A . 20 PHE CE1 1 1 12 5131 1 1 20 PHE CE2 C 0.064 -4.620 2.034 1.00 . A A . 20 PHE CE2 1 1 12 5132 1 1 20 PHE CG C 1.804 -3.378 0.867 1.00 . A A . 20 PHE CG 1 1 12 5133 1 1 20 PHE CZ C -0.496 -4.995 0.800 1.00 . A A . 20 PHE CZ 1 1 12 5134 1 1 20 PHE H H 5.250 -1.341 0.936 1.00 . A A . 20 PHE H 1 1 12 5135 1 1 20 PHE HA H 4.419 -3.932 1.665 1.00 . A A . 20 PHE HA 1 1 12 5136 1 1 20 PHE HB2 H 3.029 -1.952 1.844 1.00 . A A . 20 PHE HB2 1 1 12 5137 1 1 20 PHE HB3 H 2.982 -1.784 0.088 1.00 . A A . 20 PHE HB3 1 1 12 5138 1 1 20 PHE HD1 H 1.672 -3.383 -1.288 1.00 . A A . 20 PHE HD1 1 1 12 5139 1 1 20 PHE HD2 H 1.651 -3.537 3.018 1.00 . A A . 20 PHE HD2 1 1 12 5140 1 1 20 PHE HE1 H -0.339 -4.846 -1.349 1.00 . A A . 20 PHE HE1 1 1 12 5141 1 1 20 PHE HE2 H -0.392 -4.951 2.956 1.00 . A A . 20 PHE HE2 1 1 12 5142 1 1 20 PHE HZ H -1.379 -5.616 0.774 1.00 . A A . 20 PHE HZ 1 1 12 5143 1 1 20 PHE N N 5.473 -2.327 0.890 1.00 . A A . 20 PHE N 1 1 12 5144 1 1 20 PHE O O 4.139 -5.289 -0.438 1.00 . A A . 20 PHE O 1 1 12 5145 1 1 21 VAL C C 6.085 -5.311 -2.747 1.00 . A A . 21 VAL C 1 1 12 5146 1 1 21 VAL CA C 4.976 -4.261 -2.851 1.00 . A A . 21 VAL CA 1 1 12 5147 1 1 21 VAL CB C 5.135 -3.307 -4.049 1.00 . A A . 21 VAL CB 1 1 12 5148 1 1 21 VAL CG1 C 5.575 -4.047 -5.318 1.00 . A A . 21 VAL CG1 1 1 12 5149 1 1 21 VAL CG2 C 3.800 -2.611 -4.344 1.00 . A A . 21 VAL CG2 1 1 12 5150 1 1 21 VAL H H 5.106 -2.528 -1.601 1.00 . A A . 21 VAL H 1 1 12 5151 1 1 21 VAL HA H 4.052 -4.822 -2.987 1.00 . A A . 21 VAL HA 1 1 12 5152 1 1 21 VAL HB H 5.885 -2.550 -3.822 1.00 . A A . 21 VAL HB 1 1 12 5153 1 1 21 VAL HG11 H 6.587 -4.435 -5.202 1.00 . A A . 21 VAL HG11 1 1 12 5154 1 1 21 VAL HG12 H 4.891 -4.871 -5.522 1.00 . A A . 21 VAL HG12 1 1 12 5155 1 1 21 VAL HG13 H 5.570 -3.361 -6.166 1.00 . A A . 21 VAL HG13 1 1 12 5156 1 1 21 VAL HG21 H 3.941 -1.859 -5.121 1.00 . A A . 21 VAL HG21 1 1 12 5157 1 1 21 VAL HG22 H 3.067 -3.342 -4.688 1.00 . A A . 21 VAL HG22 1 1 12 5158 1 1 21 VAL HG23 H 3.411 -2.124 -3.452 1.00 . A A . 21 VAL HG23 1 1 12 5159 1 1 21 VAL N N 4.854 -3.512 -1.605 1.00 . A A . 21 VAL N 1 1 12 5160 1 1 21 VAL O O 5.861 -6.467 -3.097 1.00 . A A . 21 VAL O 1 1 12 5161 1 1 22 GLN C C 7.943 -6.989 -1.081 1.00 . A A . 22 GLN C 1 1 12 5162 1 1 22 GLN CA C 8.366 -5.863 -2.019 1.00 . A A . 22 GLN CA 1 1 12 5163 1 1 22 GLN CB C 9.564 -5.137 -1.401 1.00 . A A . 22 GLN CB 1 1 12 5164 1 1 22 GLN CD C 10.831 -4.615 -3.539 1.00 . A A . 22 GLN CD 1 1 12 5165 1 1 22 GLN CG C 10.128 -4.047 -2.309 1.00 . A A . 22 GLN CG 1 1 12 5166 1 1 22 GLN H H 7.393 -3.963 -1.979 1.00 . A A . 22 GLN H 1 1 12 5167 1 1 22 GLN HA H 8.662 -6.309 -2.968 1.00 . A A . 22 GLN HA 1 1 12 5168 1 1 22 GLN HB2 H 9.256 -4.678 -0.461 1.00 . A A . 22 GLN HB2 1 1 12 5169 1 1 22 GLN HB3 H 10.354 -5.858 -1.185 1.00 . A A . 22 GLN HB3 1 1 12 5170 1 1 22 GLN HE21 H 9.107 -4.567 -4.625 1.00 . A A . 22 GLN HE21 1 1 12 5171 1 1 22 GLN HE22 H 10.518 -5.170 -5.470 1.00 . A A . 22 GLN HE22 1 1 12 5172 1 1 22 GLN HG2 H 9.328 -3.383 -2.622 1.00 . A A . 22 GLN HG2 1 1 12 5173 1 1 22 GLN HG3 H 10.838 -3.476 -1.713 1.00 . A A . 22 GLN HG3 1 1 12 5174 1 1 22 GLN N N 7.268 -4.929 -2.253 1.00 . A A . 22 GLN N 1 1 12 5175 1 1 22 GLN NE2 N 10.090 -4.794 -4.636 1.00 . A A . 22 GLN NE2 1 1 12 5176 1 1 22 GLN O O 8.363 -8.130 -1.252 1.00 . A A . 22 GLN O 1 1 12 5177 1 1 22 GLN OE1 O 12.028 -4.885 -3.503 1.00 . A A . 22 GLN OE1 1 1 12 5178 1 1 23 TRP C C 5.749 -8.645 0.246 1.00 . A A . 23 TRP C 1 1 12 5179 1 1 23 TRP CA C 6.672 -7.622 0.906 1.00 . A A . 23 TRP CA 1 1 12 5180 1 1 23 TRP CB C 5.969 -6.875 2.038 1.00 . A A . 23 TRP CB 1 1 12 5181 1 1 23 TRP CD1 C 5.569 -8.662 3.760 1.00 . A A . 23 TRP CD1 1 1 12 5182 1 1 23 TRP CD2 C 3.683 -7.962 2.792 1.00 . A A . 23 TRP CD2 1 1 12 5183 1 1 23 TRP CE2 C 3.319 -8.993 3.703 1.00 . A A . 23 TRP CE2 1 1 12 5184 1 1 23 TRP CE3 C 2.670 -7.424 1.977 1.00 . A A . 23 TRP CE3 1 1 12 5185 1 1 23 TRP CG C 5.115 -7.750 2.883 1.00 . A A . 23 TRP CG 1 1 12 5186 1 1 23 TRP CH2 C 1.006 -8.881 3.010 1.00 . A A . 23 TRP CH2 1 1 12 5187 1 1 23 TRP CZ2 C 1.998 -9.444 3.828 1.00 . A A . 23 TRP CZ2 1 1 12 5188 1 1 23 TRP CZ3 C 1.344 -7.886 2.075 1.00 . A A . 23 TRP CZ3 1 1 12 5189 1 1 23 TRP H H 6.731 -5.726 -0.051 1.00 . A A . 23 TRP H 1 1 12 5190 1 1 23 TRP HA H 7.536 -8.145 1.322 1.00 . A A . 23 TRP HA 1 1 12 5191 1 1 23 TRP HB2 H 6.712 -6.379 2.662 1.00 . A A . 23 TRP HB2 1 1 12 5192 1 1 23 TRP HB3 H 5.321 -6.109 1.621 1.00 . A A . 23 TRP HB3 1 1 12 5193 1 1 23 TRP HD1 H 6.619 -8.818 3.939 1.00 . A A . 23 TRP HD1 1 1 12 5194 1 1 23 TRP HE1 H 4.568 -10.099 4.987 1.00 . A A . 23 TRP HE1 1 1 12 5195 1 1 23 TRP HE3 H 2.957 -6.673 1.252 1.00 . A A . 23 TRP HE3 1 1 12 5196 1 1 23 TRP HH2 H -0.012 -9.228 3.093 1.00 . A A . 23 TRP HH2 1 1 12 5197 1 1 23 TRP HZ2 H 1.750 -10.225 4.532 1.00 . A A . 23 TRP HZ2 1 1 12 5198 1 1 23 TRP HZ3 H 0.585 -7.488 1.420 1.00 . A A . 23 TRP HZ3 1 1 12 5199 1 1 23 TRP N N 7.114 -6.664 -0.087 1.00 . A A . 23 TRP N 1 1 12 5200 1 1 23 TRP NE1 N 4.509 -9.366 4.296 1.00 . A A . 23 TRP NE1 1 1 12 5201 1 1 23 TRP O O 5.996 -9.847 0.310 1.00 . A A . 23 TRP O 1 1 12 5202 1 1 24 LEU C C 4.419 -9.850 -2.121 1.00 . A A . 24 LEU C 1 1 12 5203 1 1 24 LEU CA C 3.710 -8.897 -1.158 1.00 . A A . 24 LEU CA 1 1 12 5204 1 1 24 LEU CB C 2.809 -7.886 -1.887 1.00 . A A . 24 LEU CB 1 1 12 5205 1 1 24 LEU CD1 C 1.962 -9.001 -4.044 1.00 . A A . 24 LEU CD1 1 1 12 5206 1 1 24 LEU CD2 C 0.794 -9.457 -1.852 1.00 . A A . 24 LEU CD2 1 1 12 5207 1 1 24 LEU CG C 1.599 -8.437 -2.664 1.00 . A A . 24 LEU CG 1 1 12 5208 1 1 24 LEU H H 4.563 -7.139 -0.346 1.00 . A A . 24 LEU H 1 1 12 5209 1 1 24 LEU HA H 3.110 -9.472 -0.453 1.00 . A A . 24 LEU HA 1 1 12 5210 1 1 24 LEU HB2 H 2.411 -7.214 -1.126 1.00 . A A . 24 LEU HB2 1 1 12 5211 1 1 24 LEU HB3 H 3.420 -7.286 -2.563 1.00 . A A . 24 LEU HB3 1 1 12 5212 1 1 24 LEU HD11 H 2.481 -9.953 -3.962 1.00 . A A . 24 LEU HD11 1 1 12 5213 1 1 24 LEU HD12 H 1.048 -9.161 -4.615 1.00 . A A . 24 LEU HD12 1 1 12 5214 1 1 24 LEU HD13 H 2.591 -8.292 -4.583 1.00 . A A . 24 LEU HD13 1 1 12 5215 1 1 24 LEU HD21 H -0.132 -9.690 -2.379 1.00 . A A . 24 LEU HD21 1 1 12 5216 1 1 24 LEU HD22 H 1.361 -10.378 -1.719 1.00 . A A . 24 LEU HD22 1 1 12 5217 1 1 24 LEU HD23 H 0.547 -9.039 -0.875 1.00 . A A . 24 LEU HD23 1 1 12 5218 1 1 24 LEU HG H 0.946 -7.583 -2.849 1.00 . A A . 24 LEU HG 1 1 12 5219 1 1 24 LEU N N 4.689 -8.141 -0.391 1.00 . A A . 24 LEU N 1 1 12 5220 1 1 24 LEU O O 4.028 -11.007 -2.251 1.00 . A A . 24 LEU O 1 1 12 5221 1 1 25 MET C C 6.996 -11.280 -2.991 1.00 . A A . 25 MET C 1 1 12 5222 1 1 25 MET CA C 6.280 -10.135 -3.708 1.00 . A A . 25 MET CA 1 1 12 5223 1 1 25 MET CB C 7.302 -9.228 -4.398 1.00 . A A . 25 MET CB 1 1 12 5224 1 1 25 MET CE C 6.784 -6.626 -7.638 1.00 . A A . 25 MET CE 1 1 12 5225 1 1 25 MET CG C 6.675 -8.426 -5.542 1.00 . A A . 25 MET CG 1 1 12 5226 1 1 25 MET H H 5.757 -8.408 -2.562 1.00 . A A . 25 MET H 1 1 12 5227 1 1 25 MET HA H 5.621 -10.563 -4.466 1.00 . A A . 25 MET HA 1 1 12 5228 1 1 25 MET HB2 H 7.736 -8.551 -3.664 1.00 . A A . 25 MET HB2 1 1 12 5229 1 1 25 MET HB3 H 8.102 -9.845 -4.810 1.00 . A A . 25 MET HB3 1 1 12 5230 1 1 25 MET HE1 H 5.803 -6.293 -7.300 1.00 . A A . 25 MET HE1 1 1 12 5231 1 1 25 MET HE2 H 7.290 -5.804 -8.145 1.00 . A A . 25 MET HE2 1 1 12 5232 1 1 25 MET HE3 H 6.663 -7.458 -8.332 1.00 . A A . 25 MET HE3 1 1 12 5233 1 1 25 MET HG2 H 6.410 -9.118 -6.342 1.00 . A A . 25 MET HG2 1 1 12 5234 1 1 25 MET HG3 H 5.764 -7.940 -5.196 1.00 . A A . 25 MET HG3 1 1 12 5235 1 1 25 MET N N 5.477 -9.359 -2.773 1.00 . A A . 25 MET N 1 1 12 5236 1 1 25 MET O O 6.831 -12.438 -3.370 1.00 . A A . 25 MET O 1 1 12 5237 1 1 25 MET SD S 7.776 -7.158 -6.220 1.00 . A A . 25 MET SD 1 1 12 5238 1 1 26 ASN C C 7.734 -13.033 -0.647 1.00 . A A . 26 ASN C 1 1 12 5239 1 1 26 ASN CA C 8.599 -11.911 -1.220 1.00 . A A . 26 ASN CA 1 1 12 5240 1 1 26 ASN CB C 9.365 -11.200 -0.095 1.00 . A A . 26 ASN CB 1 1 12 5241 1 1 26 ASN CG C 10.416 -10.210 -0.602 1.00 . A A . 26 ASN CG 1 1 12 5242 1 1 26 ASN H H 7.876 -9.974 -1.713 1.00 . A A . 26 ASN H 1 1 12 5243 1 1 26 ASN HA H 9.322 -12.364 -1.902 1.00 . A A . 26 ASN HA 1 1 12 5244 1 1 26 ASN HB2 H 8.656 -10.672 0.545 1.00 . A A . 26 ASN HB2 1 1 12 5245 1 1 26 ASN HB3 H 9.879 -11.951 0.507 1.00 . A A . 26 ASN HB3 1 1 12 5246 1 1 26 ASN HD21 H 10.682 -9.463 1.275 1.00 . A A . 26 ASN HD21 1 1 12 5247 1 1 26 ASN HD22 H 11.661 -8.731 0.020 1.00 . A A . 26 ASN HD22 1 1 12 5248 1 1 26 ASN N N 7.795 -10.950 -1.968 1.00 . A A . 26 ASN N 1 1 12 5249 1 1 26 ASN ND2 N 10.965 -9.403 0.308 1.00 . A A . 26 ASN ND2 1 1 12 5250 1 1 26 ASN O O 8.117 -14.200 -0.708 1.00 . A A . 26 ASN O 1 1 12 5251 1 1 26 ASN OD1 O 10.732 -10.168 -1.789 1.00 . A A . 26 ASN OD1 1 1 12 5252 1 1 27 THR C C 4.969 -14.470 -0.624 1.00 . A A . 27 THR C 1 1 12 5253 1 1 27 THR CA C 5.630 -13.633 0.476 1.00 . A A . 27 THR CA 1 1 12 5254 1 1 27 THR CB C 4.601 -12.898 1.345 1.00 . A A . 27 THR CB 1 1 12 5255 1 1 27 THR CG2 C 5.282 -12.271 2.563 1.00 . A A . 27 THR CG2 1 1 12 5256 1 1 27 THR H H 6.314 -11.702 -0.078 1.00 . A A . 27 THR H 1 1 12 5257 1 1 27 THR HA H 6.180 -14.318 1.124 1.00 . A A . 27 THR HA 1 1 12 5258 1 1 27 THR HB H 3.858 -13.616 1.695 1.00 . A A . 27 THR HB 1 1 12 5259 1 1 27 THR HG1 H 4.575 -11.192 0.401 1.00 . A A . 27 THR HG1 1 1 12 5260 1 1 27 THR HG21 H 5.801 -13.040 3.133 1.00 . A A . 27 THR HG21 1 1 12 5261 1 1 27 THR HG22 H 6.002 -11.511 2.258 1.00 . A A . 27 THR HG22 1 1 12 5262 1 1 27 THR HG23 H 4.522 -11.811 3.191 1.00 . A A . 27 THR HG23 1 1 12 5263 1 1 27 THR N N 6.569 -12.680 -0.094 1.00 . A A . 27 THR N 1 1 12 5264 1 1 27 THR O O 4.972 -15.697 -0.553 1.00 . A A . 27 THR O 1 1 12 5265 1 1 27 THR OG1 O 3.941 -11.881 0.619 1.00 . A A . 27 THR OG1 1 1 12 5266 1 1 28 NH2 HN1 H 4.412 -12.808 -1.663 1.00 . A A . 28 NH2 HN1 1 1 12 5267 1 1 28 NH2 HN2 H 3.971 -14.339 -2.391 1.00 . A A . 28 NH2 HN2 1 1 12 5268 1 1 28 NH2 N N 4.405 -13.819 -1.643 1.00 . A A . 28 NH2 N 1 1 13 5269 1 1 1 SER C C -10.229 7.161 8.716 1.00 . A A . 1 SER C 1 1 13 5270 1 1 1 SER CA C -9.426 5.860 8.765 1.00 . A A . 1 SER CA 1 1 13 5271 1 1 1 SER CB C -10.329 4.650 8.494 1.00 . A A . 1 SER CB 1 1 13 5272 1 1 1 SER H1 H -9.378 5.676 10.799 1.00 . A A . 1 SER H1 1 1 13 5273 1 1 1 SER H2 H -8.170 4.855 10.031 1.00 . A A . 1 SER H2 1 1 13 5274 1 1 1 SER H3 H -8.090 6.496 10.177 1.00 . A A . 1 SER H3 1 1 13 5275 1 1 1 SER HA H -8.668 5.895 7.982 1.00 . A A . 1 SER HA 1 1 13 5276 1 1 1 SER HB2 H -10.828 4.773 7.532 1.00 . A A . 1 SER HB2 1 1 13 5277 1 1 1 SER HB3 H -9.725 3.742 8.460 1.00 . A A . 1 SER HB3 1 1 13 5278 1 1 1 SER HG H -10.875 4.365 10.342 1.00 . A A . 1 SER HG 1 1 13 5279 1 1 1 SER N N -8.708 5.709 10.043 1.00 . A A . 1 SER N 1 1 13 5280 1 1 1 SER O O -10.649 7.674 9.752 1.00 . A A . 1 SER O 1 1 13 5281 1 1 1 SER OG O -11.311 4.518 9.501 1.00 . A A . 1 SER OG 1 1 13 5282 1 1 2 GLN C C -11.684 8.906 5.802 1.00 . A A . 2 GLN C 1 1 13 5283 1 1 2 GLN CA C -11.193 8.904 7.250 1.00 . A A . 2 GLN CA 1 1 13 5284 1 1 2 GLN CB C -10.339 10.142 7.569 1.00 . A A . 2 GLN CB 1 1 13 5285 1 1 2 GLN CD C -8.195 11.418 7.149 1.00 . A A . 2 GLN CD 1 1 13 5286 1 1 2 GLN CG C -9.052 10.227 6.733 1.00 . A A . 2 GLN CG 1 1 13 5287 1 1 2 GLN H H -10.062 7.211 6.691 1.00 . A A . 2 GLN H 1 1 13 5288 1 1 2 GLN HA H -12.065 8.914 7.907 1.00 . A A . 2 GLN HA 1 1 13 5289 1 1 2 GLN HB2 H -10.935 11.038 7.386 1.00 . A A . 2 GLN HB2 1 1 13 5290 1 1 2 GLN HB3 H -10.076 10.120 8.627 1.00 . A A . 2 GLN HB3 1 1 13 5291 1 1 2 GLN HE21 H -7.686 10.514 8.902 1.00 . A A . 2 GLN HE21 1 1 13 5292 1 1 2 GLN HE22 H -6.996 12.103 8.640 1.00 . A A . 2 GLN HE22 1 1 13 5293 1 1 2 GLN HG2 H -8.463 9.317 6.852 1.00 . A A . 2 GLN HG2 1 1 13 5294 1 1 2 GLN HG3 H -9.306 10.343 5.680 1.00 . A A . 2 GLN HG3 1 1 13 5295 1 1 2 GLN N N -10.438 7.686 7.502 1.00 . A A . 2 GLN N 1 1 13 5296 1 1 2 GLN NE2 N -7.574 11.337 8.328 1.00 . A A . 2 GLN NE2 1 1 13 5297 1 1 2 GLN O O -10.953 8.507 4.898 1.00 . A A . 2 GLN O 1 1 13 5298 1 1 2 GLN OE1 O -8.090 12.399 6.416 1.00 . A A . 2 GLN OE1 1 1 13 5299 1 1 3 GLY C C -13.673 7.993 3.672 1.00 . A A . 3 GLY C 1 1 13 5300 1 1 3 GLY CA C -13.517 9.398 4.254 1.00 . A A . 3 GLY CA 1 1 13 5301 1 1 3 GLY H H -13.486 9.658 6.359 1.00 . A A . 3 GLY H 1 1 13 5302 1 1 3 GLY HA2 H -14.504 9.855 4.331 1.00 . A A . 3 GLY HA2 1 1 13 5303 1 1 3 GLY HA3 H -12.901 10.018 3.601 1.00 . A A . 3 GLY HA3 1 1 13 5304 1 1 3 GLY N N -12.924 9.349 5.580 1.00 . A A . 3 GLY N 1 1 13 5305 1 1 3 GLY O O -14.465 7.204 4.185 1.00 . A A . 3 GLY O 1 1 13 5306 1 1 4 THR C C -11.699 6.241 1.095 1.00 . A A . 4 THR C 1 1 13 5307 1 1 4 THR CA C -13.011 6.457 1.838 1.00 . A A . 4 THR CA 1 1 13 5308 1 1 4 THR CB C -14.209 6.493 0.864 1.00 . A A . 4 THR CB 1 1 13 5309 1 1 4 THR CG2 C -14.300 5.204 0.039 1.00 . A A . 4 THR CG2 1 1 13 5310 1 1 4 THR H H -12.216 8.360 2.317 1.00 . A A . 4 THR H 1 1 13 5311 1 1 4 THR HA H -13.136 5.626 2.514 1.00 . A A . 4 THR HA 1 1 13 5312 1 1 4 THR HB H -14.109 7.338 0.182 1.00 . A A . 4 THR HB 1 1 13 5313 1 1 4 THR HG1 H -16.144 6.689 0.932 1.00 . A A . 4 THR HG1 1 1 13 5314 1 1 4 THR HG21 H -14.369 4.342 0.704 1.00 . A A . 4 THR HG21 1 1 13 5315 1 1 4 THR HG22 H -15.188 5.237 -0.593 1.00 . A A . 4 THR HG22 1 1 13 5316 1 1 4 THR HG23 H -13.426 5.093 -0.603 1.00 . A A . 4 THR HG23 1 1 13 5317 1 1 4 THR N N -12.923 7.697 2.602 1.00 . A A . 4 THR N 1 1 13 5318 1 1 4 THR O O -10.992 5.259 1.305 1.00 . A A . 4 THR O 1 1 13 5319 1 1 4 THR OG1 O -15.424 6.647 1.565 1.00 . A A . 4 THR OG1 1 1 13 5320 1 1 5 THR C C -8.946 7.179 0.037 1.00 . A A . 5 THR C 1 1 13 5321 1 1 5 THR CA C -10.279 7.157 -0.710 1.00 . A A . 5 THR CA 1 1 13 5322 1 1 5 THR CB C -10.381 8.324 -1.703 1.00 . A A . 5 THR CB 1 1 13 5323 1 1 5 THR CG2 C -11.587 8.159 -2.633 1.00 . A A . 5 THR CG2 1 1 13 5324 1 1 5 THR H H -12.058 7.952 0.163 1.00 . A A . 5 THR H 1 1 13 5325 1 1 5 THR HA H -10.335 6.224 -1.263 1.00 . A A . 5 THR HA 1 1 13 5326 1 1 5 THR HB H -9.476 8.350 -2.312 1.00 . A A . 5 THR HB 1 1 13 5327 1 1 5 THR HG1 H -10.517 10.264 -1.635 1.00 . A A . 5 THR HG1 1 1 13 5328 1 1 5 THR HG21 H -11.514 7.214 -3.172 1.00 . A A . 5 THR HG21 1 1 13 5329 1 1 5 THR HG22 H -12.517 8.175 -2.063 1.00 . A A . 5 THR HG22 1 1 13 5330 1 1 5 THR HG23 H -11.603 8.974 -3.356 1.00 . A A . 5 THR HG23 1 1 13 5331 1 1 5 THR N N -11.406 7.187 0.208 1.00 . A A . 5 THR N 1 1 13 5332 1 1 5 THR O O -8.018 6.458 -0.330 1.00 . A A . 5 THR O 1 1 13 5333 1 1 5 THR OG1 O -10.502 9.544 -1.000 1.00 . A A . 5 THR OG1 1 1 13 5334 1 1 6 SER C C -7.128 6.847 2.430 1.00 . A A . 6 SER C 1 1 13 5335 1 1 6 SER CA C -7.695 8.177 1.932 1.00 . A A . 6 SER CA 1 1 13 5336 1 1 6 SER CB C -8.051 9.076 3.119 1.00 . A A . 6 SER CB 1 1 13 5337 1 1 6 SER H H -9.668 8.581 1.305 1.00 . A A . 6 SER H 1 1 13 5338 1 1 6 SER HA H -6.933 8.688 1.343 1.00 . A A . 6 SER HA 1 1 13 5339 1 1 6 SER HB2 H -8.711 8.536 3.795 1.00 . A A . 6 SER HB2 1 1 13 5340 1 1 6 SER HB3 H -7.143 9.349 3.658 1.00 . A A . 6 SER HB3 1 1 13 5341 1 1 6 SER HG H -8.120 10.717 2.074 1.00 . A A . 6 SER HG 1 1 13 5342 1 1 6 SER N N -8.867 8.005 1.088 1.00 . A A . 6 SER N 1 1 13 5343 1 1 6 SER O O -5.919 6.741 2.612 1.00 . A A . 6 SER O 1 1 13 5344 1 1 6 SER OG O -8.705 10.246 2.672 1.00 . A A . 6 SER OG 1 1 13 5345 1 1 7 GLU C C -6.557 3.898 2.211 1.00 . A A . 7 GLU C 1 1 13 5346 1 1 7 GLU CA C -7.564 4.543 3.163 1.00 . A A . 7 GLU CA 1 1 13 5347 1 1 7 GLU CB C -8.769 3.620 3.401 1.00 . A A . 7 GLU CB 1 1 13 5348 1 1 7 GLU CD C -10.020 5.344 4.809 1.00 . A A . 7 GLU CD 1 1 13 5349 1 1 7 GLU CG C -9.501 3.913 4.718 1.00 . A A . 7 GLU CG 1 1 13 5350 1 1 7 GLU H H -8.970 5.978 2.472 1.00 . A A . 7 GLU H 1 1 13 5351 1 1 7 GLU HA H -7.077 4.711 4.123 1.00 . A A . 7 GLU HA 1 1 13 5352 1 1 7 GLU HB2 H -9.462 3.679 2.562 1.00 . A A . 7 GLU HB2 1 1 13 5353 1 1 7 GLU HB3 H -8.409 2.592 3.465 1.00 . A A . 7 GLU HB3 1 1 13 5354 1 1 7 GLU HG2 H -10.341 3.224 4.811 1.00 . A A . 7 GLU HG2 1 1 13 5355 1 1 7 GLU HG3 H -8.819 3.730 5.550 1.00 . A A . 7 GLU HG3 1 1 13 5356 1 1 7 GLU N N -7.985 5.840 2.652 1.00 . A A . 7 GLU N 1 1 13 5357 1 1 7 GLU O O -5.452 3.555 2.629 1.00 . A A . 7 GLU O 1 1 13 5358 1 1 7 GLU OE1 O -11.172 5.565 4.378 1.00 . A A . 7 GLU OE1 1 1 13 5359 1 1 7 GLU OE2 O -9.253 6.193 5.313 1.00 . A A . 7 GLU OE2 1 1 13 5360 1 1 8 TYR C C -4.874 4.027 -0.414 1.00 . A A . 8 TYR C 1 1 13 5361 1 1 8 TYR CA C -6.050 3.125 -0.050 1.00 . A A . 8 TYR CA 1 1 13 5362 1 1 8 TYR CB C -6.819 2.648 -1.289 1.00 . A A . 8 TYR CB 1 1 13 5363 1 1 8 TYR CD1 C -6.631 4.517 -3.000 1.00 . A A . 8 TYR CD1 1 1 13 5364 1 1 8 TYR CD2 C -8.840 3.835 -2.244 1.00 . A A . 8 TYR CD2 1 1 13 5365 1 1 8 TYR CE1 C -7.216 5.468 -3.854 1.00 . A A . 8 TYR CE1 1 1 13 5366 1 1 8 TYR CE2 C -9.425 4.727 -3.159 1.00 . A A . 8 TYR CE2 1 1 13 5367 1 1 8 TYR CG C -7.440 3.727 -2.159 1.00 . A A . 8 TYR CG 1 1 13 5368 1 1 8 TYR CZ C -8.614 5.574 -3.933 1.00 . A A . 8 TYR CZ 1 1 13 5369 1 1 8 TYR H H -7.838 4.063 0.632 1.00 . A A . 8 TYR H 1 1 13 5370 1 1 8 TYR HA H -5.629 2.238 0.412 1.00 . A A . 8 TYR HA 1 1 13 5371 1 1 8 TYR HB2 H -6.128 2.080 -1.914 1.00 . A A . 8 TYR HB2 1 1 13 5372 1 1 8 TYR HB3 H -7.595 1.957 -0.959 1.00 . A A . 8 TYR HB3 1 1 13 5373 1 1 8 TYR HD1 H -5.558 4.398 -2.998 1.00 . A A . 8 TYR HD1 1 1 13 5374 1 1 8 TYR HD2 H -9.469 3.223 -1.616 1.00 . A A . 8 TYR HD2 1 1 13 5375 1 1 8 TYR HE1 H -6.588 6.106 -4.458 1.00 . A A . 8 TYR HE1 1 1 13 5376 1 1 8 TYR HE2 H -10.500 4.775 -3.251 1.00 . A A . 8 TYR HE2 1 1 13 5377 1 1 8 TYR HH H -8.547 7.015 -5.250 1.00 . A A . 8 TYR HH 1 1 13 5378 1 1 8 TYR N N -6.931 3.738 0.934 1.00 . A A . 8 TYR N 1 1 13 5379 1 1 8 TYR O O -3.803 3.518 -0.741 1.00 . A A . 8 TYR O 1 1 13 5380 1 1 8 TYR OH O -9.188 6.495 -4.760 1.00 . A A . 8 TYR OH 1 1 13 5381 1 1 9 SER C C -2.722 6.114 -0.104 1.00 . A A . 9 SER C 1 1 13 5382 1 1 9 SER CA C -4.086 6.345 -0.762 1.00 . A A . 9 SER CA 1 1 13 5383 1 1 9 SER CB C -4.600 7.758 -0.474 1.00 . A A . 9 SER CB 1 1 13 5384 1 1 9 SER H H -5.989 5.692 -0.089 1.00 . A A . 9 SER H 1 1 13 5385 1 1 9 SER HA H -3.962 6.275 -1.841 1.00 . A A . 9 SER HA 1 1 13 5386 1 1 9 SER HB2 H -4.786 7.880 0.591 1.00 . A A . 9 SER HB2 1 1 13 5387 1 1 9 SER HB3 H -3.846 8.484 -0.783 1.00 . A A . 9 SER HB3 1 1 13 5388 1 1 9 SER HG H -6.456 7.373 -0.935 1.00 . A A . 9 SER HG 1 1 13 5389 1 1 9 SER N N -5.076 5.353 -0.363 1.00 . A A . 9 SER N 1 1 13 5390 1 1 9 SER O O -1.699 6.401 -0.720 1.00 . A A . 9 SER O 1 1 13 5391 1 1 9 SER OG O -5.785 8.009 -1.200 1.00 . A A . 9 SER OG 1 1 13 5392 1 1 10 LYS C C -0.625 4.291 1.170 1.00 . A A . 10 LYS C 1 1 13 5393 1 1 10 LYS CA C -1.482 5.338 1.876 1.00 . A A . 10 LYS CA 1 1 13 5394 1 1 10 LYS CB C -1.835 4.932 3.311 1.00 . A A . 10 LYS CB 1 1 13 5395 1 1 10 LYS CD C -2.298 7.352 4.152 1.00 . A A . 10 LYS CD 1 1 13 5396 1 1 10 LYS CE C -2.623 8.257 2.951 1.00 . A A . 10 LYS CE 1 1 13 5397 1 1 10 LYS CG C -2.790 5.900 4.029 1.00 . A A . 10 LYS CG 1 1 13 5398 1 1 10 LYS H H -3.560 5.348 1.588 1.00 . A A . 10 LYS H 1 1 13 5399 1 1 10 LYS HA H -0.892 6.249 1.914 1.00 . A A . 10 LYS HA 1 1 13 5400 1 1 10 LYS HB2 H -2.309 3.949 3.298 1.00 . A A . 10 LYS HB2 1 1 13 5401 1 1 10 LYS HB3 H -0.919 4.858 3.895 1.00 . A A . 10 LYS HB3 1 1 13 5402 1 1 10 LYS HD2 H -2.809 7.778 5.016 1.00 . A A . 10 LYS HD2 1 1 13 5403 1 1 10 LYS HD3 H -1.228 7.361 4.354 1.00 . A A . 10 LYS HD3 1 1 13 5404 1 1 10 LYS HE2 H -2.014 8.024 2.081 1.00 . A A . 10 LYS HE2 1 1 13 5405 1 1 10 LYS HE3 H -3.670 8.145 2.676 1.00 . A A . 10 LYS HE3 1 1 13 5406 1 1 10 LYS HG2 H -3.773 5.879 3.566 1.00 . A A . 10 LYS HG2 1 1 13 5407 1 1 10 LYS HG3 H -2.907 5.513 5.043 1.00 . A A . 10 LYS HG3 1 1 13 5408 1 1 10 LYS HZ1 H -1.404 9.799 3.512 1.00 . A A . 10 LYS HZ1 1 1 13 5409 1 1 10 LYS HZ2 H -2.607 10.245 2.476 1.00 . A A . 10 LYS HZ2 1 1 13 5410 1 1 10 LYS HZ3 H -2.954 9.943 4.060 1.00 . A A . 10 LYS HZ3 1 1 13 5411 1 1 10 LYS N N -2.698 5.592 1.129 1.00 . A A . 10 LYS N 1 1 13 5412 1 1 10 LYS NZ N -2.378 9.672 3.276 1.00 . A A . 10 LYS NZ 1 1 13 5413 1 1 10 LYS O O 0.495 4.592 0.765 1.00 . A A . 10 LYS O 1 1 13 5414 1 1 11 TYR C C -0.297 2.157 -1.152 1.00 . A A . 11 TYR C 1 1 13 5415 1 1 11 TYR CA C -0.394 1.991 0.366 1.00 . A A . 11 TYR CA 1 1 13 5416 1 1 11 TYR CB C -0.981 0.643 0.787 1.00 . A A . 11 TYR CB 1 1 13 5417 1 1 11 TYR CD1 C -2.925 0.154 -0.770 1.00 . A A . 11 TYR CD1 1 1 13 5418 1 1 11 TYR CD2 C -3.353 0.351 1.617 1.00 . A A . 11 TYR CD2 1 1 13 5419 1 1 11 TYR CE1 C -4.268 -0.201 -0.981 1.00 . A A . 11 TYR CE1 1 1 13 5420 1 1 11 TYR CE2 C -4.688 -0.035 1.411 1.00 . A A . 11 TYR CE2 1 1 13 5421 1 1 11 TYR CG C -2.462 0.433 0.530 1.00 . A A . 11 TYR CG 1 1 13 5422 1 1 11 TYR CZ C -5.145 -0.316 0.111 1.00 . A A . 11 TYR CZ 1 1 13 5423 1 1 11 TYR H H -2.119 2.911 1.176 1.00 . A A . 11 TYR H 1 1 13 5424 1 1 11 TYR HA H 0.628 2.014 0.747 1.00 . A A . 11 TYR HA 1 1 13 5425 1 1 11 TYR HB2 H -0.428 -0.144 0.278 1.00 . A A . 11 TYR HB2 1 1 13 5426 1 1 11 TYR HB3 H -0.796 0.547 1.856 1.00 . A A . 11 TYR HB3 1 1 13 5427 1 1 11 TYR HD1 H -2.250 0.192 -1.612 1.00 . A A . 11 TYR HD1 1 1 13 5428 1 1 11 TYR HD2 H -3.013 0.566 2.620 1.00 . A A . 11 TYR HD2 1 1 13 5429 1 1 11 TYR HE1 H -4.622 -0.392 -1.983 1.00 . A A . 11 TYR HE1 1 1 13 5430 1 1 11 TYR HE2 H -5.362 -0.099 2.253 1.00 . A A . 11 TYR HE2 1 1 13 5431 1 1 11 TYR HH H -6.954 -0.740 0.715 1.00 . A A . 11 TYR HH 1 1 13 5432 1 1 11 TYR N N -1.143 3.073 0.986 1.00 . A A . 11 TYR N 1 1 13 5433 1 1 11 TYR O O 0.280 1.306 -1.826 1.00 . A A . 11 TYR O 1 1 13 5434 1 1 11 TYR OH O -6.441 -0.690 -0.095 1.00 . A A . 11 TYR OH 1 1 13 5435 1 1 12 LEU C C 0.377 4.787 -3.181 1.00 . A A . 12 LEU C 1 1 13 5436 1 1 12 LEU CA C -0.712 3.703 -3.047 1.00 . A A . 12 LEU CA 1 1 13 5437 1 1 12 LEU CB C -2.109 4.181 -3.475 1.00 . A A . 12 LEU CB 1 1 13 5438 1 1 12 LEU CD1 C -1.729 4.049 -5.986 1.00 . A A . 12 LEU CD1 1 1 13 5439 1 1 12 LEU CD2 C -3.643 5.356 -5.074 1.00 . A A . 12 LEU CD2 1 1 13 5440 1 1 12 LEU CG C -2.195 4.925 -4.815 1.00 . A A . 12 LEU CG 1 1 13 5441 1 1 12 LEU H H -1.334 3.896 -1.066 1.00 . A A . 12 LEU H 1 1 13 5442 1 1 12 LEU HA H -0.443 2.844 -3.652 1.00 . A A . 12 LEU HA 1 1 13 5443 1 1 12 LEU HB2 H -2.771 3.313 -3.496 1.00 . A A . 12 LEU HB2 1 1 13 5444 1 1 12 LEU HB3 H -2.471 4.859 -2.707 1.00 . A A . 12 LEU HB3 1 1 13 5445 1 1 12 LEU HD11 H -0.691 3.745 -5.860 1.00 . A A . 12 LEU HD11 1 1 13 5446 1 1 12 LEU HD12 H -2.351 3.156 -6.051 1.00 . A A . 12 LEU HD12 1 1 13 5447 1 1 12 LEU HD13 H -1.814 4.610 -6.917 1.00 . A A . 12 LEU HD13 1 1 13 5448 1 1 12 LEU HD21 H -4.289 4.480 -5.138 1.00 . A A . 12 LEU HD21 1 1 13 5449 1 1 12 LEU HD22 H -3.986 6.002 -4.266 1.00 . A A . 12 LEU HD22 1 1 13 5450 1 1 12 LEU HD23 H -3.700 5.910 -6.011 1.00 . A A . 12 LEU HD23 1 1 13 5451 1 1 12 LEU HG H -1.600 5.836 -4.744 1.00 . A A . 12 LEU HG 1 1 13 5452 1 1 12 LEU N N -0.825 3.269 -1.672 1.00 . A A . 12 LEU N 1 1 13 5453 1 1 12 LEU O O 0.791 5.096 -4.296 1.00 . A A . 12 LEU O 1 1 13 5454 1 1 13 ASP C C 3.215 6.090 -2.329 1.00 . A A . 13 ASP C 1 1 13 5455 1 1 13 ASP CA C 1.760 6.509 -2.048 1.00 . A A . 13 ASP CA 1 1 13 5456 1 1 13 ASP CB C 1.564 7.285 -0.734 1.00 . A A . 13 ASP CB 1 1 13 5457 1 1 13 ASP CG C 2.255 8.649 -0.729 1.00 . A A . 13 ASP CG 1 1 13 5458 1 1 13 ASP H H 0.477 5.080 -1.167 1.00 . A A . 13 ASP H 1 1 13 5459 1 1 13 ASP HA H 1.467 7.183 -2.854 1.00 . A A . 13 ASP HA 1 1 13 5460 1 1 13 ASP HB2 H 0.500 7.467 -0.586 1.00 . A A . 13 ASP HB2 1 1 13 5461 1 1 13 ASP HB3 H 1.920 6.682 0.100 1.00 . A A . 13 ASP HB3 1 1 13 5462 1 1 13 ASP N N 0.833 5.381 -2.064 1.00 . A A . 13 ASP N 1 1 13 5463 1 1 13 ASP O O 3.487 5.505 -3.376 1.00 . A A . 13 ASP O 1 1 13 5464 1 1 13 ASP OD1 O 1.826 9.511 -1.526 1.00 . A A . 13 ASP OD1 1 1 13 5465 1 1 13 ASP OD2 O 3.203 8.803 0.072 1.00 . A A . 13 ASP OD2 1 1 13 5466 1 1 14 SER C C 6.190 5.149 -0.880 1.00 . A A . 14 SER C 1 1 13 5467 1 1 14 SER CA C 5.594 6.323 -1.666 1.00 . A A . 14 SER CA 1 1 13 5468 1 1 14 SER CB C 6.259 7.674 -1.362 1.00 . A A . 14 SER CB 1 1 13 5469 1 1 14 SER H H 3.875 6.918 -0.598 1.00 . A A . 14 SER H 1 1 13 5470 1 1 14 SER HA H 5.788 6.120 -2.721 1.00 . A A . 14 SER HA 1 1 13 5471 1 1 14 SER HB2 H 6.094 7.958 -0.322 1.00 . A A . 14 SER HB2 1 1 13 5472 1 1 14 SER HB3 H 7.331 7.614 -1.558 1.00 . A A . 14 SER HB3 1 1 13 5473 1 1 14 SER HG H 4.775 8.762 -2.001 1.00 . A A . 14 SER HG 1 1 13 5474 1 1 14 SER N N 4.159 6.451 -1.446 1.00 . A A . 14 SER N 1 1 13 5475 1 1 14 SER O O 5.883 4.004 -1.199 1.00 . A A . 14 SER O 1 1 13 5476 1 1 14 SER OG O 5.713 8.680 -2.190 1.00 . A A . 14 SER OG 1 1 13 5477 1 1 15 ARG C C 7.019 3.236 1.306 1.00 . A A . 15 ARG C 1 1 13 5478 1 1 15 ARG CA C 7.851 4.425 0.828 1.00 . A A . 15 ARG CA 1 1 13 5479 1 1 15 ARG CB C 8.585 5.105 1.994 1.00 . A A . 15 ARG CB 1 1 13 5480 1 1 15 ARG CD C 10.432 3.334 2.107 1.00 . A A . 15 ARG CD 1 1 13 5481 1 1 15 ARG CG C 9.379 4.135 2.884 1.00 . A A . 15 ARG CG 1 1 13 5482 1 1 15 ARG CZ C 12.239 2.855 3.772 1.00 . A A . 15 ARG CZ 1 1 13 5483 1 1 15 ARG H H 7.258 6.385 0.324 1.00 . A A . 15 ARG H 1 1 13 5484 1 1 15 ARG HA H 8.601 4.052 0.130 1.00 . A A . 15 ARG HA 1 1 13 5485 1 1 15 ARG HB2 H 9.271 5.850 1.590 1.00 . A A . 15 ARG HB2 1 1 13 5486 1 1 15 ARG HB3 H 7.856 5.618 2.623 1.00 . A A . 15 ARG HB3 1 1 13 5487 1 1 15 ARG HD2 H 9.942 2.686 1.382 1.00 . A A . 15 ARG HD2 1 1 13 5488 1 1 15 ARG HD3 H 11.094 4.012 1.568 1.00 . A A . 15 ARG HD3 1 1 13 5489 1 1 15 ARG HE H 10.939 1.491 3.026 1.00 . A A . 15 ARG HE 1 1 13 5490 1 1 15 ARG HG2 H 9.878 4.725 3.653 1.00 . A A . 15 ARG HG2 1 1 13 5491 1 1 15 ARG HG3 H 8.699 3.443 3.382 1.00 . A A . 15 ARG HG3 1 1 13 5492 1 1 15 ARG HH11 H 12.186 4.825 3.221 1.00 . A A . 15 ARG HH11 1 1 13 5493 1 1 15 ARG HH12 H 13.428 4.402 4.376 1.00 . A A . 15 ARG HH12 1 1 13 5494 1 1 15 ARG HH21 H 12.564 0.987 4.533 1.00 . A A . 15 ARG HH21 1 1 13 5495 1 1 15 ARG HH22 H 13.640 2.234 5.122 1.00 . A A . 15 ARG HH22 1 1 13 5496 1 1 15 ARG N N 7.066 5.420 0.100 1.00 . A A . 15 ARG N 1 1 13 5497 1 1 15 ARG NE N 11.210 2.464 3.000 1.00 . A A . 15 ARG NE 1 1 13 5498 1 1 15 ARG NH1 N 12.651 4.131 3.790 1.00 . A A . 15 ARG NH1 1 1 13 5499 1 1 15 ARG NH2 N 12.865 1.951 4.538 1.00 . A A . 15 ARG NH2 1 1 13 5500 1 1 15 ARG O O 7.373 2.094 1.019 1.00 . A A . 15 ARG O 1 1 13 5501 1 1 16 ARG C C 4.549 1.556 1.417 1.00 . A A . 16 ARG C 1 1 13 5502 1 1 16 ARG CA C 5.051 2.456 2.549 1.00 . A A . 16 ARG CA 1 1 13 5503 1 1 16 ARG CB C 3.923 3.066 3.396 1.00 . A A . 16 ARG CB 1 1 13 5504 1 1 16 ARG CD C 2.087 4.806 3.543 1.00 . A A . 16 ARG CD 1 1 13 5505 1 1 16 ARG CG C 2.996 4.000 2.608 1.00 . A A . 16 ARG CG 1 1 13 5506 1 1 16 ARG CZ C 1.463 7.247 3.419 1.00 . A A . 16 ARG CZ 1 1 13 5507 1 1 16 ARG H H 5.690 4.462 2.227 1.00 . A A . 16 ARG H 1 1 13 5508 1 1 16 ARG HA H 5.647 1.836 3.222 1.00 . A A . 16 ARG HA 1 1 13 5509 1 1 16 ARG HB2 H 3.329 2.266 3.836 1.00 . A A . 16 ARG HB2 1 1 13 5510 1 1 16 ARG HB3 H 4.390 3.627 4.205 1.00 . A A . 16 ARG HB3 1 1 13 5511 1 1 16 ARG HD2 H 1.229 4.191 3.819 1.00 . A A . 16 ARG HD2 1 1 13 5512 1 1 16 ARG HD3 H 2.633 5.069 4.445 1.00 . A A . 16 ARG HD3 1 1 13 5513 1 1 16 ARG HE H 1.374 5.913 1.900 1.00 . A A . 16 ARG HE 1 1 13 5514 1 1 16 ARG HG2 H 3.591 4.695 2.018 1.00 . A A . 16 ARG HG2 1 1 13 5515 1 1 16 ARG HG3 H 2.378 3.405 1.935 1.00 . A A . 16 ARG HG3 1 1 13 5516 1 1 16 ARG HH11 H 2.003 6.731 5.327 1.00 . A A . 16 ARG HH11 1 1 13 5517 1 1 16 ARG HH12 H 1.587 8.409 5.091 1.00 . A A . 16 ARG HH12 1 1 13 5518 1 1 16 ARG HH21 H 0.861 8.101 1.663 1.00 . A A . 16 ARG HH21 1 1 13 5519 1 1 16 ARG HH22 H 0.933 9.182 3.035 1.00 . A A . 16 ARG HH22 1 1 13 5520 1 1 16 ARG N N 5.926 3.500 2.031 1.00 . A A . 16 ARG N 1 1 13 5521 1 1 16 ARG NE N 1.615 6.026 2.875 1.00 . A A . 16 ARG NE 1 1 13 5522 1 1 16 ARG NH1 N 1.707 7.479 4.718 1.00 . A A . 16 ARG NH1 1 1 13 5523 1 1 16 ARG NH2 N 1.053 8.259 2.642 1.00 . A A . 16 ARG NH2 1 1 13 5524 1 1 16 ARG O O 4.620 0.337 1.535 1.00 . A A . 16 ARG O 1 1 13 5525 1 1 17 ALA C C 4.746 0.519 -1.401 1.00 . A A . 17 ALA C 1 1 13 5526 1 1 17 ALA CA C 3.636 1.424 -0.865 1.00 . A A . 17 ALA CA 1 1 13 5527 1 1 17 ALA CB C 3.143 2.398 -1.937 1.00 . A A . 17 ALA CB 1 1 13 5528 1 1 17 ALA H H 4.074 3.158 0.267 1.00 . A A . 17 ALA H 1 1 13 5529 1 1 17 ALA HA H 2.790 0.799 -0.578 1.00 . A A . 17 ALA HA 1 1 13 5530 1 1 17 ALA HB1 H 2.704 1.839 -2.762 1.00 . A A . 17 ALA HB1 1 1 13 5531 1 1 17 ALA HB2 H 2.395 3.064 -1.510 1.00 . A A . 17 ALA HB2 1 1 13 5532 1 1 17 ALA HB3 H 3.963 2.994 -2.327 1.00 . A A . 17 ALA HB3 1 1 13 5533 1 1 17 ALA N N 4.080 2.151 0.313 1.00 . A A . 17 ALA N 1 1 13 5534 1 1 17 ALA O O 4.495 -0.657 -1.652 1.00 . A A . 17 ALA O 1 1 13 5535 1 1 18 GLN C C 7.359 -0.933 -1.148 1.00 . A A . 18 GLN C 1 1 13 5536 1 1 18 GLN CA C 7.090 0.259 -2.065 1.00 . A A . 18 GLN CA 1 1 13 5537 1 1 18 GLN CB C 8.375 1.090 -2.220 1.00 . A A . 18 GLN CB 1 1 13 5538 1 1 18 GLN CD C 7.275 2.361 -4.152 1.00 . A A . 18 GLN CD 1 1 13 5539 1 1 18 GLN CG C 8.239 2.421 -2.971 1.00 . A A . 18 GLN CG 1 1 13 5540 1 1 18 GLN H H 6.124 2.019 -1.327 1.00 . A A . 18 GLN H 1 1 13 5541 1 1 18 GLN HA H 6.810 -0.135 -3.044 1.00 . A A . 18 GLN HA 1 1 13 5542 1 1 18 GLN HB2 H 8.795 1.306 -1.236 1.00 . A A . 18 GLN HB2 1 1 13 5543 1 1 18 GLN HB3 H 9.093 0.472 -2.760 1.00 . A A . 18 GLN HB3 1 1 13 5544 1 1 18 GLN HE21 H 5.920 3.518 -3.166 1.00 . A A . 18 GLN HE21 1 1 13 5545 1 1 18 GLN HE22 H 5.455 3.017 -4.782 1.00 . A A . 18 GLN HE22 1 1 13 5546 1 1 18 GLN HG2 H 7.923 3.190 -2.271 1.00 . A A . 18 GLN HG2 1 1 13 5547 1 1 18 GLN HG3 H 9.224 2.708 -3.341 1.00 . A A . 18 GLN HG3 1 1 13 5548 1 1 18 GLN N N 5.969 1.047 -1.563 1.00 . A A . 18 GLN N 1 1 13 5549 1 1 18 GLN NE2 N 6.123 3.023 -4.026 1.00 . A A . 18 GLN NE2 1 1 13 5550 1 1 18 GLN O O 7.516 -2.052 -1.626 1.00 . A A . 18 GLN O 1 1 13 5551 1 1 18 GLN OE1 O 7.566 1.729 -5.164 1.00 . A A . 18 GLN OE1 1 1 13 5552 1 1 19 ASP C C 6.614 -2.828 1.057 1.00 . A A . 19 ASP C 1 1 13 5553 1 1 19 ASP CA C 7.654 -1.714 1.171 1.00 . A A . 19 ASP CA 1 1 13 5554 1 1 19 ASP CB C 7.653 -1.078 2.566 1.00 . A A . 19 ASP CB 1 1 13 5555 1 1 19 ASP CG C 7.881 -2.121 3.657 1.00 . A A . 19 ASP CG 1 1 13 5556 1 1 19 ASP H H 7.210 0.248 0.485 1.00 . A A . 19 ASP H 1 1 13 5557 1 1 19 ASP HA H 8.643 -2.139 0.990 1.00 . A A . 19 ASP HA 1 1 13 5558 1 1 19 ASP HB2 H 8.445 -0.329 2.619 1.00 . A A . 19 ASP HB2 1 1 13 5559 1 1 19 ASP HB3 H 6.701 -0.581 2.748 1.00 . A A . 19 ASP HB3 1 1 13 5560 1 1 19 ASP N N 7.402 -0.691 0.167 1.00 . A A . 19 ASP N 1 1 13 5561 1 1 19 ASP O O 6.969 -4.004 1.011 1.00 . A A . 19 ASP O 1 1 13 5562 1 1 19 ASP OD1 O 9.062 -2.461 3.882 1.00 . A A . 19 ASP OD1 1 1 13 5563 1 1 19 ASP OD2 O 6.868 -2.562 4.244 1.00 . A A . 19 ASP OD2 1 1 13 5564 1 1 20 PHE C C 4.360 -4.161 -0.494 1.00 . A A . 20 PHE C 1 1 13 5565 1 1 20 PHE CA C 4.233 -3.381 0.817 1.00 . A A . 20 PHE CA 1 1 13 5566 1 1 20 PHE CB C 2.891 -2.643 0.912 1.00 . A A . 20 PHE CB 1 1 13 5567 1 1 20 PHE CD1 C 3.015 -2.439 3.459 1.00 . A A . 20 PHE CD1 1 1 13 5568 1 1 20 PHE CD2 C 1.948 -0.668 2.179 1.00 . A A . 20 PHE CD2 1 1 13 5569 1 1 20 PHE CE1 C 2.763 -1.729 4.646 1.00 . A A . 20 PHE CE1 1 1 13 5570 1 1 20 PHE CE2 C 1.684 0.035 3.367 1.00 . A A . 20 PHE CE2 1 1 13 5571 1 1 20 PHE CG C 2.623 -1.903 2.215 1.00 . A A . 20 PHE CG 1 1 13 5572 1 1 20 PHE CZ C 2.098 -0.492 4.601 1.00 . A A . 20 PHE CZ 1 1 13 5573 1 1 20 PHE H H 5.110 -1.464 1.053 1.00 . A A . 20 PHE H 1 1 13 5574 1 1 20 PHE HA H 4.280 -4.117 1.619 1.00 . A A . 20 PHE HA 1 1 13 5575 1 1 20 PHE HB2 H 2.844 -1.931 0.086 1.00 . A A . 20 PHE HB2 1 1 13 5576 1 1 20 PHE HB3 H 2.088 -3.367 0.773 1.00 . A A . 20 PHE HB3 1 1 13 5577 1 1 20 PHE HD1 H 3.511 -3.394 3.526 1.00 . A A . 20 PHE HD1 1 1 13 5578 1 1 20 PHE HD2 H 1.657 -0.242 1.234 1.00 . A A . 20 PHE HD2 1 1 13 5579 1 1 20 PHE HE1 H 3.079 -2.137 5.595 1.00 . A A . 20 PHE HE1 1 1 13 5580 1 1 20 PHE HE2 H 1.171 0.985 3.331 1.00 . A A . 20 PHE HE2 1 1 13 5581 1 1 20 PHE HZ H 1.904 0.051 5.514 1.00 . A A . 20 PHE HZ 1 1 13 5582 1 1 20 PHE N N 5.333 -2.449 0.992 1.00 . A A . 20 PHE N 1 1 13 5583 1 1 20 PHE O O 4.027 -5.342 -0.518 1.00 . A A . 20 PHE O 1 1 13 5584 1 1 21 VAL C C 6.122 -5.309 -2.709 1.00 . A A . 21 VAL C 1 1 13 5585 1 1 21 VAL CA C 5.022 -4.256 -2.840 1.00 . A A . 21 VAL CA 1 1 13 5586 1 1 21 VAL CB C 5.251 -3.275 -4.005 1.00 . A A . 21 VAL CB 1 1 13 5587 1 1 21 VAL CG1 C 5.747 -3.989 -5.270 1.00 . A A . 21 VAL CG1 1 1 13 5588 1 1 21 VAL CG2 C 3.939 -2.558 -4.349 1.00 . A A . 21 VAL CG2 1 1 13 5589 1 1 21 VAL H H 5.123 -2.567 -1.527 1.00 . A A . 21 VAL H 1 1 13 5590 1 1 21 VAL HA H 4.107 -4.812 -3.035 1.00 . A A . 21 VAL HA 1 1 13 5591 1 1 21 VAL HB H 5.996 -2.534 -3.718 1.00 . A A . 21 VAL HB 1 1 13 5592 1 1 21 VAL HG11 H 5.068 -4.800 -5.535 1.00 . A A . 21 VAL HG11 1 1 13 5593 1 1 21 VAL HG12 H 5.793 -3.280 -6.097 1.00 . A A . 21 VAL HG12 1 1 13 5594 1 1 21 VAL HG13 H 6.748 -4.394 -5.116 1.00 . A A . 21 VAL HG13 1 1 13 5595 1 1 21 VAL HG21 H 4.126 -1.786 -5.096 1.00 . A A . 21 VAL HG21 1 1 13 5596 1 1 21 VAL HG22 H 3.218 -3.272 -4.749 1.00 . A A . 21 VAL HG22 1 1 13 5597 1 1 21 VAL HG23 H 3.509 -2.092 -3.465 1.00 . A A . 21 VAL HG23 1 1 13 5598 1 1 21 VAL N N 4.845 -3.542 -1.578 1.00 . A A . 21 VAL N 1 1 13 5599 1 1 21 VAL O O 5.888 -6.475 -3.017 1.00 . A A . 21 VAL O 1 1 13 5600 1 1 22 GLN C C 8.002 -6.987 -1.112 1.00 . A A . 22 GLN C 1 1 13 5601 1 1 22 GLN CA C 8.424 -5.820 -1.999 1.00 . A A . 22 GLN CA 1 1 13 5602 1 1 22 GLN CB C 9.565 -5.071 -1.304 1.00 . A A . 22 GLN CB 1 1 13 5603 1 1 22 GLN CD C 10.931 -4.545 -3.379 1.00 . A A . 22 GLN CD 1 1 13 5604 1 1 22 GLN CG C 10.160 -3.977 -2.190 1.00 . A A . 22 GLN CG 1 1 13 5605 1 1 22 GLN H H 7.429 -3.937 -1.997 1.00 . A A . 22 GLN H 1 1 13 5606 1 1 22 GLN HA H 8.774 -6.217 -2.953 1.00 . A A . 22 GLN HA 1 1 13 5607 1 1 22 GLN HB2 H 9.186 -4.609 -0.392 1.00 . A A . 22 GLN HB2 1 1 13 5608 1 1 22 GLN HB3 H 10.351 -5.775 -1.028 1.00 . A A . 22 GLN HB3 1 1 13 5609 1 1 22 GLN HE21 H 12.427 -5.214 -2.168 1.00 . A A . 22 GLN HE21 1 1 13 5610 1 1 22 GLN HE22 H 12.633 -5.536 -3.878 1.00 . A A . 22 GLN HE22 1 1 13 5611 1 1 22 GLN HG2 H 9.361 -3.342 -2.561 1.00 . A A . 22 GLN HG2 1 1 13 5612 1 1 22 GLN HG3 H 10.821 -3.377 -1.568 1.00 . A A . 22 GLN HG3 1 1 13 5613 1 1 22 GLN N N 7.309 -4.911 -2.240 1.00 . A A . 22 GLN N 1 1 13 5614 1 1 22 GLN NE2 N 12.093 -5.147 -3.118 1.00 . A A . 22 GLN NE2 1 1 13 5615 1 1 22 GLN O O 8.433 -8.119 -1.327 1.00 . A A . 22 GLN O 1 1 13 5616 1 1 22 GLN OE1 O 10.484 -4.441 -4.518 1.00 . A A . 22 GLN OE1 1 1 13 5617 1 1 23 TRP C C 5.800 -8.684 0.195 1.00 . A A . 23 TRP C 1 1 13 5618 1 1 23 TRP CA C 6.735 -7.681 0.861 1.00 . A A . 23 TRP CA 1 1 13 5619 1 1 23 TRP CB C 6.037 -6.975 2.022 1.00 . A A . 23 TRP CB 1 1 13 5620 1 1 23 TRP CD1 C 5.629 -8.876 3.622 1.00 . A A . 23 TRP CD1 1 1 13 5621 1 1 23 TRP CD2 C 3.741 -8.070 2.742 1.00 . A A . 23 TRP CD2 1 1 13 5622 1 1 23 TRP CE2 C 3.372 -9.161 3.579 1.00 . A A . 23 TRP CE2 1 1 13 5623 1 1 23 TRP CE3 C 2.725 -7.457 1.986 1.00 . A A . 23 TRP CE3 1 1 13 5624 1 1 23 TRP CG C 5.179 -7.890 2.826 1.00 . A A . 23 TRP CG 1 1 13 5625 1 1 23 TRP CH2 C 1.045 -8.936 2.960 1.00 . A A . 23 TRP CH2 1 1 13 5626 1 1 23 TRP CZ2 C 2.043 -9.591 3.698 1.00 . A A . 23 TRP CZ2 1 1 13 5627 1 1 23 TRP CZ3 C 1.386 -7.877 2.098 1.00 . A A . 23 TRP CZ3 1 1 13 5628 1 1 23 TRP H H 6.753 -5.774 -0.068 1.00 . A A . 23 TRP H 1 1 13 5629 1 1 23 TRP HA H 7.605 -8.213 1.253 1.00 . A A . 23 TRP HA 1 1 13 5630 1 1 23 TRP HB2 H 6.780 -6.506 2.667 1.00 . A A . 23 TRP HB2 1 1 13 5631 1 1 23 TRP HB3 H 5.390 -6.193 1.629 1.00 . A A . 23 TRP HB3 1 1 13 5632 1 1 23 TRP HD1 H 6.678 -9.067 3.776 1.00 . A A . 23 TRP HD1 1 1 13 5633 1 1 23 TRP HE1 H 4.621 -10.401 4.733 1.00 . A A . 23 TRP HE1 1 1 13 5634 1 1 23 TRP HE3 H 3.014 -6.679 1.293 1.00 . A A . 23 TRP HE3 1 1 13 5635 1 1 23 TRP HH2 H 0.020 -9.258 3.048 1.00 . A A . 23 TRP HH2 1 1 13 5636 1 1 23 TRP HZ2 H 1.793 -10.422 4.341 1.00 . A A . 23 TRP HZ2 1 1 13 5637 1 1 23 TRP HZ3 H 0.619 -7.389 1.515 1.00 . A A . 23 TRP HZ3 1 1 13 5638 1 1 23 TRP N N 7.161 -6.701 -0.115 1.00 . A A . 23 TRP N 1 1 13 5639 1 1 23 TRP NE1 N 4.565 -9.609 4.110 1.00 . A A . 23 TRP NE1 1 1 13 5640 1 1 23 TRP O O 6.038 -9.886 0.256 1.00 . A A . 23 TRP O 1 1 13 5641 1 1 24 LEU C C 4.380 -9.872 -2.148 1.00 . A A . 24 LEU C 1 1 13 5642 1 1 24 LEU CA C 3.725 -8.927 -1.141 1.00 . A A . 24 LEU CA 1 1 13 5643 1 1 24 LEU CB C 2.791 -7.929 -1.836 1.00 . A A . 24 LEU CB 1 1 13 5644 1 1 24 LEU CD1 C 0.742 -9.438 -1.776 1.00 . A A . 24 LEU CD1 1 1 13 5645 1 1 24 LEU CD2 C 0.839 -7.476 -3.326 1.00 . A A . 24 LEU CD2 1 1 13 5646 1 1 24 LEU CG C 1.662 -8.579 -2.653 1.00 . A A . 24 LEU CG 1 1 13 5647 1 1 24 LEU H H 4.622 -7.164 -0.397 1.00 . A A . 24 LEU H 1 1 13 5648 1 1 24 LEU HA H 3.159 -9.502 -0.410 1.00 . A A . 24 LEU HA 1 1 13 5649 1 1 24 LEU HB2 H 2.351 -7.285 -1.074 1.00 . A A . 24 LEU HB2 1 1 13 5650 1 1 24 LEU HB3 H 3.392 -7.306 -2.500 1.00 . A A . 24 LEU HB3 1 1 13 5651 1 1 24 LEU HD11 H 1.280 -10.304 -1.392 1.00 . A A . 24 LEU HD11 1 1 13 5652 1 1 24 LEU HD12 H 0.364 -8.848 -0.940 1.00 . A A . 24 LEU HD12 1 1 13 5653 1 1 24 LEU HD13 H -0.100 -9.795 -2.369 1.00 . A A . 24 LEU HD13 1 1 13 5654 1 1 24 LEU HD21 H 1.483 -6.874 -3.968 1.00 . A A . 24 LEU HD21 1 1 13 5655 1 1 24 LEU HD22 H 0.052 -7.921 -3.936 1.00 . A A . 24 LEU HD22 1 1 13 5656 1 1 24 LEU HD23 H 0.385 -6.833 -2.571 1.00 . A A . 24 LEU HD23 1 1 13 5657 1 1 24 LEU HG H 2.087 -9.206 -3.438 1.00 . A A . 24 LEU HG 1 1 13 5658 1 1 24 LEU N N 4.737 -8.167 -0.426 1.00 . A A . 24 LEU N 1 1 13 5659 1 1 24 LEU O O 3.989 -11.032 -2.265 1.00 . A A . 24 LEU O 1 1 13 5660 1 1 25 MET C C 6.942 -11.235 -3.149 1.00 . A A . 25 MET C 1 1 13 5661 1 1 25 MET CA C 6.151 -10.124 -3.839 1.00 . A A . 25 MET CA 1 1 13 5662 1 1 25 MET CB C 7.089 -9.196 -4.623 1.00 . A A . 25 MET CB 1 1 13 5663 1 1 25 MET CE C 4.834 -7.765 -7.871 1.00 . A A . 25 MET CE 1 1 13 5664 1 1 25 MET CG C 6.328 -8.302 -5.610 1.00 . A A . 25 MET CG 1 1 13 5665 1 1 25 MET H H 5.660 -8.405 -2.662 1.00 . A A . 25 MET H 1 1 13 5666 1 1 25 MET HA H 5.453 -10.592 -4.536 1.00 . A A . 25 MET HA 1 1 13 5667 1 1 25 MET HB2 H 7.649 -8.574 -3.924 1.00 . A A . 25 MET HB2 1 1 13 5668 1 1 25 MET HB3 H 7.802 -9.800 -5.187 1.00 . A A . 25 MET HB3 1 1 13 5669 1 1 25 MET HE1 H 4.342 -8.115 -8.779 1.00 . A A . 25 MET HE1 1 1 13 5670 1 1 25 MET HE2 H 4.093 -7.311 -7.212 1.00 . A A . 25 MET HE2 1 1 13 5671 1 1 25 MET HE3 H 5.591 -7.026 -8.132 1.00 . A A . 25 MET HE3 1 1 13 5672 1 1 25 MET HG2 H 5.519 -7.790 -5.093 1.00 . A A . 25 MET HG2 1 1 13 5673 1 1 25 MET HG3 H 7.022 -7.551 -5.990 1.00 . A A . 25 MET HG3 1 1 13 5674 1 1 25 MET N N 5.389 -9.361 -2.860 1.00 . A A . 25 MET N 1 1 13 5675 1 1 25 MET O O 6.877 -12.387 -3.571 1.00 . A A . 25 MET O 1 1 13 5676 1 1 25 MET SD S 5.615 -9.168 -7.033 1.00 . A A . 25 MET SD 1 1 13 5677 1 1 26 ASN C C 7.742 -12.980 -0.778 1.00 . A A . 26 ASN C 1 1 13 5678 1 1 26 ASN CA C 8.540 -11.813 -1.366 1.00 . A A . 26 ASN CA 1 1 13 5679 1 1 26 ASN CB C 9.308 -11.058 -0.275 1.00 . A A . 26 ASN CB 1 1 13 5680 1 1 26 ASN CG C 10.242 -11.987 0.493 1.00 . A A . 26 ASN CG 1 1 13 5681 1 1 26 ASN H H 7.689 -9.918 -1.794 1.00 . A A . 26 ASN H 1 1 13 5682 1 1 26 ASN HA H 9.268 -12.218 -2.073 1.00 . A A . 26 ASN HA 1 1 13 5683 1 1 26 ASN HB2 H 9.904 -10.267 -0.733 1.00 . A A . 26 ASN HB2 1 1 13 5684 1 1 26 ASN HB3 H 8.606 -10.603 0.424 1.00 . A A . 26 ASN HB3 1 1 13 5685 1 1 26 ASN HD21 H 11.491 -12.140 -1.109 1.00 . A A . 26 ASN HD21 1 1 13 5686 1 1 26 ASN HD22 H 11.965 -13.048 0.310 1.00 . A A . 26 ASN HD22 1 1 13 5687 1 1 26 ASN N N 7.687 -10.885 -2.093 1.00 . A A . 26 ASN N 1 1 13 5688 1 1 26 ASN ND2 N 11.322 -12.426 -0.155 1.00 . A A . 26 ASN ND2 1 1 13 5689 1 1 26 ASN O O 8.108 -14.136 -0.982 1.00 . A A . 26 ASN O 1 1 13 5690 1 1 26 ASN OD1 O 9.992 -12.306 1.653 1.00 . A A . 26 ASN OD1 1 1 13 5691 1 1 27 THR C C 5.033 -14.491 -0.440 1.00 . A A . 27 THR C 1 1 13 5692 1 1 27 THR CA C 5.832 -13.696 0.594 1.00 . A A . 27 THR CA 1 1 13 5693 1 1 27 THR CB C 4.934 -13.057 1.666 1.00 . A A . 27 THR CB 1 1 13 5694 1 1 27 THR CG2 C 3.740 -12.272 1.112 1.00 . A A . 27 THR CG2 1 1 13 5695 1 1 27 THR H H 6.403 -11.714 0.073 1.00 . A A . 27 THR H 1 1 13 5696 1 1 27 THR HA H 6.502 -14.387 1.110 1.00 . A A . 27 THR HA 1 1 13 5697 1 1 27 THR HB H 5.548 -12.369 2.242 1.00 . A A . 27 THR HB 1 1 13 5698 1 1 27 THR HG1 H 3.950 -14.695 2.042 1.00 . A A . 27 THR HG1 1 1 13 5699 1 1 27 THR HG21 H 4.080 -11.547 0.378 1.00 . A A . 27 THR HG21 1 1 13 5700 1 1 27 THR HG22 H 3.017 -12.943 0.649 1.00 . A A . 27 THR HG22 1 1 13 5701 1 1 27 THR HG23 H 3.248 -11.744 1.928 1.00 . A A . 27 THR HG23 1 1 13 5702 1 1 27 THR N N 6.659 -12.683 -0.048 1.00 . A A . 27 THR N 1 1 13 5703 1 1 27 THR O O 4.869 -15.700 -0.299 1.00 . A A . 27 THR O 1 1 13 5704 1 1 27 THR OG1 O 4.454 -14.052 2.547 1.00 . A A . 27 THR OG1 1 1 13 5705 1 1 28 NH2 HN1 H 4.673 -12.823 -1.572 1.00 . A A . 28 NH2 HN1 1 1 13 5706 1 1 28 NH2 HN2 H 3.981 -14.315 -2.162 1.00 . A A . 28 NH2 HN2 1 1 13 5707 1 1 28 NH2 N N 4.528 -13.820 -1.478 1.00 . A A . 28 NH2 N 1 1 14 5708 1 1 1 SER C C -7.077 8.147 -10.453 1.00 . A A . 1 SER C 1 1 14 5709 1 1 1 SER CA C -7.455 7.642 -11.845 1.00 . A A . 1 SER CA 1 1 14 5710 1 1 1 SER CB C -6.225 7.625 -12.759 1.00 . A A . 1 SER CB 1 1 14 5711 1 1 1 SER H1 H -8.236 9.407 -12.520 1.00 . A A . 1 SER H1 1 1 14 5712 1 1 1 SER H2 H -8.760 8.084 -13.355 1.00 . A A . 1 SER H2 1 1 14 5713 1 1 1 SER H3 H -9.356 8.400 -11.848 1.00 . A A . 1 SER H3 1 1 14 5714 1 1 1 SER HA H -7.827 6.621 -11.755 1.00 . A A . 1 SER HA 1 1 14 5715 1 1 1 SER HB2 H -5.836 8.638 -12.874 1.00 . A A . 1 SER HB2 1 1 14 5716 1 1 1 SER HB3 H -5.450 6.995 -12.322 1.00 . A A . 1 SER HB3 1 1 14 5717 1 1 1 SER HG H -6.891 6.217 -13.926 1.00 . A A . 1 SER HG 1 1 14 5718 1 1 1 SER N N -8.538 8.446 -12.439 1.00 . A A . 1 SER N 1 1 14 5719 1 1 1 SER O O -7.187 9.342 -10.181 1.00 . A A . 1 SER O 1 1 14 5720 1 1 1 SER OG O -6.570 7.116 -14.030 1.00 . A A . 1 SER OG 1 1 14 5721 1 1 2 GLN C C -7.188 8.388 -7.459 1.00 . A A . 2 GLN C 1 1 14 5722 1 1 2 GLN CA C -6.215 7.464 -8.209 1.00 . A A . 2 GLN CA 1 1 14 5723 1 1 2 GLN CB C -4.722 7.841 -8.127 1.00 . A A . 2 GLN CB 1 1 14 5724 1 1 2 GLN CD C -2.788 9.320 -8.856 1.00 . A A . 2 GLN CD 1 1 14 5725 1 1 2 GLN CG C -4.260 8.967 -9.069 1.00 . A A . 2 GLN CG 1 1 14 5726 1 1 2 GLN H H -6.572 6.268 -9.910 1.00 . A A . 2 GLN H 1 1 14 5727 1 1 2 GLN HA H -6.299 6.503 -7.699 1.00 . A A . 2 GLN HA 1 1 14 5728 1 1 2 GLN HB2 H -4.478 8.103 -7.097 1.00 . A A . 2 GLN HB2 1 1 14 5729 1 1 2 GLN HB3 H -4.151 6.947 -8.386 1.00 . A A . 2 GLN HB3 1 1 14 5730 1 1 2 GLN HE21 H -3.123 11.267 -9.357 1.00 . A A . 2 GLN HE21 1 1 14 5731 1 1 2 GLN HE22 H -1.472 10.865 -8.937 1.00 . A A . 2 GLN HE22 1 1 14 5732 1 1 2 GLN HG2 H -4.371 8.647 -10.104 1.00 . A A . 2 GLN HG2 1 1 14 5733 1 1 2 GLN HG3 H -4.863 9.860 -8.914 1.00 . A A . 2 GLN HG3 1 1 14 5734 1 1 2 GLN N N -6.626 7.224 -9.590 1.00 . A A . 2 GLN N 1 1 14 5735 1 1 2 GLN NE2 N -2.433 10.588 -9.071 1.00 . A A . 2 GLN NE2 1 1 14 5736 1 1 2 GLN O O -8.352 8.028 -7.290 1.00 . A A . 2 GLN O 1 1 14 5737 1 1 2 GLN OE1 O -1.978 8.464 -8.503 1.00 . A A . 2 GLN OE1 1 1 14 5738 1 1 3 GLY C C -6.880 11.907 -6.364 1.00 . A A . 3 GLY C 1 1 14 5739 1 1 3 GLY CA C -7.567 10.545 -6.340 1.00 . A A . 3 GLY CA 1 1 14 5740 1 1 3 GLY H H -5.769 9.816 -7.164 1.00 . A A . 3 GLY H 1 1 14 5741 1 1 3 GLY HA2 H -8.531 10.633 -6.843 1.00 . A A . 3 GLY HA2 1 1 14 5742 1 1 3 GLY HA3 H -7.728 10.224 -5.310 1.00 . A A . 3 GLY HA3 1 1 14 5743 1 1 3 GLY N N -6.734 9.564 -7.014 1.00 . A A . 3 GLY N 1 1 14 5744 1 1 3 GLY O O -6.129 12.202 -7.292 1.00 . A A . 3 GLY O 1 1 14 5745 1 1 4 THR C C -5.162 13.856 -4.412 1.00 . A A . 4 THR C 1 1 14 5746 1 1 4 THR CA C -6.490 14.024 -5.160 1.00 . A A . 4 THR CA 1 1 14 5747 1 1 4 THR CB C -7.461 14.999 -4.468 1.00 . A A . 4 THR CB 1 1 14 5748 1 1 4 THR CG2 C -7.807 14.595 -3.030 1.00 . A A . 4 THR CG2 1 1 14 5749 1 1 4 THR H H -7.764 12.413 -4.614 1.00 . A A . 4 THR H 1 1 14 5750 1 1 4 THR HA H -6.266 14.445 -6.142 1.00 . A A . 4 THR HA 1 1 14 5751 1 1 4 THR HB H -8.386 15.030 -5.047 1.00 . A A . 4 THR HB 1 1 14 5752 1 1 4 THR HG1 H -7.572 16.908 -4.100 1.00 . A A . 4 THR HG1 1 1 14 5753 1 1 4 THR HG21 H -8.479 15.336 -2.598 1.00 . A A . 4 THR HG21 1 1 14 5754 1 1 4 THR HG22 H -8.308 13.628 -3.019 1.00 . A A . 4 THR HG22 1 1 14 5755 1 1 4 THR HG23 H -6.906 14.543 -2.421 1.00 . A A . 4 THR HG23 1 1 14 5756 1 1 4 THR N N -7.135 12.727 -5.338 1.00 . A A . 4 THR N 1 1 14 5757 1 1 4 THR O O -4.785 12.741 -4.049 1.00 . A A . 4 THR O 1 1 14 5758 1 1 4 THR OG1 O -6.920 16.305 -4.466 1.00 . A A . 4 THR OG1 1 1 14 5759 1 1 5 THR C C -3.171 14.252 -2.199 1.00 . A A . 5 THR C 1 1 14 5760 1 1 5 THR CA C -3.156 15.009 -3.527 1.00 . A A . 5 THR CA 1 1 14 5761 1 1 5 THR CB C -2.655 16.458 -3.397 1.00 . A A . 5 THR CB 1 1 14 5762 1 1 5 THR CG2 C -3.590 17.377 -2.600 1.00 . A A . 5 THR CG2 1 1 14 5763 1 1 5 THR H H -4.856 15.846 -4.495 1.00 . A A . 5 THR H 1 1 14 5764 1 1 5 THR HA H -2.451 14.492 -4.176 1.00 . A A . 5 THR HA 1 1 14 5765 1 1 5 THR HB H -2.552 16.870 -4.403 1.00 . A A . 5 THR HB 1 1 14 5766 1 1 5 THR HG1 H -0.803 15.855 -3.234 1.00 . A A . 5 THR HG1 1 1 14 5767 1 1 5 THR HG21 H -3.204 18.396 -2.641 1.00 . A A . 5 THR HG21 1 1 14 5768 1 1 5 THR HG22 H -4.595 17.371 -3.023 1.00 . A A . 5 THR HG22 1 1 14 5769 1 1 5 THR HG23 H -3.634 17.070 -1.556 1.00 . A A . 5 THR HG23 1 1 14 5770 1 1 5 THR N N -4.455 14.970 -4.187 1.00 . A A . 5 THR N 1 1 14 5771 1 1 5 THR O O -2.282 13.440 -1.953 1.00 . A A . 5 THR O 1 1 14 5772 1 1 5 THR OG1 O -1.383 16.477 -2.784 1.00 . A A . 5 THR OG1 1 1 14 5773 1 1 6 SER C C -4.321 12.297 -0.192 1.00 . A A . 6 SER C 1 1 14 5774 1 1 6 SER CA C -4.375 13.825 -0.081 1.00 . A A . 6 SER CA 1 1 14 5775 1 1 6 SER CB C -5.714 14.263 0.520 1.00 . A A . 6 SER CB 1 1 14 5776 1 1 6 SER H H -4.884 15.174 -1.628 1.00 . A A . 6 SER H 1 1 14 5777 1 1 6 SER HA H -3.577 14.152 0.587 1.00 . A A . 6 SER HA 1 1 14 5778 1 1 6 SER HB2 H -6.537 13.861 -0.072 1.00 . A A . 6 SER HB2 1 1 14 5779 1 1 6 SER HB3 H -5.798 13.885 1.540 1.00 . A A . 6 SER HB3 1 1 14 5780 1 1 6 SER HG H -5.086 16.024 1.062 1.00 . A A . 6 SER HG 1 1 14 5781 1 1 6 SER N N -4.190 14.489 -1.365 1.00 . A A . 6 SER N 1 1 14 5782 1 1 6 SER O O -3.917 11.636 0.761 1.00 . A A . 6 SER O 1 1 14 5783 1 1 6 SER OG O -5.805 15.673 0.530 1.00 . A A . 6 SER OG 1 1 14 5784 1 1 7 GLU C C -3.450 9.827 -2.188 1.00 . A A . 7 GLU C 1 1 14 5785 1 1 7 GLU CA C -4.771 10.315 -1.594 1.00 . A A . 7 GLU CA 1 1 14 5786 1 1 7 GLU CB C -5.952 9.972 -2.517 1.00 . A A . 7 GLU CB 1 1 14 5787 1 1 7 GLU CD C -7.605 10.201 -0.600 1.00 . A A . 7 GLU CD 1 1 14 5788 1 1 7 GLU CG C -7.282 10.575 -2.044 1.00 . A A . 7 GLU CG 1 1 14 5789 1 1 7 GLU H H -5.022 12.349 -2.099 1.00 . A A . 7 GLU H 1 1 14 5790 1 1 7 GLU HA H -4.927 9.789 -0.651 1.00 . A A . 7 GLU HA 1 1 14 5791 1 1 7 GLU HB2 H -5.758 10.337 -3.526 1.00 . A A . 7 GLU HB2 1 1 14 5792 1 1 7 GLU HB3 H -6.052 8.887 -2.563 1.00 . A A . 7 GLU HB3 1 1 14 5793 1 1 7 GLU HG2 H -7.245 11.660 -2.138 1.00 . A A . 7 GLU HG2 1 1 14 5794 1 1 7 GLU HG3 H -8.081 10.209 -2.690 1.00 . A A . 7 GLU HG3 1 1 14 5795 1 1 7 GLU N N -4.729 11.746 -1.343 1.00 . A A . 7 GLU N 1 1 14 5796 1 1 7 GLU O O -2.799 8.963 -1.602 1.00 . A A . 7 GLU O 1 1 14 5797 1 1 7 GLU OE1 O -7.970 9.025 -0.384 1.00 . A A . 7 GLU OE1 1 1 14 5798 1 1 7 GLU OE2 O -7.479 11.097 0.264 1.00 . A A . 7 GLU OE2 1 1 14 5799 1 1 8 TYR C C -0.580 10.157 -3.478 1.00 . A A . 8 TYR C 1 1 14 5800 1 1 8 TYR CA C -1.927 9.805 -4.100 1.00 . A A . 8 TYR CA 1 1 14 5801 1 1 8 TYR CB C -1.975 10.165 -5.590 1.00 . A A . 8 TYR CB 1 1 14 5802 1 1 8 TYR CD1 C -0.388 12.111 -5.981 1.00 . A A . 8 TYR CD1 1 1 14 5803 1 1 8 TYR CD2 C -2.764 12.434 -6.373 1.00 . A A . 8 TYR CD2 1 1 14 5804 1 1 8 TYR CE1 C -0.144 13.442 -6.361 1.00 . A A . 8 TYR CE1 1 1 14 5805 1 1 8 TYR CE2 C -2.520 13.754 -6.788 1.00 . A A . 8 TYR CE2 1 1 14 5806 1 1 8 TYR CG C -1.706 11.616 -5.944 1.00 . A A . 8 TYR CG 1 1 14 5807 1 1 8 TYR CZ C -1.212 14.267 -6.757 1.00 . A A . 8 TYR CZ 1 1 14 5808 1 1 8 TYR H H -3.625 11.069 -3.797 1.00 . A A . 8 TYR H 1 1 14 5809 1 1 8 TYR HA H -2.019 8.725 -4.058 1.00 . A A . 8 TYR HA 1 1 14 5810 1 1 8 TYR HB2 H -1.223 9.560 -6.099 1.00 . A A . 8 TYR HB2 1 1 14 5811 1 1 8 TYR HB3 H -2.949 9.868 -5.979 1.00 . A A . 8 TYR HB3 1 1 14 5812 1 1 8 TYR HD1 H 0.445 11.476 -5.711 1.00 . A A . 8 TYR HD1 1 1 14 5813 1 1 8 TYR HD2 H -3.766 12.040 -6.389 1.00 . A A . 8 TYR HD2 1 1 14 5814 1 1 8 TYR HE1 H 0.866 13.826 -6.351 1.00 . A A . 8 TYR HE1 1 1 14 5815 1 1 8 TYR HE2 H -3.339 14.376 -7.116 1.00 . A A . 8 TYR HE2 1 1 14 5816 1 1 8 TYR HH H -0.058 15.815 -7.056 1.00 . A A . 8 TYR HH 1 1 14 5817 1 1 8 TYR N N -3.073 10.336 -3.370 1.00 . A A . 8 TYR N 1 1 14 5818 1 1 8 TYR O O 0.341 9.341 -3.528 1.00 . A A . 8 TYR O 1 1 14 5819 1 1 8 TYR OH O -0.984 15.565 -7.109 1.00 . A A . 8 TYR OH 1 1 14 5820 1 1 9 SER C C 1.415 11.002 -1.323 1.00 . A A . 9 SER C 1 1 14 5821 1 1 9 SER CA C 0.831 11.870 -2.440 1.00 . A A . 9 SER CA 1 1 14 5822 1 1 9 SER CB C 0.737 13.339 -2.016 1.00 . A A . 9 SER CB 1 1 14 5823 1 1 9 SER H H -1.246 11.991 -2.880 1.00 . A A . 9 SER H 1 1 14 5824 1 1 9 SER HA H 1.518 11.856 -3.282 1.00 . A A . 9 SER HA 1 1 14 5825 1 1 9 SER HB2 H 0.122 13.443 -1.123 1.00 . A A . 9 SER HB2 1 1 14 5826 1 1 9 SER HB3 H 1.738 13.711 -1.793 1.00 . A A . 9 SER HB3 1 1 14 5827 1 1 9 SER HG H -0.728 13.852 -3.170 1.00 . A A . 9 SER HG 1 1 14 5828 1 1 9 SER N N -0.448 11.371 -2.926 1.00 . A A . 9 SER N 1 1 14 5829 1 1 9 SER O O 2.618 11.059 -1.091 1.00 . A A . 9 SER O 1 1 14 5830 1 1 9 SER OG O 0.192 14.110 -3.066 1.00 . A A . 9 SER OG 1 1 14 5831 1 1 10 LYS C C 1.936 8.285 0.009 1.00 . A A . 10 LYS C 1 1 14 5832 1 1 10 LYS CA C 0.998 9.386 0.487 1.00 . A A . 10 LYS CA 1 1 14 5833 1 1 10 LYS CB C -0.227 8.789 1.192 1.00 . A A . 10 LYS CB 1 1 14 5834 1 1 10 LYS CD C -0.945 11.014 2.357 1.00 . A A . 10 LYS CD 1 1 14 5835 1 1 10 LYS CE C -0.390 12.185 1.530 1.00 . A A . 10 LYS CE 1 1 14 5836 1 1 10 LYS CG C -1.347 9.792 1.514 1.00 . A A . 10 LYS CG 1 1 14 5837 1 1 10 LYS H H -0.389 10.153 -0.896 1.00 . A A . 10 LYS H 1 1 14 5838 1 1 10 LYS HA H 1.542 10.000 1.206 1.00 . A A . 10 LYS HA 1 1 14 5839 1 1 10 LYS HB2 H -0.664 8.017 0.554 1.00 . A A . 10 LYS HB2 1 1 14 5840 1 1 10 LYS HB3 H 0.108 8.310 2.113 1.00 . A A . 10 LYS HB3 1 1 14 5841 1 1 10 LYS HD2 H -1.856 11.366 2.844 1.00 . A A . 10 LYS HD2 1 1 14 5842 1 1 10 LYS HD3 H -0.235 10.725 3.133 1.00 . A A . 10 LYS HD3 1 1 14 5843 1 1 10 LYS HE2 H 0.657 12.023 1.276 1.00 . A A . 10 LYS HE2 1 1 14 5844 1 1 10 LYS HE3 H -0.966 12.295 0.612 1.00 . A A . 10 LYS HE3 1 1 14 5845 1 1 10 LYS HG2 H -1.821 10.125 0.593 1.00 . A A . 10 LYS HG2 1 1 14 5846 1 1 10 LYS HG3 H -2.100 9.240 2.079 1.00 . A A . 10 LYS HG3 1 1 14 5847 1 1 10 LYS HZ1 H -1.434 13.649 2.503 1.00 . A A . 10 LYS HZ1 1 1 14 5848 1 1 10 LYS HZ2 H 0.070 13.378 3.125 1.00 . A A . 10 LYS HZ2 1 1 14 5849 1 1 10 LYS HZ3 H -0.100 14.200 1.705 1.00 . A A . 10 LYS HZ3 1 1 14 5850 1 1 10 LYS N N 0.584 10.204 -0.637 1.00 . A A . 10 LYS N 1 1 14 5851 1 1 10 LYS NZ N -0.470 13.452 2.274 1.00 . A A . 10 LYS NZ 1 1 14 5852 1 1 10 LYS O O 3.072 8.201 0.463 1.00 . A A . 10 LYS O 1 1 14 5853 1 1 11 TYR C C 3.395 6.798 -2.275 1.00 . A A . 11 TYR C 1 1 14 5854 1 1 11 TYR CA C 2.245 6.314 -1.399 1.00 . A A . 11 TYR CA 1 1 14 5855 1 1 11 TYR CB C 1.334 5.300 -2.089 1.00 . A A . 11 TYR CB 1 1 14 5856 1 1 11 TYR CD1 C 0.888 6.127 -4.448 1.00 . A A . 11 TYR CD1 1 1 14 5857 1 1 11 TYR CD2 C -0.992 5.812 -2.936 1.00 . A A . 11 TYR CD2 1 1 14 5858 1 1 11 TYR CE1 C 0.000 6.469 -5.482 1.00 . A A . 11 TYR CE1 1 1 14 5859 1 1 11 TYR CE2 C -1.882 6.098 -3.984 1.00 . A A . 11 TYR CE2 1 1 14 5860 1 1 11 TYR CG C 0.397 5.821 -3.163 1.00 . A A . 11 TYR CG 1 1 14 5861 1 1 11 TYR CZ C -1.386 6.444 -5.253 1.00 . A A . 11 TYR CZ 1 1 14 5862 1 1 11 TYR H H 0.576 7.613 -1.346 1.00 . A A . 11 TYR H 1 1 14 5863 1 1 11 TYR HA H 2.688 5.801 -0.548 1.00 . A A . 11 TYR HA 1 1 14 5864 1 1 11 TYR HB2 H 1.972 4.549 -2.541 1.00 . A A . 11 TYR HB2 1 1 14 5865 1 1 11 TYR HB3 H 0.748 4.822 -1.300 1.00 . A A . 11 TYR HB3 1 1 14 5866 1 1 11 TYR HD1 H 1.948 6.085 -4.652 1.00 . A A . 11 TYR HD1 1 1 14 5867 1 1 11 TYR HD2 H -1.385 5.564 -1.960 1.00 . A A . 11 TYR HD2 1 1 14 5868 1 1 11 TYR HE1 H 0.386 6.733 -6.456 1.00 . A A . 11 TYR HE1 1 1 14 5869 1 1 11 TYR HE2 H -2.947 6.069 -3.809 1.00 . A A . 11 TYR HE2 1 1 14 5870 1 1 11 TYR HH H -1.836 7.093 -7.051 1.00 . A A . 11 TYR HH 1 1 14 5871 1 1 11 TYR N N 1.468 7.438 -0.911 1.00 . A A . 11 TYR N 1 1 14 5872 1 1 11 TYR O O 4.459 6.182 -2.297 1.00 . A A . 11 TYR O 1 1 14 5873 1 1 11 TYR OH O -2.258 6.761 -6.253 1.00 . A A . 11 TYR OH 1 1 14 5874 1 1 12 LEU C C 5.345 9.100 -2.831 1.00 . A A . 12 LEU C 1 1 14 5875 1 1 12 LEU CA C 4.200 8.608 -3.731 1.00 . A A . 12 LEU CA 1 1 14 5876 1 1 12 LEU CB C 3.513 9.760 -4.478 1.00 . A A . 12 LEU CB 1 1 14 5877 1 1 12 LEU CD1 C 5.304 10.064 -6.257 1.00 . A A . 12 LEU CD1 1 1 14 5878 1 1 12 LEU CD2 C 3.607 11.849 -5.853 1.00 . A A . 12 LEU CD2 1 1 14 5879 1 1 12 LEU CG C 4.445 10.752 -5.188 1.00 . A A . 12 LEU CG 1 1 14 5880 1 1 12 LEU H H 2.266 8.351 -2.925 1.00 . A A . 12 LEU H 1 1 14 5881 1 1 12 LEU HA H 4.585 7.895 -4.456 1.00 . A A . 12 LEU HA 1 1 14 5882 1 1 12 LEU HB2 H 2.812 9.341 -5.202 1.00 . A A . 12 LEU HB2 1 1 14 5883 1 1 12 LEU HB3 H 2.950 10.324 -3.742 1.00 . A A . 12 LEU HB3 1 1 14 5884 1 1 12 LEU HD11 H 5.928 10.806 -6.756 1.00 . A A . 12 LEU HD11 1 1 14 5885 1 1 12 LEU HD12 H 5.953 9.313 -5.810 1.00 . A A . 12 LEU HD12 1 1 14 5886 1 1 12 LEU HD13 H 4.662 9.584 -6.996 1.00 . A A . 12 LEU HD13 1 1 14 5887 1 1 12 LEU HD21 H 3.017 12.375 -5.103 1.00 . A A . 12 LEU HD21 1 1 14 5888 1 1 12 LEU HD22 H 4.264 12.568 -6.345 1.00 . A A . 12 LEU HD22 1 1 14 5889 1 1 12 LEU HD23 H 2.937 11.414 -6.596 1.00 . A A . 12 LEU HD23 1 1 14 5890 1 1 12 LEU HG H 5.077 11.233 -4.439 1.00 . A A . 12 LEU HG 1 1 14 5891 1 1 12 LEU N N 3.182 7.922 -2.964 1.00 . A A . 12 LEU N 1 1 14 5892 1 1 12 LEU O O 6.488 9.153 -3.279 1.00 . A A . 12 LEU O 1 1 14 5893 1 1 13 ASP C C 7.311 9.486 -0.510 1.00 . A A . 13 ASP C 1 1 14 5894 1 1 13 ASP CA C 5.955 10.156 -0.669 1.00 . A A . 13 ASP CA 1 1 14 5895 1 1 13 ASP CB C 5.287 10.363 0.700 1.00 . A A . 13 ASP CB 1 1 14 5896 1 1 13 ASP CG C 6.159 11.177 1.652 1.00 . A A . 13 ASP CG 1 1 14 5897 1 1 13 ASP H H 4.070 9.432 -1.286 1.00 . A A . 13 ASP H 1 1 14 5898 1 1 13 ASP HA H 6.169 11.115 -1.100 1.00 . A A . 13 ASP HA 1 1 14 5899 1 1 13 ASP HB2 H 4.341 10.886 0.576 1.00 . A A . 13 ASP HB2 1 1 14 5900 1 1 13 ASP HB3 H 5.086 9.395 1.156 1.00 . A A . 13 ASP HB3 1 1 14 5901 1 1 13 ASP N N 5.033 9.501 -1.589 1.00 . A A . 13 ASP N 1 1 14 5902 1 1 13 ASP O O 8.341 10.071 -0.843 1.00 . A A . 13 ASP O 1 1 14 5903 1 1 13 ASP OD1 O 6.411 12.358 1.328 1.00 . A A . 13 ASP OD1 1 1 14 5904 1 1 13 ASP OD2 O 6.558 10.603 2.688 1.00 . A A . 13 ASP OD2 1 1 14 5905 1 1 14 SER C C 8.445 6.142 -0.032 1.00 . A A . 14 SER C 1 1 14 5906 1 1 14 SER CA C 8.480 7.572 0.491 1.00 . A A . 14 SER CA 1 1 14 5907 1 1 14 SER CB C 8.606 7.650 2.020 1.00 . A A . 14 SER CB 1 1 14 5908 1 1 14 SER H H 6.372 7.911 0.242 1.00 . A A . 14 SER H 1 1 14 5909 1 1 14 SER HA H 9.375 8.031 0.068 1.00 . A A . 14 SER HA 1 1 14 5910 1 1 14 SER HB2 H 7.679 7.327 2.498 1.00 . A A . 14 SER HB2 1 1 14 5911 1 1 14 SER HB3 H 9.426 7.013 2.354 1.00 . A A . 14 SER HB3 1 1 14 5912 1 1 14 SER HG H 8.137 9.533 2.197 1.00 . A A . 14 SER HG 1 1 14 5913 1 1 14 SER N N 7.289 8.290 0.068 1.00 . A A . 14 SER N 1 1 14 5914 1 1 14 SER O O 8.786 5.907 -1.190 1.00 . A A . 14 SER O 1 1 14 5915 1 1 14 SER OG O 8.886 8.974 2.422 1.00 . A A . 14 SER OG 1 1 14 5916 1 1 15 ARG C C 7.134 2.957 1.326 1.00 . A A . 15 ARG C 1 1 14 5917 1 1 15 ARG CA C 8.110 3.778 0.488 1.00 . A A . 15 ARG CA 1 1 14 5918 1 1 15 ARG CB C 9.565 3.265 0.552 1.00 . A A . 15 ARG CB 1 1 14 5919 1 1 15 ARG CD C 9.775 2.941 3.093 1.00 . A A . 15 ARG CD 1 1 14 5920 1 1 15 ARG CG C 10.343 3.605 1.835 1.00 . A A . 15 ARG CG 1 1 14 5921 1 1 15 ARG CZ C 10.458 2.602 5.462 1.00 . A A . 15 ARG CZ 1 1 14 5922 1 1 15 ARG H H 7.744 5.431 1.745 1.00 . A A . 15 ARG H 1 1 14 5923 1 1 15 ARG HA H 7.758 3.672 -0.533 1.00 . A A . 15 ARG HA 1 1 14 5924 1 1 15 ARG HB2 H 9.586 2.185 0.398 1.00 . A A . 15 ARG HB2 1 1 14 5925 1 1 15 ARG HB3 H 10.111 3.715 -0.278 1.00 . A A . 15 ARG HB3 1 1 14 5926 1 1 15 ARG HD2 H 8.804 3.372 3.334 1.00 . A A . 15 ARG HD2 1 1 14 5927 1 1 15 ARG HD3 H 9.669 1.871 2.912 1.00 . A A . 15 ARG HD3 1 1 14 5928 1 1 15 ARG HE H 11.474 3.722 4.107 1.00 . A A . 15 ARG HE 1 1 14 5929 1 1 15 ARG HG2 H 11.365 3.248 1.698 1.00 . A A . 15 ARG HG2 1 1 14 5930 1 1 15 ARG HG3 H 10.381 4.685 1.978 1.00 . A A . 15 ARG HG3 1 1 14 5931 1 1 15 ARG HH11 H 8.729 1.627 4.966 1.00 . A A . 15 ARG HH11 1 1 14 5932 1 1 15 ARG HH12 H 9.257 1.423 6.620 1.00 . A A . 15 ARG HH12 1 1 14 5933 1 1 15 ARG HH21 H 12.136 3.435 6.276 1.00 . A A . 15 ARG HH21 1 1 14 5934 1 1 15 ARG HH22 H 11.186 2.447 7.363 1.00 . A A . 15 ARG HH22 1 1 14 5935 1 1 15 ARG N N 8.058 5.186 0.820 1.00 . A A . 15 ARG N 1 1 14 5936 1 1 15 ARG NE N 10.660 3.140 4.247 1.00 . A A . 15 ARG NE 1 1 14 5937 1 1 15 ARG NH1 N 9.394 1.821 5.701 1.00 . A A . 15 ARG NH1 1 1 14 5938 1 1 15 ARG NH2 N 11.331 2.849 6.447 1.00 . A A . 15 ARG NH2 1 1 14 5939 1 1 15 ARG O O 7.377 1.779 1.564 1.00 . A A . 15 ARG O 1 1 14 5940 1 1 16 ARG C C 4.420 1.731 1.503 1.00 . A A . 16 ARG C 1 1 14 5941 1 1 16 ARG CA C 4.963 2.812 2.437 1.00 . A A . 16 ARG CA 1 1 14 5942 1 1 16 ARG CB C 3.886 3.766 2.969 1.00 . A A . 16 ARG CB 1 1 14 5943 1 1 16 ARG CD C 2.378 5.725 2.560 1.00 . A A . 16 ARG CD 1 1 14 5944 1 1 16 ARG CG C 3.166 4.593 1.902 1.00 . A A . 16 ARG CG 1 1 14 5945 1 1 16 ARG CZ C 3.690 7.190 4.145 1.00 . A A . 16 ARG CZ 1 1 14 5946 1 1 16 ARG H H 5.859 4.532 1.552 1.00 . A A . 16 ARG H 1 1 14 5947 1 1 16 ARG HA H 5.386 2.328 3.314 1.00 . A A . 16 ARG HA 1 1 14 5948 1 1 16 ARG HB2 H 3.137 3.189 3.514 1.00 . A A . 16 ARG HB2 1 1 14 5949 1 1 16 ARG HB3 H 4.377 4.446 3.661 1.00 . A A . 16 ARG HB3 1 1 14 5950 1 1 16 ARG HD2 H 1.659 6.089 1.829 1.00 . A A . 16 ARG HD2 1 1 14 5951 1 1 16 ARG HD3 H 1.825 5.338 3.415 1.00 . A A . 16 ARG HD3 1 1 14 5952 1 1 16 ARG HE H 3.536 7.441 2.148 1.00 . A A . 16 ARG HE 1 1 14 5953 1 1 16 ARG HG2 H 3.880 5.021 1.199 1.00 . A A . 16 ARG HG2 1 1 14 5954 1 1 16 ARG HG3 H 2.463 3.955 1.366 1.00 . A A . 16 ARG HG3 1 1 14 5955 1 1 16 ARG HH11 H 2.767 5.667 5.158 1.00 . A A . 16 ARG HH11 1 1 14 5956 1 1 16 ARG HH12 H 3.700 6.767 6.142 1.00 . A A . 16 ARG HH12 1 1 14 5957 1 1 16 ARG HH21 H 4.745 8.803 3.464 1.00 . A A . 16 ARG HH21 1 1 14 5958 1 1 16 ARG HH22 H 4.824 8.530 5.189 1.00 . A A . 16 ARG HH22 1 1 14 5959 1 1 16 ARG N N 6.015 3.554 1.755 1.00 . A A . 16 ARG N 1 1 14 5960 1 1 16 ARG NE N 3.252 6.852 2.920 1.00 . A A . 16 ARG NE 1 1 14 5961 1 1 16 ARG NH1 N 3.356 6.484 5.236 1.00 . A A . 16 ARG NH1 1 1 14 5962 1 1 16 ARG NH2 N 4.485 8.262 4.277 1.00 . A A . 16 ARG NH2 1 1 14 5963 1 1 16 ARG O O 4.430 0.549 1.833 1.00 . A A . 16 ARG O 1 1 14 5964 1 1 17 ALA C C 4.573 0.439 -1.340 1.00 . A A . 17 ALA C 1 1 14 5965 1 1 17 ALA CA C 3.467 1.291 -0.729 1.00 . A A . 17 ALA CA 1 1 14 5966 1 1 17 ALA CB C 2.815 2.169 -1.788 1.00 . A A . 17 ALA CB 1 1 14 5967 1 1 17 ALA H H 4.051 3.138 0.111 1.00 . A A . 17 ALA H 1 1 14 5968 1 1 17 ALA HA H 2.703 0.636 -0.312 1.00 . A A . 17 ALA HA 1 1 14 5969 1 1 17 ALA HB1 H 3.533 2.913 -2.139 1.00 . A A . 17 ALA HB1 1 1 14 5970 1 1 17 ALA HB2 H 2.479 1.564 -2.628 1.00 . A A . 17 ALA HB2 1 1 14 5971 1 1 17 ALA HB3 H 1.960 2.669 -1.334 1.00 . A A . 17 ALA HB3 1 1 14 5972 1 1 17 ALA N N 3.987 2.152 0.314 1.00 . A A . 17 ALA N 1 1 14 5973 1 1 17 ALA O O 4.361 -0.742 -1.596 1.00 . A A . 17 ALA O 1 1 14 5974 1 1 18 GLN C C 7.266 -0.855 -1.281 1.00 . A A . 18 GLN C 1 1 14 5975 1 1 18 GLN CA C 6.885 0.338 -2.163 1.00 . A A . 18 GLN CA 1 1 14 5976 1 1 18 GLN CB C 8.068 1.304 -2.340 1.00 . A A . 18 GLN CB 1 1 14 5977 1 1 18 GLN CD C 6.661 3.255 -3.357 1.00 . A A . 18 GLN CD 1 1 14 5978 1 1 18 GLN CG C 7.910 2.370 -3.445 1.00 . A A . 18 GLN CG 1 1 14 5979 1 1 18 GLN H H 5.857 2.006 -1.336 1.00 . A A . 18 GLN H 1 1 14 5980 1 1 18 GLN HA H 6.593 -0.045 -3.143 1.00 . A A . 18 GLN HA 1 1 14 5981 1 1 18 GLN HB2 H 8.285 1.776 -1.387 1.00 . A A . 18 GLN HB2 1 1 14 5982 1 1 18 GLN HB3 H 8.941 0.708 -2.608 1.00 . A A . 18 GLN HB3 1 1 14 5983 1 1 18 GLN HE21 H 7.631 4.829 -2.418 1.00 . A A . 18 GLN HE21 1 1 14 5984 1 1 18 GLN HE22 H 5.932 5.039 -2.734 1.00 . A A . 18 GLN HE22 1 1 14 5985 1 1 18 GLN HG2 H 8.798 3.004 -3.437 1.00 . A A . 18 GLN HG2 1 1 14 5986 1 1 18 GLN HG3 H 7.879 1.849 -4.402 1.00 . A A . 18 GLN HG3 1 1 14 5987 1 1 18 GLN N N 5.749 1.031 -1.573 1.00 . A A . 18 GLN N 1 1 14 5988 1 1 18 GLN NE2 N 6.761 4.461 -2.785 1.00 . A A . 18 GLN NE2 1 1 14 5989 1 1 18 GLN O O 7.464 -1.956 -1.786 1.00 . A A . 18 GLN O 1 1 14 5990 1 1 18 GLN OE1 O 5.598 2.857 -3.826 1.00 . A A . 18 GLN OE1 1 1 14 5991 1 1 19 ASP C C 6.526 -2.774 0.915 1.00 . A A . 19 ASP C 1 1 14 5992 1 1 19 ASP CA C 7.583 -1.677 1.030 1.00 . A A . 19 ASP CA 1 1 14 5993 1 1 19 ASP CB C 7.592 -1.073 2.440 1.00 . A A . 19 ASP CB 1 1 14 5994 1 1 19 ASP CG C 7.775 -2.146 3.511 1.00 . A A . 19 ASP CG 1 1 14 5995 1 1 19 ASP H H 7.138 0.291 0.376 1.00 . A A . 19 ASP H 1 1 14 5996 1 1 19 ASP HA H 8.565 -2.113 0.837 1.00 . A A . 19 ASP HA 1 1 14 5997 1 1 19 ASP HB2 H 8.411 -0.357 2.522 1.00 . A A . 19 ASP HB2 1 1 14 5998 1 1 19 ASP HB3 H 6.655 -0.548 2.626 1.00 . A A . 19 ASP HB3 1 1 14 5999 1 1 19 ASP N N 7.336 -0.638 0.038 1.00 . A A . 19 ASP N 1 1 14 6000 1 1 19 ASP O O 6.871 -3.951 0.853 1.00 . A A . 19 ASP O 1 1 14 6001 1 1 19 ASP OD1 O 8.935 -2.570 3.700 1.00 . A A . 19 ASP OD1 1 1 14 6002 1 1 19 ASP OD2 O 6.749 -2.525 4.119 1.00 . A A . 19 ASP OD2 1 1 14 6003 1 1 20 PHE C C 4.291 -4.143 -0.566 1.00 . A A . 20 PHE C 1 1 14 6004 1 1 20 PHE CA C 4.144 -3.327 0.722 1.00 . A A . 20 PHE CA 1 1 14 6005 1 1 20 PHE CB C 2.791 -2.602 0.774 1.00 . A A . 20 PHE CB 1 1 14 6006 1 1 20 PHE CD1 C 3.168 -1.974 3.231 1.00 . A A . 20 PHE CD1 1 1 14 6007 1 1 20 PHE CD2 C 1.540 -0.732 1.917 1.00 . A A . 20 PHE CD2 1 1 14 6008 1 1 20 PHE CE1 C 2.931 -1.124 4.325 1.00 . A A . 20 PHE CE1 1 1 14 6009 1 1 20 PHE CE2 C 1.305 0.120 3.011 1.00 . A A . 20 PHE CE2 1 1 14 6010 1 1 20 PHE CG C 2.497 -1.761 2.008 1.00 . A A . 20 PHE CG 1 1 14 6011 1 1 20 PHE CZ C 2.008 -0.070 4.212 1.00 . A A . 20 PHE CZ 1 1 14 6012 1 1 20 PHE H H 5.021 -1.403 0.957 1.00 . A A . 20 PHE H 1 1 14 6013 1 1 20 PHE HA H 4.178 -4.036 1.549 1.00 . A A . 20 PHE HA 1 1 14 6014 1 1 20 PHE HB2 H 2.719 -1.953 -0.099 1.00 . A A . 20 PHE HB2 1 1 14 6015 1 1 20 PHE HB3 H 2.002 -3.350 0.693 1.00 . A A . 20 PHE HB3 1 1 14 6016 1 1 20 PHE HD1 H 3.879 -2.776 3.350 1.00 . A A . 20 PHE HD1 1 1 14 6017 1 1 20 PHE HD2 H 0.987 -0.584 1.001 1.00 . A A . 20 PHE HD2 1 1 14 6018 1 1 20 PHE HE1 H 3.463 -1.278 5.252 1.00 . A A . 20 PHE HE1 1 1 14 6019 1 1 20 PHE HE2 H 0.585 0.921 2.927 1.00 . A A . 20 PHE HE2 1 1 14 6020 1 1 20 PHE HZ H 1.834 0.588 5.051 1.00 . A A . 20 PHE HZ 1 1 14 6021 1 1 20 PHE N N 5.245 -2.386 0.879 1.00 . A A . 20 PHE N 1 1 14 6022 1 1 20 PHE O O 3.965 -5.326 -0.567 1.00 . A A . 20 PHE O 1 1 14 6023 1 1 21 VAL C C 6.099 -5.300 -2.765 1.00 . A A . 21 VAL C 1 1 14 6024 1 1 21 VAL CA C 4.977 -4.273 -2.908 1.00 . A A . 21 VAL CA 1 1 14 6025 1 1 21 VAL CB C 5.187 -3.305 -4.087 1.00 . A A . 21 VAL CB 1 1 14 6026 1 1 21 VAL CG1 C 5.656 -4.038 -5.352 1.00 . A A . 21 VAL CG1 1 1 14 6027 1 1 21 VAL CG2 C 3.873 -2.583 -4.416 1.00 . A A . 21 VAL CG2 1 1 14 6028 1 1 21 VAL H H 5.067 -2.570 -1.614 1.00 . A A . 21 VAL H 1 1 14 6029 1 1 21 VAL HA H 4.072 -4.849 -3.093 1.00 . A A . 21 VAL HA 1 1 14 6030 1 1 21 VAL HB H 5.941 -2.564 -3.824 1.00 . A A . 21 VAL HB 1 1 14 6031 1 1 21 VAL HG11 H 6.656 -4.449 -5.210 1.00 . A A . 21 VAL HG11 1 1 14 6032 1 1 21 VAL HG12 H 4.965 -4.846 -5.595 1.00 . A A . 21 VAL HG12 1 1 14 6033 1 1 21 VAL HG13 H 5.693 -3.339 -6.188 1.00 . A A . 21 VAL HG13 1 1 14 6034 1 1 21 VAL HG21 H 3.474 -2.083 -3.535 1.00 . A A . 21 VAL HG21 1 1 14 6035 1 1 21 VAL HG22 H 4.047 -1.837 -5.191 1.00 . A A . 21 VAL HG22 1 1 14 6036 1 1 21 VAL HG23 H 3.134 -3.300 -4.773 1.00 . A A . 21 VAL HG23 1 1 14 6037 1 1 21 VAL N N 4.790 -3.546 -1.657 1.00 . A A . 21 VAL N 1 1 14 6038 1 1 21 VAL O O 5.891 -6.471 -3.071 1.00 . A A . 21 VAL O 1 1 14 6039 1 1 22 GLN C C 7.965 -6.936 -1.138 1.00 . A A . 22 GLN C 1 1 14 6040 1 1 22 GLN CA C 8.394 -5.771 -2.025 1.00 . A A . 22 GLN CA 1 1 14 6041 1 1 22 GLN CB C 9.522 -5.012 -1.320 1.00 . A A . 22 GLN CB 1 1 14 6042 1 1 22 GLN CD C 10.915 -4.506 -3.380 1.00 . A A . 22 GLN CD 1 1 14 6043 1 1 22 GLN CG C 10.129 -3.927 -2.206 1.00 . A A . 22 GLN CG 1 1 14 6044 1 1 22 GLN H H 7.378 -3.897 -2.052 1.00 . A A . 22 GLN H 1 1 14 6045 1 1 22 GLN HA H 8.759 -6.173 -2.972 1.00 . A A . 22 GLN HA 1 1 14 6046 1 1 22 GLN HB2 H 9.129 -4.544 -0.417 1.00 . A A . 22 GLN HB2 1 1 14 6047 1 1 22 GLN HB3 H 10.305 -5.713 -1.025 1.00 . A A . 22 GLN HB3 1 1 14 6048 1 1 22 GLN HE21 H 12.387 -5.178 -2.143 1.00 . A A . 22 GLN HE21 1 1 14 6049 1 1 22 GLN HE22 H 12.617 -5.511 -3.847 1.00 . A A . 22 GLN HE22 1 1 14 6050 1 1 22 GLN HG2 H 9.333 -3.296 -2.592 1.00 . A A . 22 GLN HG2 1 1 14 6051 1 1 22 GLN HG3 H 10.783 -3.322 -1.582 1.00 . A A . 22 GLN HG3 1 1 14 6052 1 1 22 GLN N N 7.273 -4.875 -2.288 1.00 . A A . 22 GLN N 1 1 14 6053 1 1 22 GLN NE2 N 12.068 -5.114 -3.098 1.00 . A A . 22 GLN NE2 1 1 14 6054 1 1 22 GLN O O 8.379 -8.071 -1.358 1.00 . A A . 22 GLN O 1 1 14 6055 1 1 22 GLN OE1 O 10.486 -4.404 -4.527 1.00 . A A . 22 GLN OE1 1 1 14 6056 1 1 23 TRP C C 5.808 -8.647 0.184 1.00 . A A . 23 TRP C 1 1 14 6057 1 1 23 TRP CA C 6.715 -7.618 0.849 1.00 . A A . 23 TRP CA 1 1 14 6058 1 1 23 TRP CB C 5.989 -6.909 1.991 1.00 . A A . 23 TRP CB 1 1 14 6059 1 1 23 TRP CD1 C 5.606 -8.785 3.627 1.00 . A A . 23 TRP CD1 1 1 14 6060 1 1 23 TRP CD2 C 3.713 -8.050 2.700 1.00 . A A . 23 TRP CD2 1 1 14 6061 1 1 23 TRP CE2 C 3.358 -9.130 3.556 1.00 . A A . 23 TRP CE2 1 1 14 6062 1 1 23 TRP CE3 C 2.694 -7.481 1.913 1.00 . A A . 23 TRP CE3 1 1 14 6063 1 1 23 TRP CG C 5.144 -7.830 2.801 1.00 . A A . 23 TRP CG 1 1 14 6064 1 1 23 TRP CH2 C 1.037 -8.981 2.894 1.00 . A A . 23 TRP CH2 1 1 14 6065 1 1 23 TRP CZ2 C 2.039 -9.592 3.665 1.00 . A A . 23 TRP CZ2 1 1 14 6066 1 1 23 TRP CZ3 C 1.365 -7.933 2.014 1.00 . A A . 23 TRP CZ3 1 1 14 6067 1 1 23 TRP H H 6.719 -5.718 -0.095 1.00 . A A . 23 TRP H 1 1 14 6068 1 1 23 TRP HA H 7.591 -8.127 1.256 1.00 . A A . 23 TRP HA 1 1 14 6069 1 1 23 TRP HB2 H 6.716 -6.415 2.636 1.00 . A A . 23 TRP HB2 1 1 14 6070 1 1 23 TRP HB3 H 5.330 -6.147 1.580 1.00 . A A . 23 TRP HB3 1 1 14 6071 1 1 23 TRP HD1 H 6.657 -8.943 3.803 1.00 . A A . 23 TRP HD1 1 1 14 6072 1 1 23 TRP HE1 H 4.620 -10.310 4.759 1.00 . A A . 23 TRP HE1 1 1 14 6073 1 1 23 TRP HE3 H 2.976 -6.711 1.208 1.00 . A A . 23 TRP HE3 1 1 14 6074 1 1 23 TRP HH2 H 0.019 -9.328 2.974 1.00 . A A . 23 TRP HH2 1 1 14 6075 1 1 23 TRP HZ2 H 1.799 -10.414 4.323 1.00 . A A . 23 TRP HZ2 1 1 14 6076 1 1 23 TRP HZ3 H 0.596 -7.479 1.406 1.00 . A A . 23 TRP HZ3 1 1 14 6077 1 1 23 TRP N N 7.132 -6.644 -0.137 1.00 . A A . 23 TRP N 1 1 14 6078 1 1 23 TRP NE1 N 4.554 -9.535 4.116 1.00 . A A . 23 TRP NE1 1 1 14 6079 1 1 23 TRP O O 6.067 -9.845 0.264 1.00 . A A . 23 TRP O 1 1 14 6080 1 1 24 LEU C C 4.460 -9.885 -2.173 1.00 . A A . 24 LEU C 1 1 14 6081 1 1 24 LEU CA C 3.767 -8.937 -1.195 1.00 . A A . 24 LEU CA 1 1 14 6082 1 1 24 LEU CB C 2.835 -7.961 -1.923 1.00 . A A . 24 LEU CB 1 1 14 6083 1 1 24 LEU CD1 C 0.810 -9.503 -1.899 1.00 . A A . 24 LEU CD1 1 1 14 6084 1 1 24 LEU CD2 C 0.913 -7.553 -3.464 1.00 . A A . 24 LEU CD2 1 1 14 6085 1 1 24 LEU CG C 1.737 -8.637 -2.761 1.00 . A A . 24 LEU CG 1 1 14 6086 1 1 24 LEU H H 4.613 -7.153 -0.436 1.00 . A A . 24 LEU H 1 1 14 6087 1 1 24 LEU HA H 3.189 -9.510 -0.472 1.00 . A A . 24 LEU HA 1 1 14 6088 1 1 24 LEU HB2 H 2.366 -7.316 -1.180 1.00 . A A . 24 LEU HB2 1 1 14 6089 1 1 24 LEU HB3 H 3.442 -7.335 -2.579 1.00 . A A . 24 LEU HB3 1 1 14 6090 1 1 24 LEU HD11 H 1.352 -10.357 -1.495 1.00 . A A . 24 LEU HD11 1 1 14 6091 1 1 24 LEU HD12 H 0.402 -8.912 -1.078 1.00 . A A . 24 LEU HD12 1 1 14 6092 1 1 24 LEU HD13 H -0.011 -9.879 -2.509 1.00 . A A . 24 LEU HD13 1 1 14 6093 1 1 24 LEU HD21 H 1.562 -6.946 -4.096 1.00 . A A . 24 LEU HD21 1 1 14 6094 1 1 24 LEU HD22 H 0.149 -8.016 -4.089 1.00 . A A . 24 LEU HD22 1 1 14 6095 1 1 24 LEU HD23 H 0.430 -6.911 -2.726 1.00 . A A . 24 LEU HD23 1 1 14 6096 1 1 24 LEU HG H 2.192 -9.263 -3.530 1.00 . A A . 24 LEU HG 1 1 14 6097 1 1 24 LEU N N 4.748 -8.155 -0.461 1.00 . A A . 24 LEU N 1 1 14 6098 1 1 24 LEU O O 4.076 -11.047 -2.294 1.00 . A A . 24 LEU O 1 1 14 6099 1 1 25 MET C C 7.067 -11.247 -3.104 1.00 . A A . 25 MET C 1 1 14 6100 1 1 25 MET CA C 6.273 -10.148 -3.815 1.00 . A A . 25 MET CA 1 1 14 6101 1 1 25 MET CB C 7.199 -9.220 -4.615 1.00 . A A . 25 MET CB 1 1 14 6102 1 1 25 MET CE C 4.925 -7.889 -7.893 1.00 . A A . 25 MET CE 1 1 14 6103 1 1 25 MET CG C 6.425 -8.358 -5.619 1.00 . A A . 25 MET CG 1 1 14 6104 1 1 25 MET H H 5.754 -8.420 -2.662 1.00 . A A . 25 MET H 1 1 14 6105 1 1 25 MET HA H 5.587 -10.635 -4.509 1.00 . A A . 25 MET HA 1 1 14 6106 1 1 25 MET HB2 H 7.746 -8.573 -3.929 1.00 . A A . 25 MET HB2 1 1 14 6107 1 1 25 MET HB3 H 7.921 -9.821 -5.169 1.00 . A A . 25 MET HB3 1 1 14 6108 1 1 25 MET HE1 H 4.176 -7.435 -7.244 1.00 . A A . 25 MET HE1 1 1 14 6109 1 1 25 MET HE2 H 5.670 -7.141 -8.166 1.00 . A A . 25 MET HE2 1 1 14 6110 1 1 25 MET HE3 H 4.442 -8.264 -8.795 1.00 . A A . 25 MET HE3 1 1 14 6111 1 1 25 MET HG2 H 5.606 -7.849 -5.114 1.00 . A A . 25 MET HG2 1 1 14 6112 1 1 25 MET HG3 H 7.106 -7.603 -6.013 1.00 . A A . 25 MET HG3 1 1 14 6113 1 1 25 MET N N 5.490 -9.379 -2.857 1.00 . A A . 25 MET N 1 1 14 6114 1 1 25 MET O O 7.022 -12.400 -3.527 1.00 . A A . 25 MET O 1 1 14 6115 1 1 25 MET SD S 5.729 -9.262 -7.027 1.00 . A A . 25 MET SD 1 1 14 6116 1 1 26 ASN C C 7.780 -12.976 -0.696 1.00 . A A . 26 ASN C 1 1 14 6117 1 1 26 ASN CA C 8.614 -11.831 -1.277 1.00 . A A . 26 ASN CA 1 1 14 6118 1 1 26 ASN CB C 9.374 -11.100 -0.159 1.00 . A A . 26 ASN CB 1 1 14 6119 1 1 26 ASN CG C 10.419 -10.110 -0.676 1.00 . A A . 26 ASN CG 1 1 14 6120 1 1 26 ASN H H 7.783 -9.927 -1.735 1.00 . A A . 26 ASN H 1 1 14 6121 1 1 26 ASN HA H 9.345 -12.271 -1.957 1.00 . A A . 26 ASN HA 1 1 14 6122 1 1 26 ASN HB2 H 8.663 -10.570 0.476 1.00 . A A . 26 ASN HB2 1 1 14 6123 1 1 26 ASN HB3 H 9.893 -11.840 0.451 1.00 . A A . 26 ASN HB3 1 1 14 6124 1 1 26 ASN HD21 H 10.639 -9.304 1.183 1.00 . A A . 26 ASN HD21 1 1 14 6125 1 1 26 ASN HD22 H 11.632 -8.596 -0.075 1.00 . A A . 26 ASN HD22 1 1 14 6126 1 1 26 ASN N N 7.787 -10.895 -2.031 1.00 . A A . 26 ASN N 1 1 14 6127 1 1 26 ASN ND2 N 10.940 -9.269 0.220 1.00 . A A . 26 ASN ND2 1 1 14 6128 1 1 26 ASN O O 8.134 -14.140 -0.873 1.00 . A A . 26 ASN O 1 1 14 6129 1 1 26 ASN OD1 O 10.758 -10.098 -1.857 1.00 . A A . 26 ASN OD1 1 1 14 6130 1 1 27 THR C C 5.056 -14.464 -0.392 1.00 . A A . 27 THR C 1 1 14 6131 1 1 27 THR CA C 5.833 -13.650 0.642 1.00 . A A . 27 THR CA 1 1 14 6132 1 1 27 THR CB C 4.913 -12.986 1.680 1.00 . A A . 27 THR CB 1 1 14 6133 1 1 27 THR CG2 C 3.734 -12.214 1.082 1.00 . A A . 27 THR CG2 1 1 14 6134 1 1 27 THR H H 6.432 -11.680 0.097 1.00 . A A . 27 THR H 1 1 14 6135 1 1 27 THR HA H 6.487 -14.333 1.188 1.00 . A A . 27 THR HA 1 1 14 6136 1 1 27 THR HB H 5.515 -12.286 2.254 1.00 . A A . 27 THR HB 1 1 14 6137 1 1 27 THR HG1 H 3.917 -14.613 2.071 1.00 . A A . 27 THR HG1 1 1 14 6138 1 1 27 THR HG21 H 3.223 -11.667 1.874 1.00 . A A . 27 THR HG21 1 1 14 6139 1 1 27 THR HG22 H 4.094 -11.506 0.341 1.00 . A A . 27 THR HG22 1 1 14 6140 1 1 27 THR HG23 H 3.021 -12.894 0.615 1.00 . A A . 27 THR HG23 1 1 14 6141 1 1 27 THR N N 6.681 -12.654 -0.001 1.00 . A A . 27 THR N 1 1 14 6142 1 1 27 THR O O 4.881 -15.669 -0.227 1.00 . A A . 27 THR O 1 1 14 6143 1 1 27 THR OG1 O 4.413 -13.961 2.572 1.00 . A A . 27 THR OG1 1 1 14 6144 1 1 28 NH2 HN1 H 4.733 -12.822 -1.572 1.00 . A A . 28 NH2 HN1 1 1 14 6145 1 1 28 NH2 HN2 H 4.048 -14.324 -2.143 1.00 . A A . 28 NH2 HN2 1 1 14 6146 1 1 28 NH2 N N 4.580 -13.816 -1.458 1.00 . A A . 28 NH2 N 1 1 15 6147 1 1 1 SER C C -12.598 3.593 -0.367 1.00 . A A . 1 SER C 1 1 15 6148 1 1 1 SER CA C -14.074 3.560 -0.767 1.00 . A A . 1 SER CA 1 1 15 6149 1 1 1 SER CB C -14.318 4.392 -2.032 1.00 . A A . 1 SER CB 1 1 15 6150 1 1 1 SER H1 H -14.813 3.417 1.135 1.00 . A A . 1 SER H1 1 1 15 6151 1 1 1 SER H2 H -14.719 4.964 0.571 1.00 . A A . 1 SER H2 1 1 15 6152 1 1 1 SER H3 H -15.913 3.962 0.030 1.00 . A A . 1 SER H3 1 1 15 6153 1 1 1 SER HA H -14.338 2.524 -0.987 1.00 . A A . 1 SER HA 1 1 15 6154 1 1 1 SER HB2 H -14.069 5.437 -1.843 1.00 . A A . 1 SER HB2 1 1 15 6155 1 1 1 SER HB3 H -13.700 4.022 -2.850 1.00 . A A . 1 SER HB3 1 1 15 6156 1 1 1 SER HG H -15.885 3.391 -2.606 1.00 . A A . 1 SER HG 1 1 15 6157 1 1 1 SER N N -14.950 4.011 0.329 1.00 . A A . 1 SER N 1 1 15 6158 1 1 1 SER O O -12.238 4.167 0.659 1.00 . A A . 1 SER O 1 1 15 6159 1 1 1 SER OG O -15.675 4.308 -2.414 1.00 . A A . 1 SER OG 1 1 15 6160 1 1 2 GLN C C -9.646 4.199 -1.332 1.00 . A A . 2 GLN C 1 1 15 6161 1 1 2 GLN CA C -10.315 2.878 -0.954 1.00 . A A . 2 GLN CA 1 1 15 6162 1 1 2 GLN CB C -9.709 1.705 -1.743 1.00 . A A . 2 GLN CB 1 1 15 6163 1 1 2 GLN CD C -11.649 0.025 -1.597 1.00 . A A . 2 GLN CD 1 1 15 6164 1 1 2 GLN CG C -10.191 0.331 -1.249 1.00 . A A . 2 GLN CG 1 1 15 6165 1 1 2 GLN H H -12.113 2.496 -2.006 1.00 . A A . 2 GLN H 1 1 15 6166 1 1 2 GLN HA H -10.141 2.689 0.105 1.00 . A A . 2 GLN HA 1 1 15 6167 1 1 2 GLN HB2 H -9.917 1.811 -2.809 1.00 . A A . 2 GLN HB2 1 1 15 6168 1 1 2 GLN HB3 H -8.627 1.737 -1.605 1.00 . A A . 2 GLN HB3 1 1 15 6169 1 1 2 GLN HE21 H -11.863 -1.131 0.068 1.00 . A A . 2 GLN HE21 1 1 15 6170 1 1 2 GLN HE22 H -13.284 -0.991 -0.946 1.00 . A A . 2 GLN HE22 1 1 15 6171 1 1 2 GLN HG2 H -9.573 -0.437 -1.715 1.00 . A A . 2 GLN HG2 1 1 15 6172 1 1 2 GLN HG3 H -10.048 0.276 -0.169 1.00 . A A . 2 GLN HG3 1 1 15 6173 1 1 2 GLN N N -11.747 2.967 -1.189 1.00 . A A . 2 GLN N 1 1 15 6174 1 1 2 GLN NE2 N -12.319 -0.764 -0.755 1.00 . A A . 2 GLN NE2 1 1 15 6175 1 1 2 GLN O O -9.051 4.855 -0.480 1.00 . A A . 2 GLN O 1 1 15 6176 1 1 2 GLN OE1 O -12.169 0.494 -2.608 1.00 . A A . 2 GLN OE1 1 1 15 6177 1 1 3 GLY C C -9.828 7.040 -2.769 1.00 . A A . 3 GLY C 1 1 15 6178 1 1 3 GLY CA C -9.078 5.765 -3.143 1.00 . A A . 3 GLY CA 1 1 15 6179 1 1 3 GLY H H -10.263 4.010 -3.253 1.00 . A A . 3 GLY H 1 1 15 6180 1 1 3 GLY HA2 H -8.057 5.817 -2.768 1.00 . A A . 3 GLY HA2 1 1 15 6181 1 1 3 GLY HA3 H -9.039 5.678 -4.230 1.00 . A A . 3 GLY HA3 1 1 15 6182 1 1 3 GLY N N -9.738 4.584 -2.610 1.00 . A A . 3 GLY N 1 1 15 6183 1 1 3 GLY O O -10.450 7.661 -3.629 1.00 . A A . 3 GLY O 1 1 15 6184 1 1 4 THR C C -9.379 9.681 -0.646 1.00 . A A . 4 THR C 1 1 15 6185 1 1 4 THR CA C -10.423 8.604 -0.948 1.00 . A A . 4 THR CA 1 1 15 6186 1 1 4 THR CB C -11.281 8.200 0.262 1.00 . A A . 4 THR CB 1 1 15 6187 1 1 4 THR CG2 C -12.459 7.330 -0.183 1.00 . A A . 4 THR CG2 1 1 15 6188 1 1 4 THR H H -9.242 6.850 -0.832 1.00 . A A . 4 THR H 1 1 15 6189 1 1 4 THR HA H -11.099 9.043 -1.677 1.00 . A A . 4 THR HA 1 1 15 6190 1 1 4 THR HB H -11.683 9.099 0.729 1.00 . A A . 4 THR HB 1 1 15 6191 1 1 4 THR HG1 H -10.273 6.633 0.841 1.00 . A A . 4 THR HG1 1 1 15 6192 1 1 4 THR HG21 H -13.096 7.894 -0.865 1.00 . A A . 4 THR HG21 1 1 15 6193 1 1 4 THR HG22 H -12.096 6.438 -0.692 1.00 . A A . 4 THR HG22 1 1 15 6194 1 1 4 THR HG23 H -13.045 7.034 0.687 1.00 . A A . 4 THR HG23 1 1 15 6195 1 1 4 THR N N -9.765 7.423 -1.487 1.00 . A A . 4 THR N 1 1 15 6196 1 1 4 THR O O -8.815 10.263 -1.571 1.00 . A A . 4 THR O 1 1 15 6197 1 1 4 THR OG1 O -10.507 7.490 1.210 1.00 . A A . 4 THR OG1 1 1 15 6198 1 1 5 THR C C -7.524 10.473 2.391 1.00 . A A . 5 THR C 1 1 15 6199 1 1 5 THR CA C -8.226 10.977 1.129 1.00 . A A . 5 THR CA 1 1 15 6200 1 1 5 THR CB C -8.998 12.280 1.406 1.00 . A A . 5 THR CB 1 1 15 6201 1 1 5 THR CG2 C -9.467 12.957 0.114 1.00 . A A . 5 THR CG2 1 1 15 6202 1 1 5 THR H H -9.636 9.401 1.325 1.00 . A A . 5 THR H 1 1 15 6203 1 1 5 THR HA H -7.455 11.187 0.386 1.00 . A A . 5 THR HA 1 1 15 6204 1 1 5 THR HB H -8.332 12.972 1.924 1.00 . A A . 5 THR HB 1 1 15 6205 1 1 5 THR HG1 H -10.571 12.862 2.395 1.00 . A A . 5 THR HG1 1 1 15 6206 1 1 5 THR HG21 H -10.217 12.346 -0.388 1.00 . A A . 5 THR HG21 1 1 15 6207 1 1 5 THR HG22 H -9.907 13.925 0.351 1.00 . A A . 5 THR HG22 1 1 15 6208 1 1 5 THR HG23 H -8.619 13.110 -0.555 1.00 . A A . 5 THR HG23 1 1 15 6209 1 1 5 THR N N -9.133 9.947 0.640 1.00 . A A . 5 THR N 1 1 15 6210 1 1 5 THR O O -6.301 10.354 2.415 1.00 . A A . 5 THR O 1 1 15 6211 1 1 5 THR OG1 O -10.123 12.029 2.225 1.00 . A A . 5 THR OG1 1 1 15 6212 1 1 6 SER C C -6.832 8.634 4.701 1.00 . A A . 6 SER C 1 1 15 6213 1 1 6 SER CA C -7.856 9.771 4.756 1.00 . A A . 6 SER CA 1 1 15 6214 1 1 6 SER CB C -9.073 9.380 5.602 1.00 . A A . 6 SER CB 1 1 15 6215 1 1 6 SER H H -9.307 10.308 3.313 1.00 . A A . 6 SER H 1 1 15 6216 1 1 6 SER HA H -7.382 10.631 5.232 1.00 . A A . 6 SER HA 1 1 15 6217 1 1 6 SER HB2 H -8.742 8.997 6.569 1.00 . A A . 6 SER HB2 1 1 15 6218 1 1 6 SER HB3 H -9.696 10.260 5.767 1.00 . A A . 6 SER HB3 1 1 15 6219 1 1 6 SER HG H -10.597 8.170 5.490 1.00 . A A . 6 SER HG 1 1 15 6220 1 1 6 SER N N -8.311 10.181 3.433 1.00 . A A . 6 SER N 1 1 15 6221 1 1 6 SER O O -5.771 8.736 5.314 1.00 . A A . 6 SER O 1 1 15 6222 1 1 6 SER OG O -9.843 8.396 4.940 1.00 . A A . 6 SER OG 1 1 15 6223 1 1 7 GLU C C -5.380 6.649 2.560 1.00 . A A . 7 GLU C 1 1 15 6224 1 1 7 GLU CA C -6.272 6.421 3.770 1.00 . A A . 7 GLU CA 1 1 15 6225 1 1 7 GLU CB C -7.079 5.123 3.626 1.00 . A A . 7 GLU CB 1 1 15 6226 1 1 7 GLU CD C -8.882 3.797 2.462 1.00 . A A . 7 GLU CD 1 1 15 6227 1 1 7 GLU CG C -8.113 5.114 2.494 1.00 . A A . 7 GLU CG 1 1 15 6228 1 1 7 GLU H H -8.027 7.579 3.460 1.00 . A A . 7 GLU H 1 1 15 6229 1 1 7 GLU HA H -5.633 6.298 4.639 1.00 . A A . 7 GLU HA 1 1 15 6230 1 1 7 GLU HB2 H -6.373 4.312 3.447 1.00 . A A . 7 GLU HB2 1 1 15 6231 1 1 7 GLU HB3 H -7.601 4.942 4.563 1.00 . A A . 7 GLU HB3 1 1 15 6232 1 1 7 GLU HG2 H -8.820 5.933 2.623 1.00 . A A . 7 GLU HG2 1 1 15 6233 1 1 7 GLU HG3 H -7.608 5.226 1.538 1.00 . A A . 7 GLU HG3 1 1 15 6234 1 1 7 GLU N N -7.153 7.564 3.967 1.00 . A A . 7 GLU N 1 1 15 6235 1 1 7 GLU O O -4.191 6.339 2.582 1.00 . A A . 7 GLU O 1 1 15 6236 1 1 7 GLU OE1 O -8.273 2.794 2.032 1.00 . A A . 7 GLU OE1 1 1 15 6237 1 1 7 GLU OE2 O -10.066 3.815 2.865 1.00 . A A . 7 GLU OE2 1 1 15 6238 1 1 8 TYR C C -4.079 8.095 0.256 1.00 . A A . 8 TYR C 1 1 15 6239 1 1 8 TYR CA C -5.401 7.347 0.199 1.00 . A A . 8 TYR CA 1 1 15 6240 1 1 8 TYR CB C -6.418 8.062 -0.674 1.00 . A A . 8 TYR CB 1 1 15 6241 1 1 8 TYR CD1 C -5.595 7.240 -2.896 1.00 . A A . 8 TYR CD1 1 1 15 6242 1 1 8 TYR CD2 C -5.655 9.637 -2.484 1.00 . A A . 8 TYR CD2 1 1 15 6243 1 1 8 TYR CE1 C -5.066 7.466 -4.171 1.00 . A A . 8 TYR CE1 1 1 15 6244 1 1 8 TYR CE2 C -5.141 9.867 -3.766 1.00 . A A . 8 TYR CE2 1 1 15 6245 1 1 8 TYR CG C -5.923 8.324 -2.068 1.00 . A A . 8 TYR CG 1 1 15 6246 1 1 8 TYR CZ C -4.843 8.783 -4.615 1.00 . A A . 8 TYR CZ 1 1 15 6247 1 1 8 TYR H H -6.969 7.413 1.590 1.00 . A A . 8 TYR H 1 1 15 6248 1 1 8 TYR HA H -5.215 6.365 -0.222 1.00 . A A . 8 TYR HA 1 1 15 6249 1 1 8 TYR HB2 H -7.304 7.436 -0.733 1.00 . A A . 8 TYR HB2 1 1 15 6250 1 1 8 TYR HB3 H -6.686 9.003 -0.200 1.00 . A A . 8 TYR HB3 1 1 15 6251 1 1 8 TYR HD1 H -5.735 6.228 -2.551 1.00 . A A . 8 TYR HD1 1 1 15 6252 1 1 8 TYR HD2 H -5.831 10.471 -1.821 1.00 . A A . 8 TYR HD2 1 1 15 6253 1 1 8 TYR HE1 H -4.837 6.609 -4.783 1.00 . A A . 8 TYR HE1 1 1 15 6254 1 1 8 TYR HE2 H -4.976 10.886 -4.068 1.00 . A A . 8 TYR HE2 1 1 15 6255 1 1 8 TYR HH H -4.222 9.936 -6.063 1.00 . A A . 8 TYR HH 1 1 15 6256 1 1 8 TYR N N -5.993 7.172 1.500 1.00 . A A . 8 TYR N 1 1 15 6257 1 1 8 TYR O O -3.062 7.562 -0.179 1.00 . A A . 8 TYR O 1 1 15 6258 1 1 8 TYR OH O -4.336 9.005 -5.861 1.00 . A A . 8 TYR OH 1 1 15 6259 1 1 9 SER C C -1.755 9.574 1.600 1.00 . A A . 9 SER C 1 1 15 6260 1 1 9 SER CA C -2.948 10.199 0.867 1.00 . A A . 9 SER CA 1 1 15 6261 1 1 9 SER CB C -3.365 11.529 1.502 1.00 . A A . 9 SER CB 1 1 15 6262 1 1 9 SER H H -4.976 9.676 1.158 1.00 . A A . 9 SER H 1 1 15 6263 1 1 9 SER HA H -2.640 10.412 -0.155 1.00 . A A . 9 SER HA 1 1 15 6264 1 1 9 SER HB2 H -3.706 11.365 2.524 1.00 . A A . 9 SER HB2 1 1 15 6265 1 1 9 SER HB3 H -2.515 12.212 1.515 1.00 . A A . 9 SER HB3 1 1 15 6266 1 1 9 SER HG H -4.113 12.244 -0.146 1.00 . A A . 9 SER HG 1 1 15 6267 1 1 9 SER N N -4.101 9.317 0.798 1.00 . A A . 9 SER N 1 1 15 6268 1 1 9 SER O O -0.633 10.048 1.431 1.00 . A A . 9 SER O 1 1 15 6269 1 1 9 SER OG O -4.415 12.109 0.755 1.00 . A A . 9 SER OG 1 1 15 6270 1 1 10 LYS C C -0.180 6.914 2.091 1.00 . A A . 10 LYS C 1 1 15 6271 1 1 10 LYS CA C -0.914 7.810 3.085 1.00 . A A . 10 LYS CA 1 1 15 6272 1 1 10 LYS CB C -1.461 7.017 4.280 1.00 . A A . 10 LYS CB 1 1 15 6273 1 1 10 LYS CD C -1.898 9.029 5.871 1.00 . A A . 10 LYS CD 1 1 15 6274 1 1 10 LYS CE C -1.908 10.302 5.010 1.00 . A A . 10 LYS CE 1 1 15 6275 1 1 10 LYS CG C -2.456 7.784 5.166 1.00 . A A . 10 LYS CG 1 1 15 6276 1 1 10 LYS H H -2.912 8.146 2.488 1.00 . A A . 10 LYS H 1 1 15 6277 1 1 10 LYS HA H -0.186 8.522 3.473 1.00 . A A . 10 LYS HA 1 1 15 6278 1 1 10 LYS HB2 H -1.975 6.126 3.921 1.00 . A A . 10 LYS HB2 1 1 15 6279 1 1 10 LYS HB3 H -0.620 6.688 4.892 1.00 . A A . 10 LYS HB3 1 1 15 6280 1 1 10 LYS HD2 H -2.548 9.213 6.727 1.00 . A A . 10 LYS HD2 1 1 15 6281 1 1 10 LYS HD3 H -0.891 8.831 6.239 1.00 . A A . 10 LYS HD3 1 1 15 6282 1 1 10 LYS HE2 H -1.085 10.303 4.299 1.00 . A A . 10 LYS HE2 1 1 15 6283 1 1 10 LYS HE3 H -2.848 10.370 4.464 1.00 . A A . 10 LYS HE3 1 1 15 6284 1 1 10 LYS HG2 H -3.346 8.051 4.596 1.00 . A A . 10 LYS HG2 1 1 15 6285 1 1 10 LYS HG3 H -2.771 7.088 5.945 1.00 . A A . 10 LYS HG3 1 1 15 6286 1 1 10 LYS HZ1 H -0.897 11.471 6.347 1.00 . A A . 10 LYS HZ1 1 1 15 6287 1 1 10 LYS HZ2 H -1.783 12.327 5.251 1.00 . A A . 10 LYS HZ2 1 1 15 6288 1 1 10 LYS HZ3 H -2.537 11.556 6.498 1.00 . A A . 10 LYS HZ3 1 1 15 6289 1 1 10 LYS N N -1.977 8.518 2.396 1.00 . A A . 10 LYS N 1 1 15 6290 1 1 10 LYS NZ N -1.770 11.508 5.842 1.00 . A A . 10 LYS NZ 1 1 15 6291 1 1 10 LYS O O 0.992 7.149 1.815 1.00 . A A . 10 LYS O 1 1 15 6292 1 1 11 TYR C C 0.140 5.510 -0.687 1.00 . A A . 11 TYR C 1 1 15 6293 1 1 11 TYR CA C -0.225 4.915 0.666 1.00 . A A . 11 TYR CA 1 1 15 6294 1 1 11 TYR CB C -1.084 3.663 0.542 1.00 . A A . 11 TYR CB 1 1 15 6295 1 1 11 TYR CD1 C -2.787 3.988 -1.306 1.00 . A A . 11 TYR CD1 1 1 15 6296 1 1 11 TYR CD2 C -3.577 3.715 0.979 1.00 . A A . 11 TYR CD2 1 1 15 6297 1 1 11 TYR CE1 C -4.115 3.983 -1.764 1.00 . A A . 11 TYR CE1 1 1 15 6298 1 1 11 TYR CE2 C -4.905 3.704 0.520 1.00 . A A . 11 TYR CE2 1 1 15 6299 1 1 11 TYR CG C -2.513 3.856 0.068 1.00 . A A . 11 TYR CG 1 1 15 6300 1 1 11 TYR CZ C -5.175 3.839 -0.852 1.00 . A A . 11 TYR CZ 1 1 15 6301 1 1 11 TYR H H -1.849 5.819 1.689 1.00 . A A . 11 TYR H 1 1 15 6302 1 1 11 TYR HA H 0.714 4.598 1.118 1.00 . A A . 11 TYR HA 1 1 15 6303 1 1 11 TYR HB2 H -0.574 2.994 -0.148 1.00 . A A . 11 TYR HB2 1 1 15 6304 1 1 11 TYR HB3 H -1.095 3.204 1.529 1.00 . A A . 11 TYR HB3 1 1 15 6305 1 1 11 TYR HD1 H -1.979 4.072 -2.018 1.00 . A A . 11 TYR HD1 1 1 15 6306 1 1 11 TYR HD2 H -3.379 3.600 2.035 1.00 . A A . 11 TYR HD2 1 1 15 6307 1 1 11 TYR HE1 H -4.318 4.091 -2.819 1.00 . A A . 11 TYR HE1 1 1 15 6308 1 1 11 TYR HE2 H -5.712 3.590 1.227 1.00 . A A . 11 TYR HE2 1 1 15 6309 1 1 11 TYR HH H -7.119 3.873 -0.601 1.00 . A A . 11 TYR HH 1 1 15 6310 1 1 11 TYR N N -0.853 5.893 1.545 1.00 . A A . 11 TYR N 1 1 15 6311 1 1 11 TYR O O 0.997 4.980 -1.388 1.00 . A A . 11 TYR O 1 1 15 6312 1 1 11 TYR OH O -6.463 3.843 -1.303 1.00 . A A . 11 TYR OH 1 1 15 6313 1 1 12 LEU C C 1.408 7.817 -2.067 1.00 . A A . 12 LEU C 1 1 15 6314 1 1 12 LEU CA C -0.087 7.470 -2.142 1.00 . A A . 12 LEU CA 1 1 15 6315 1 1 12 LEU CB C -0.980 8.710 -2.098 1.00 . A A . 12 LEU CB 1 1 15 6316 1 1 12 LEU CD1 C -0.640 9.405 -4.512 1.00 . A A . 12 LEU CD1 1 1 15 6317 1 1 12 LEU CD2 C -1.513 11.047 -2.840 1.00 . A A . 12 LEU CD2 1 1 15 6318 1 1 12 LEU CG C -0.580 9.849 -3.045 1.00 . A A . 12 LEU CG 1 1 15 6319 1 1 12 LEU H H -1.198 7.007 -0.417 1.00 . A A . 12 LEU H 1 1 15 6320 1 1 12 LEU HA H -0.299 6.894 -3.039 1.00 . A A . 12 LEU HA 1 1 15 6321 1 1 12 LEU HB2 H -1.998 8.381 -2.316 1.00 . A A . 12 LEU HB2 1 1 15 6322 1 1 12 LEU HB3 H -0.942 9.082 -1.075 1.00 . A A . 12 LEU HB3 1 1 15 6323 1 1 12 LEU HD11 H -0.379 10.242 -5.160 1.00 . A A . 12 LEU HD11 1 1 15 6324 1 1 12 LEU HD12 H 0.063 8.594 -4.696 1.00 . A A . 12 LEU HD12 1 1 15 6325 1 1 12 LEU HD13 H -1.647 9.066 -4.755 1.00 . A A . 12 LEU HD13 1 1 15 6326 1 1 12 LEU HD21 H -1.394 11.436 -1.829 1.00 . A A . 12 LEU HD21 1 1 15 6327 1 1 12 LEU HD22 H -1.260 11.838 -3.546 1.00 . A A . 12 LEU HD22 1 1 15 6328 1 1 12 LEU HD23 H -2.549 10.748 -2.993 1.00 . A A . 12 LEU HD23 1 1 15 6329 1 1 12 LEU HG H 0.426 10.183 -2.790 1.00 . A A . 12 LEU HG 1 1 15 6330 1 1 12 LEU N N -0.460 6.654 -1.011 1.00 . A A . 12 LEU N 1 1 15 6331 1 1 12 LEU O O 2.076 7.885 -3.097 1.00 . A A . 12 LEU O 1 1 15 6332 1 1 13 ASP C C 4.207 7.090 -0.993 1.00 . A A . 13 ASP C 1 1 15 6333 1 1 13 ASP CA C 3.341 8.291 -0.614 1.00 . A A . 13 ASP CA 1 1 15 6334 1 1 13 ASP CB C 3.553 8.699 0.847 1.00 . A A . 13 ASP CB 1 1 15 6335 1 1 13 ASP CG C 4.992 9.126 1.125 1.00 . A A . 13 ASP CG 1 1 15 6336 1 1 13 ASP H H 1.337 7.939 -0.035 1.00 . A A . 13 ASP H 1 1 15 6337 1 1 13 ASP HA H 3.627 9.120 -1.263 1.00 . A A . 13 ASP HA 1 1 15 6338 1 1 13 ASP HB2 H 2.877 9.521 1.092 1.00 . A A . 13 ASP HB2 1 1 15 6339 1 1 13 ASP HB3 H 3.318 7.850 1.484 1.00 . A A . 13 ASP HB3 1 1 15 6340 1 1 13 ASP N N 1.932 8.022 -0.849 1.00 . A A . 13 ASP N 1 1 15 6341 1 1 13 ASP O O 3.776 5.940 -0.921 1.00 . A A . 13 ASP O 1 1 15 6342 1 1 13 ASP OD1 O 5.338 10.258 0.725 1.00 . A A . 13 ASP OD1 1 1 15 6343 1 1 13 ASP OD2 O 5.723 8.309 1.728 1.00 . A A . 13 ASP OD2 1 1 15 6344 1 1 14 SER C C 7.408 6.041 -0.955 1.00 . A A . 14 SER C 1 1 15 6345 1 1 14 SER CA C 6.368 6.441 -1.991 1.00 . A A . 14 SER CA 1 1 15 6346 1 1 14 SER CB C 7.032 7.028 -3.230 1.00 . A A . 14 SER CB 1 1 15 6347 1 1 14 SER H H 5.733 8.349 -1.357 1.00 . A A . 14 SER H 1 1 15 6348 1 1 14 SER HA H 5.832 5.552 -2.313 1.00 . A A . 14 SER HA 1 1 15 6349 1 1 14 SER HB2 H 7.597 7.914 -2.943 1.00 . A A . 14 SER HB2 1 1 15 6350 1 1 14 SER HB3 H 7.704 6.273 -3.637 1.00 . A A . 14 SER HB3 1 1 15 6351 1 1 14 SER HG H 5.539 6.596 -4.403 1.00 . A A . 14 SER HG 1 1 15 6352 1 1 14 SER N N 5.431 7.393 -1.432 1.00 . A A . 14 SER N 1 1 15 6353 1 1 14 SER O O 8.482 6.631 -0.859 1.00 . A A . 14 SER O 1 1 15 6354 1 1 14 SER OG O 6.061 7.375 -4.195 1.00 . A A . 14 SER OG 1 1 15 6355 1 1 15 ARG C C 7.180 3.208 1.351 1.00 . A A . 15 ARG C 1 1 15 6356 1 1 15 ARG CA C 7.960 4.357 0.738 1.00 . A A . 15 ARG CA 1 1 15 6357 1 1 15 ARG CB C 8.443 5.370 1.785 1.00 . A A . 15 ARG CB 1 1 15 6358 1 1 15 ARG CD C 10.383 3.870 2.509 1.00 . A A . 15 ARG CD 1 1 15 6359 1 1 15 ARG CG C 9.191 4.723 2.960 1.00 . A A . 15 ARG CG 1 1 15 6360 1 1 15 ARG CZ C 12.055 4.063 4.360 1.00 . A A . 15 ARG CZ 1 1 15 6361 1 1 15 ARG H H 6.155 4.595 -0.335 1.00 . A A . 15 ARG H 1 1 15 6362 1 1 15 ARG HA H 8.817 3.959 0.193 1.00 . A A . 15 ARG HA 1 1 15 6363 1 1 15 ARG HB2 H 9.101 6.090 1.297 1.00 . A A . 15 ARG HB2 1 1 15 6364 1 1 15 ARG HB3 H 7.585 5.911 2.189 1.00 . A A . 15 ARG HB3 1 1 15 6365 1 1 15 ARG HD2 H 10.023 3.001 1.957 1.00 . A A . 15 ARG HD2 1 1 15 6366 1 1 15 ARG HD3 H 11.029 4.450 1.850 1.00 . A A . 15 ARG HD3 1 1 15 6367 1 1 15 ARG HE H 10.968 2.408 3.930 1.00 . A A . 15 ARG HE 1 1 15 6368 1 1 15 ARG HG2 H 9.546 5.526 3.606 1.00 . A A . 15 ARG HG2 1 1 15 6369 1 1 15 ARG HG3 H 8.505 4.102 3.537 1.00 . A A . 15 ARG HG3 1 1 15 6370 1 1 15 ARG HH11 H 11.869 5.797 3.290 1.00 . A A . 15 ARG HH11 1 1 15 6371 1 1 15 ARG HH12 H 13.027 5.844 4.598 1.00 . A A . 15 ARG HH12 1 1 15 6372 1 1 15 ARG HH21 H 12.480 2.516 5.624 1.00 . A A . 15 ARG HH21 1 1 15 6373 1 1 15 ARG HH22 H 13.370 3.991 5.921 1.00 . A A . 15 ARG HH22 1 1 15 6374 1 1 15 ARG N N 7.072 4.998 -0.205 1.00 . A A . 15 ARG N 1 1 15 6375 1 1 15 ARG NE N 11.147 3.364 3.657 1.00 . A A . 15 ARG NE 1 1 15 6376 1 1 15 ARG NH1 N 12.340 5.338 4.056 1.00 . A A . 15 ARG NH1 1 1 15 6377 1 1 15 ARG NH2 N 12.687 3.475 5.386 1.00 . A A . 15 ARG NH2 1 1 15 6378 1 1 15 ARG O O 7.619 2.061 1.311 1.00 . A A . 15 ARG O 1 1 15 6379 1 1 16 ARG C C 4.577 1.594 1.533 1.00 . A A . 16 ARG C 1 1 15 6380 1 1 16 ARG CA C 5.172 2.552 2.562 1.00 . A A . 16 ARG CA 1 1 15 6381 1 1 16 ARG CB C 4.143 3.265 3.439 1.00 . A A . 16 ARG CB 1 1 15 6382 1 1 16 ARG CD C 2.227 4.810 3.696 1.00 . A A . 16 ARG CD 1 1 15 6383 1 1 16 ARG CG C 2.990 3.938 2.697 1.00 . A A . 16 ARG CG 1 1 15 6384 1 1 16 ARG CZ C 3.593 6.681 4.698 1.00 . A A . 16 ARG CZ 1 1 15 6385 1 1 16 ARG H H 5.671 4.486 1.841 1.00 . A A . 16 ARG H 1 1 15 6386 1 1 16 ARG HA H 5.803 1.975 3.240 1.00 . A A . 16 ARG HA 1 1 15 6387 1 1 16 ARG HB2 H 3.712 2.542 4.128 1.00 . A A . 16 ARG HB2 1 1 15 6388 1 1 16 ARG HB3 H 4.675 4.026 4.007 1.00 . A A . 16 ARG HB3 1 1 15 6389 1 1 16 ARG HD2 H 1.201 4.891 3.352 1.00 . A A . 16 ARG HD2 1 1 15 6390 1 1 16 ARG HD3 H 2.212 4.332 4.674 1.00 . A A . 16 ARG HD3 1 1 15 6391 1 1 16 ARG HE H 2.492 6.782 3.006 1.00 . A A . 16 ARG HE 1 1 15 6392 1 1 16 ARG HG2 H 3.350 4.550 1.868 1.00 . A A . 16 ARG HG2 1 1 15 6393 1 1 16 ARG HG3 H 2.321 3.166 2.315 1.00 . A A . 16 ARG HG3 1 1 15 6394 1 1 16 ARG HH11 H 3.691 5.005 5.870 1.00 . A A . 16 ARG HH11 1 1 15 6395 1 1 16 ARG HH12 H 4.601 6.378 6.447 1.00 . A A . 16 ARG HH12 1 1 15 6396 1 1 16 ARG HH21 H 3.727 8.499 3.776 1.00 . A A . 16 ARG HH21 1 1 15 6397 1 1 16 ARG HH22 H 4.625 8.349 5.269 1.00 . A A . 16 ARG HH22 1 1 15 6398 1 1 16 ARG N N 6.006 3.531 1.901 1.00 . A A . 16 ARG N 1 1 15 6399 1 1 16 ARG NE N 2.781 6.169 3.758 1.00 . A A . 16 ARG NE 1 1 15 6400 1 1 16 ARG NH1 N 3.992 5.962 5.758 1.00 . A A . 16 ARG NH1 1 1 15 6401 1 1 16 ARG NH2 N 4.015 7.947 4.571 1.00 . A A . 16 ARG NH2 1 1 15 6402 1 1 16 ARG O O 4.667 0.383 1.703 1.00 . A A . 16 ARG O 1 1 15 6403 1 1 17 ALA C C 4.511 0.498 -1.312 1.00 . A A . 17 ALA C 1 1 15 6404 1 1 17 ALA CA C 3.436 1.329 -0.619 1.00 . A A . 17 ALA CA 1 1 15 6405 1 1 17 ALA CB C 2.709 2.232 -1.610 1.00 . A A . 17 ALA CB 1 1 15 6406 1 1 17 ALA H H 4.003 3.136 0.336 1.00 . A A . 17 ALA H 1 1 15 6407 1 1 17 ALA HA H 2.698 0.649 -0.194 1.00 . A A . 17 ALA HA 1 1 15 6408 1 1 17 ALA HB1 H 2.373 1.645 -2.466 1.00 . A A . 17 ALA HB1 1 1 15 6409 1 1 17 ALA HB2 H 1.844 2.661 -1.111 1.00 . A A . 17 ALA HB2 1 1 15 6410 1 1 17 ALA HB3 H 3.368 3.030 -1.952 1.00 . A A . 17 ALA HB3 1 1 15 6411 1 1 17 ALA N N 4.007 2.132 0.449 1.00 . A A . 17 ALA N 1 1 15 6412 1 1 17 ALA O O 4.279 -0.670 -1.612 1.00 . A A . 17 ALA O 1 1 15 6413 1 1 18 GLN C C 7.210 -0.801 -1.345 1.00 . A A . 18 GLN C 1 1 15 6414 1 1 18 GLN CA C 6.784 0.388 -2.206 1.00 . A A . 18 GLN CA 1 1 15 6415 1 1 18 GLN CB C 7.977 1.318 -2.480 1.00 . A A . 18 GLN CB 1 1 15 6416 1 1 18 GLN CD C 6.566 2.772 -4.067 1.00 . A A . 18 GLN CD 1 1 15 6417 1 1 18 GLN CG C 7.612 2.730 -2.956 1.00 . A A . 18 GLN CG 1 1 15 6418 1 1 18 GLN H H 5.827 2.045 -1.268 1.00 . A A . 18 GLN H 1 1 15 6419 1 1 18 GLN HA H 6.419 0.007 -3.162 1.00 . A A . 18 GLN HA 1 1 15 6420 1 1 18 GLN HB2 H 8.566 1.429 -1.568 1.00 . A A . 18 GLN HB2 1 1 15 6421 1 1 18 GLN HB3 H 8.608 0.844 -3.233 1.00 . A A . 18 GLN HB3 1 1 15 6422 1 1 18 GLN HE21 H 5.258 3.737 -2.846 1.00 . A A . 18 GLN HE21 1 1 15 6423 1 1 18 GLN HE22 H 4.699 3.501 -4.482 1.00 . A A . 18 GLN HE22 1 1 15 6424 1 1 18 GLN HG2 H 7.246 3.291 -2.101 1.00 . A A . 18 GLN HG2 1 1 15 6425 1 1 18 GLN HG3 H 8.518 3.222 -3.312 1.00 . A A . 18 GLN HG3 1 1 15 6426 1 1 18 GLN N N 5.686 1.089 -1.558 1.00 . A A . 18 GLN N 1 1 15 6427 1 1 18 GLN NE2 N 5.412 3.382 -3.778 1.00 . A A . 18 GLN NE2 1 1 15 6428 1 1 18 GLN O O 7.372 -1.902 -1.862 1.00 . A A . 18 GLN O 1 1 15 6429 1 1 18 GLN OE1 O 6.798 2.277 -5.167 1.00 . A A . 18 GLN OE1 1 1 15 6430 1 1 19 ASP C C 6.687 -2.722 0.926 1.00 . A A . 19 ASP C 1 1 15 6431 1 1 19 ASP CA C 7.719 -1.594 0.940 1.00 . A A . 19 ASP CA 1 1 15 6432 1 1 19 ASP CB C 7.844 -0.964 2.333 1.00 . A A . 19 ASP CB 1 1 15 6433 1 1 19 ASP CG C 8.152 -2.013 3.397 1.00 . A A . 19 ASP CG 1 1 15 6434 1 1 19 ASP H H 7.175 0.360 0.314 1.00 . A A . 19 ASP H 1 1 15 6435 1 1 19 ASP HA H 8.692 -2.006 0.672 1.00 . A A . 19 ASP HA 1 1 15 6436 1 1 19 ASP HB2 H 8.648 -0.227 2.321 1.00 . A A . 19 ASP HB2 1 1 15 6437 1 1 19 ASP HB3 H 6.917 -0.457 2.597 1.00 . A A . 19 ASP HB3 1 1 15 6438 1 1 19 ASP N N 7.364 -0.571 -0.034 1.00 . A A . 19 ASP N 1 1 15 6439 1 1 19 ASP O O 7.057 -3.894 0.872 1.00 . A A . 19 ASP O 1 1 15 6440 1 1 19 ASP OD1 O 9.336 -2.405 3.485 1.00 . A A . 19 ASP OD1 1 1 15 6441 1 1 19 ASP OD2 O 7.198 -2.408 4.102 1.00 . A A . 19 ASP OD2 1 1 15 6442 1 1 20 PHE C C 4.406 -4.141 -0.424 1.00 . A A . 20 PHE C 1 1 15 6443 1 1 20 PHE CA C 4.307 -3.325 0.868 1.00 . A A . 20 PHE CA 1 1 15 6444 1 1 20 PHE CB C 2.947 -2.620 0.977 1.00 . A A . 20 PHE CB 1 1 15 6445 1 1 20 PHE CD1 C 3.448 -1.928 3.395 1.00 . A A . 20 PHE CD1 1 1 15 6446 1 1 20 PHE CD2 C 1.742 -0.730 2.139 1.00 . A A . 20 PHE CD2 1 1 15 6447 1 1 20 PHE CE1 C 3.248 -1.063 4.485 1.00 . A A . 20 PHE CE1 1 1 15 6448 1 1 20 PHE CE2 C 1.544 0.135 3.229 1.00 . A A . 20 PHE CE2 1 1 15 6449 1 1 20 PHE CG C 2.704 -1.757 2.208 1.00 . A A . 20 PHE CG 1 1 15 6450 1 1 20 PHE CZ C 2.298 -0.031 4.402 1.00 . A A . 20 PHE CZ 1 1 15 6451 1 1 20 PHE H H 5.159 -1.385 1.029 1.00 . A A . 20 PHE H 1 1 15 6452 1 1 20 PHE HA H 4.394 -4.027 1.698 1.00 . A A . 20 PHE HA 1 1 15 6453 1 1 20 PHE HB2 H 2.823 -1.991 0.095 1.00 . A A . 20 PHE HB2 1 1 15 6454 1 1 20 PHE HB3 H 2.167 -3.382 0.952 1.00 . A A . 20 PHE HB3 1 1 15 6455 1 1 20 PHE HD1 H 4.193 -2.704 3.486 1.00 . A A . 20 PHE HD1 1 1 15 6456 1 1 20 PHE HD2 H 1.159 -0.593 1.240 1.00 . A A . 20 PHE HD2 1 1 15 6457 1 1 20 PHE HE1 H 3.829 -1.191 5.387 1.00 . A A . 20 PHE HE1 1 1 15 6458 1 1 20 PHE HE2 H 0.812 0.926 3.164 1.00 . A A . 20 PHE HE2 1 1 15 6459 1 1 20 PHE HZ H 2.146 0.632 5.241 1.00 . A A . 20 PHE HZ 1 1 15 6460 1 1 20 PHE N N 5.397 -2.366 0.956 1.00 . A A . 20 PHE N 1 1 15 6461 1 1 20 PHE O O 4.111 -5.333 -0.408 1.00 . A A . 20 PHE O 1 1 15 6462 1 1 21 VAL C C 6.180 -5.264 -2.652 1.00 . A A . 21 VAL C 1 1 15 6463 1 1 21 VAL CA C 5.027 -4.265 -2.780 1.00 . A A . 21 VAL CA 1 1 15 6464 1 1 21 VAL CB C 5.158 -3.305 -3.978 1.00 . A A . 21 VAL CB 1 1 15 6465 1 1 21 VAL CG1 C 5.670 -4.016 -5.237 1.00 . A A . 21 VAL CG1 1 1 15 6466 1 1 21 VAL CG2 C 3.793 -2.683 -4.300 1.00 . A A . 21 VAL CG2 1 1 15 6467 1 1 21 VAL H H 5.062 -2.542 -1.518 1.00 . A A . 21 VAL H 1 1 15 6468 1 1 21 VAL HA H 4.138 -4.873 -2.937 1.00 . A A . 21 VAL HA 1 1 15 6469 1 1 21 VAL HB H 5.857 -2.505 -3.740 1.00 . A A . 21 VAL HB 1 1 15 6470 1 1 21 VAL HG11 H 5.642 -3.330 -6.084 1.00 . A A . 21 VAL HG11 1 1 15 6471 1 1 21 VAL HG12 H 6.702 -4.336 -5.095 1.00 . A A . 21 VAL HG12 1 1 15 6472 1 1 21 VAL HG13 H 5.048 -4.883 -5.459 1.00 . A A . 21 VAL HG13 1 1 15 6473 1 1 21 VAL HG21 H 3.369 -2.206 -3.419 1.00 . A A . 21 VAL HG21 1 1 15 6474 1 1 21 VAL HG22 H 3.906 -1.933 -5.084 1.00 . A A . 21 VAL HG22 1 1 15 6475 1 1 21 VAL HG23 H 3.104 -3.455 -4.644 1.00 . A A . 21 VAL HG23 1 1 15 6476 1 1 21 VAL N N 4.833 -3.530 -1.537 1.00 . A A . 21 VAL N 1 1 15 6477 1 1 21 VAL O O 6.028 -6.407 -3.079 1.00 . A A . 21 VAL O 1 1 15 6478 1 1 22 GLN C C 7.952 -6.990 -0.988 1.00 . A A . 22 GLN C 1 1 15 6479 1 1 22 GLN CA C 8.415 -5.805 -1.832 1.00 . A A . 22 GLN CA 1 1 15 6480 1 1 22 GLN CB C 9.612 -5.151 -1.127 1.00 . A A . 22 GLN CB 1 1 15 6481 1 1 22 GLN CD C 10.115 -3.813 -3.240 1.00 . A A . 22 GLN CD 1 1 15 6482 1 1 22 GLN CG C 10.064 -3.815 -1.713 1.00 . A A . 22 GLN CG 1 1 15 6483 1 1 22 GLN H H 7.398 -3.921 -1.715 1.00 . A A . 22 GLN H 1 1 15 6484 1 1 22 GLN HA H 8.749 -6.179 -2.801 1.00 . A A . 22 GLN HA 1 1 15 6485 1 1 22 GLN HB2 H 9.377 -4.989 -0.074 1.00 . A A . 22 GLN HB2 1 1 15 6486 1 1 22 GLN HB3 H 10.448 -5.849 -1.181 1.00 . A A . 22 GLN HB3 1 1 15 6487 1 1 22 GLN HE21 H 8.464 -2.624 -3.347 1.00 . A A . 22 GLN HE21 1 1 15 6488 1 1 22 GLN HE22 H 9.167 -3.088 -4.887 1.00 . A A . 22 GLN HE22 1 1 15 6489 1 1 22 GLN HG2 H 9.392 -3.045 -1.352 1.00 . A A . 22 GLN HG2 1 1 15 6490 1 1 22 GLN HG3 H 11.054 -3.597 -1.318 1.00 . A A . 22 GLN HG3 1 1 15 6491 1 1 22 GLN N N 7.313 -4.871 -2.054 1.00 . A A . 22 GLN N 1 1 15 6492 1 1 22 GLN NE2 N 9.173 -3.115 -3.878 1.00 . A A . 22 GLN NE2 1 1 15 6493 1 1 22 GLN O O 8.348 -8.125 -1.239 1.00 . A A . 22 GLN O 1 1 15 6494 1 1 22 GLN OE1 O 10.993 -4.432 -3.834 1.00 . A A . 22 GLN OE1 1 1 15 6495 1 1 23 TRP C C 5.768 -8.725 0.202 1.00 . A A . 23 TRP C 1 1 15 6496 1 1 23 TRP CA C 6.653 -7.731 0.945 1.00 . A A . 23 TRP CA 1 1 15 6497 1 1 23 TRP CB C 5.888 -7.065 2.089 1.00 . A A . 23 TRP CB 1 1 15 6498 1 1 23 TRP CD1 C 5.411 -8.996 3.634 1.00 . A A . 23 TRP CD1 1 1 15 6499 1 1 23 TRP CD2 C 3.570 -8.206 2.648 1.00 . A A . 23 TRP CD2 1 1 15 6500 1 1 23 TRP CE2 C 3.164 -9.305 3.456 1.00 . A A . 23 TRP CE2 1 1 15 6501 1 1 23 TRP CE3 C 2.594 -7.600 1.836 1.00 . A A . 23 TRP CE3 1 1 15 6502 1 1 23 TRP CG C 4.997 -8.007 2.821 1.00 . A A . 23 TRP CG 1 1 15 6503 1 1 23 TRP CH2 C 0.876 -9.102 2.700 1.00 . A A . 23 TRP CH2 1 1 15 6504 1 1 23 TRP CZ2 C 1.835 -9.749 3.495 1.00 . A A . 23 TRP CZ2 1 1 15 6505 1 1 23 TRP CZ3 C 1.256 -8.035 1.865 1.00 . A A . 23 TRP CZ3 1 1 15 6506 1 1 23 TRP H H 6.714 -5.791 0.099 1.00 . A A . 23 TRP H 1 1 15 6507 1 1 23 TRP HA H 7.510 -8.262 1.363 1.00 . A A . 23 TRP HA 1 1 15 6508 1 1 23 TRP HB2 H 6.594 -6.612 2.785 1.00 . A A . 23 TRP HB2 1 1 15 6509 1 1 23 TRP HB3 H 5.257 -6.273 1.690 1.00 . A A . 23 TRP HB3 1 1 15 6510 1 1 23 TRP HD1 H 6.451 -9.171 3.853 1.00 . A A . 23 TRP HD1 1 1 15 6511 1 1 23 TRP HE1 H 4.356 -10.539 4.675 1.00 . A A . 23 TRP HE1 1 1 15 6512 1 1 23 TRP HE3 H 2.916 -6.814 1.167 1.00 . A A . 23 TRP HE3 1 1 15 6513 1 1 23 TRP HH2 H -0.149 -9.436 2.726 1.00 . A A . 23 TRP HH2 1 1 15 6514 1 1 23 TRP HZ2 H 1.555 -10.586 4.118 1.00 . A A . 23 TRP HZ2 1 1 15 6515 1 1 23 TRP HZ3 H 0.520 -7.553 1.238 1.00 . A A . 23 TRP HZ3 1 1 15 6516 1 1 23 TRP N N 7.111 -6.720 0.016 1.00 . A A . 23 TRP N 1 1 15 6517 1 1 23 TRP NE1 N 4.328 -9.745 4.053 1.00 . A A . 23 TRP NE1 1 1 15 6518 1 1 23 TRP O O 6.014 -9.927 0.245 1.00 . A A . 23 TRP O 1 1 15 6519 1 1 24 LEU C C 4.523 -9.852 -2.266 1.00 . A A . 24 LEU C 1 1 15 6520 1 1 24 LEU CA C 3.794 -8.925 -1.292 1.00 . A A . 24 LEU CA 1 1 15 6521 1 1 24 LEU CB C 2.923 -7.903 -2.033 1.00 . A A . 24 LEU CB 1 1 15 6522 1 1 24 LEU CD1 C 0.856 -9.385 -2.148 1.00 . A A . 24 LEU CD1 1 1 15 6523 1 1 24 LEU CD2 C 1.090 -7.398 -3.651 1.00 . A A . 24 LEU CD2 1 1 15 6524 1 1 24 LEU CG C 1.848 -8.524 -2.940 1.00 . A A . 24 LEU CG 1 1 15 6525 1 1 24 LEU H H 4.619 -7.193 -0.404 1.00 . A A . 24 LEU H 1 1 15 6526 1 1 24 LEU HA H 3.164 -9.512 -0.625 1.00 . A A . 24 LEU HA 1 1 15 6527 1 1 24 LEU HB2 H 2.438 -7.264 -1.295 1.00 . A A . 24 LEU HB2 1 1 15 6528 1 1 24 LEU HB3 H 3.576 -7.278 -2.643 1.00 . A A . 24 LEU HB3 1 1 15 6529 1 1 24 LEU HD11 H 1.353 -10.267 -1.745 1.00 . A A . 24 LEU HD11 1 1 15 6530 1 1 24 LEU HD12 H 0.428 -8.806 -1.329 1.00 . A A . 24 LEU HD12 1 1 15 6531 1 1 24 LEU HD13 H 0.053 -9.717 -2.806 1.00 . A A . 24 LEU HD13 1 1 15 6532 1 1 24 LEU HD21 H 0.590 -6.762 -2.919 1.00 . A A . 24 LEU HD21 1 1 15 6533 1 1 24 LEU HD22 H 1.786 -6.794 -4.234 1.00 . A A . 24 LEU HD22 1 1 15 6534 1 1 24 LEU HD23 H 0.344 -7.822 -4.324 1.00 . A A . 24 LEU HD23 1 1 15 6535 1 1 24 LEU HG H 2.322 -9.143 -3.703 1.00 . A A . 24 LEU HG 1 1 15 6536 1 1 24 LEU N N 4.744 -8.193 -0.472 1.00 . A A . 24 LEU N 1 1 15 6537 1 1 24 LEU O O 4.120 -10.999 -2.454 1.00 . A A . 24 LEU O 1 1 15 6538 1 1 25 MET C C 7.129 -11.263 -3.098 1.00 . A A . 25 MET C 1 1 15 6539 1 1 25 MET CA C 6.426 -10.103 -3.807 1.00 . A A . 25 MET CA 1 1 15 6540 1 1 25 MET CB C 7.442 -9.182 -4.493 1.00 . A A . 25 MET CB 1 1 15 6541 1 1 25 MET CE C 9.200 -7.834 -6.865 1.00 . A A . 25 MET CE 1 1 15 6542 1 1 25 MET CG C 6.779 -8.301 -5.557 1.00 . A A . 25 MET CG 1 1 15 6543 1 1 25 MET H H 5.875 -8.401 -2.625 1.00 . A A . 25 MET H 1 1 15 6544 1 1 25 MET HA H 5.778 -10.524 -4.577 1.00 . A A . 25 MET HA 1 1 15 6545 1 1 25 MET HB2 H 7.932 -8.553 -3.750 1.00 . A A . 25 MET HB2 1 1 15 6546 1 1 25 MET HB3 H 8.200 -9.795 -4.981 1.00 . A A . 25 MET HB3 1 1 15 6547 1 1 25 MET HE1 H 9.743 -8.361 -6.081 1.00 . A A . 25 MET HE1 1 1 15 6548 1 1 25 MET HE2 H 8.835 -8.549 -7.603 1.00 . A A . 25 MET HE2 1 1 15 6549 1 1 25 MET HE3 H 9.873 -7.128 -7.350 1.00 . A A . 25 MET HE3 1 1 15 6550 1 1 25 MET HG2 H 6.506 -8.925 -6.409 1.00 . A A . 25 MET HG2 1 1 15 6551 1 1 25 MET HG3 H 5.863 -7.872 -5.153 1.00 . A A . 25 MET HG3 1 1 15 6552 1 1 25 MET N N 5.604 -9.347 -2.870 1.00 . A A . 25 MET N 1 1 15 6553 1 1 25 MET O O 7.047 -12.398 -3.561 1.00 . A A . 25 MET O 1 1 15 6554 1 1 25 MET SD S 7.804 -6.927 -6.149 1.00 . A A . 25 MET SD 1 1 15 6555 1 1 26 ASN C C 7.653 -13.100 -0.715 1.00 . A A . 26 ASN C 1 1 15 6556 1 1 26 ASN CA C 8.565 -11.984 -1.233 1.00 . A A . 26 ASN CA 1 1 15 6557 1 1 26 ASN CB C 9.348 -11.333 -0.083 1.00 . A A . 26 ASN CB 1 1 15 6558 1 1 26 ASN CG C 10.707 -10.805 -0.542 1.00 . A A . 26 ASN CG 1 1 15 6559 1 1 26 ASN H H 7.832 -10.026 -1.647 1.00 . A A . 26 ASN H 1 1 15 6560 1 1 26 ASN HA H 9.286 -12.449 -1.909 1.00 . A A . 26 ASN HA 1 1 15 6561 1 1 26 ASN HB2 H 8.765 -10.532 0.373 1.00 . A A . 26 ASN HB2 1 1 15 6562 1 1 26 ASN HB3 H 9.537 -12.089 0.681 1.00 . A A . 26 ASN HB3 1 1 15 6563 1 1 26 ASN HD21 H 9.857 -9.233 -1.519 1.00 . A A . 26 ASN HD21 1 1 15 6564 1 1 26 ASN HD22 H 11.604 -9.329 -1.612 1.00 . A A . 26 ASN HD22 1 1 15 6565 1 1 26 ASN N N 7.818 -10.981 -1.984 1.00 . A A . 26 ASN N 1 1 15 6566 1 1 26 ASN ND2 N 10.723 -9.701 -1.288 1.00 . A A . 26 ASN ND2 1 1 15 6567 1 1 26 ASN O O 7.961 -14.275 -0.908 1.00 . A A . 26 ASN O 1 1 15 6568 1 1 26 ASN OD1 O 11.739 -11.392 -0.224 1.00 . A A . 26 ASN OD1 1 1 15 6569 1 1 27 THR C C 4.887 -14.496 -0.572 1.00 . A A . 27 THR C 1 1 15 6570 1 1 27 THR CA C 5.627 -13.724 0.522 1.00 . A A . 27 THR CA 1 1 15 6571 1 1 27 THR CB C 4.674 -13.048 1.523 1.00 . A A . 27 THR CB 1 1 15 6572 1 1 27 THR CG2 C 3.562 -12.219 0.875 1.00 . A A . 27 THR CG2 1 1 15 6573 1 1 27 THR H H 6.331 -11.766 0.061 1.00 . A A . 27 THR H 1 1 15 6574 1 1 27 THR HA H 6.229 -14.438 1.088 1.00 . A A . 27 THR HA 1 1 15 6575 1 1 27 THR HB H 5.268 -12.385 2.147 1.00 . A A . 27 THR HB 1 1 15 6576 1 1 27 THR HG1 H 4.772 -14.510 2.805 1.00 . A A . 27 THR HG1 1 1 15 6577 1 1 27 THR HG21 H 3.031 -11.663 1.646 1.00 . A A . 27 THR HG21 1 1 15 6578 1 1 27 THR HG22 H 3.991 -11.518 0.166 1.00 . A A . 27 THR HG22 1 1 15 6579 1 1 27 THR HG23 H 2.849 -12.864 0.361 1.00 . A A . 27 THR HG23 1 1 15 6580 1 1 27 THR N N 6.543 -12.747 -0.055 1.00 . A A . 27 THR N 1 1 15 6581 1 1 27 THR O O 4.708 -15.707 -0.464 1.00 . A A . 27 THR O 1 1 15 6582 1 1 27 THR OG1 O 4.079 -14.019 2.357 1.00 . A A . 27 THR OG1 1 1 15 6583 1 1 28 NH2 HN1 H 4.617 -12.809 -1.700 1.00 . A A . 28 NH2 HN1 1 1 15 6584 1 1 28 NH2 HN2 H 3.950 -14.284 -2.356 1.00 . A A . 28 NH2 HN2 1 1 15 6585 1 1 28 NH2 N N 4.455 -13.805 -1.630 1.00 . A A . 28 NH2 N 1 1 16 6586 1 1 1 SER C C -11.748 -0.461 -2.452 1.00 . A A . 1 SER C 1 1 16 6587 1 1 1 SER CA C -12.293 0.360 -3.620 1.00 . A A . 1 SER CA 1 1 16 6588 1 1 1 SER CB C -13.783 0.075 -3.835 1.00 . A A . 1 SER CB 1 1 16 6589 1 1 1 SER H1 H -10.549 0.359 -4.691 1.00 . A A . 1 SER H1 1 1 16 6590 1 1 1 SER H2 H -11.596 -0.837 -5.129 1.00 . A A . 1 SER H2 1 1 16 6591 1 1 1 SER H3 H -11.883 0.721 -5.591 1.00 . A A . 1 SER H3 1 1 16 6592 1 1 1 SER HA H -12.191 1.416 -3.367 1.00 . A A . 1 SER HA 1 1 16 6593 1 1 1 SER HB2 H -13.932 -0.964 -4.130 1.00 . A A . 1 SER HB2 1 1 16 6594 1 1 1 SER HB3 H -14.323 0.260 -2.904 1.00 . A A . 1 SER HB3 1 1 16 6595 1 1 1 SER HG H -13.882 0.720 -5.671 1.00 . A A . 1 SER HG 1 1 16 6596 1 1 1 SER N N -11.519 0.132 -4.855 1.00 . A A . 1 SER N 1 1 16 6597 1 1 1 SER O O -11.449 0.099 -1.399 1.00 . A A . 1 SER O 1 1 16 6598 1 1 1 SER OG O -14.307 0.924 -4.834 1.00 . A A . 1 SER OG 1 1 16 6599 1 1 2 GLN C C -11.896 -2.616 -0.328 1.00 . A A . 2 GLN C 1 1 16 6600 1 1 2 GLN CA C -11.114 -2.722 -1.647 1.00 . A A . 2 GLN CA 1 1 16 6601 1 1 2 GLN CB C -9.609 -2.477 -1.454 1.00 . A A . 2 GLN CB 1 1 16 6602 1 1 2 GLN CD C -7.454 -3.352 -0.487 1.00 . A A . 2 GLN CD 1 1 16 6603 1 1 2 GLN CG C -8.881 -3.705 -0.895 1.00 . A A . 2 GLN CG 1 1 16 6604 1 1 2 GLN H H -11.896 -2.168 -3.536 1.00 . A A . 2 GLN H 1 1 16 6605 1 1 2 GLN HA H -11.255 -3.726 -2.048 1.00 . A A . 2 GLN HA 1 1 16 6606 1 1 2 GLN HB2 H -9.152 -2.232 -2.414 1.00 . A A . 2 GLN HB2 1 1 16 6607 1 1 2 GLN HB3 H -9.470 -1.630 -0.781 1.00 . A A . 2 GLN HB3 1 1 16 6608 1 1 2 GLN HE21 H -8.114 -2.410 1.196 1.00 . A A . 2 GLN HE21 1 1 16 6609 1 1 2 GLN HE22 H -6.372 -2.447 0.969 1.00 . A A . 2 GLN HE22 1 1 16 6610 1 1 2 GLN HG2 H -9.399 -4.103 -0.024 1.00 . A A . 2 GLN HG2 1 1 16 6611 1 1 2 GLN HG3 H -8.856 -4.482 -1.661 1.00 . A A . 2 GLN HG3 1 1 16 6612 1 1 2 GLN N N -11.628 -1.783 -2.641 1.00 . A A . 2 GLN N 1 1 16 6613 1 1 2 GLN NE2 N -7.306 -2.672 0.650 1.00 . A A . 2 GLN NE2 1 1 16 6614 1 1 2 GLN O O -11.316 -2.698 0.754 1.00 . A A . 2 GLN O 1 1 16 6615 1 1 2 GLN OE1 O -6.501 -3.689 -1.185 1.00 . A A . 2 GLN OE1 1 1 16 6616 1 1 3 GLY C C -13.821 -0.691 1.214 1.00 . A A . 3 GLY C 1 1 16 6617 1 1 3 GLY CA C -14.063 -2.119 0.726 1.00 . A A . 3 GLY CA 1 1 16 6618 1 1 3 GLY H H -13.635 -2.346 -1.336 1.00 . A A . 3 GLY H 1 1 16 6619 1 1 3 GLY HA2 H -15.104 -2.226 0.423 1.00 . A A . 3 GLY HA2 1 1 16 6620 1 1 3 GLY HA3 H -13.861 -2.828 1.530 1.00 . A A . 3 GLY HA3 1 1 16 6621 1 1 3 GLY N N -13.214 -2.395 -0.421 1.00 . A A . 3 GLY N 1 1 16 6622 1 1 3 GLY O O -14.652 0.188 0.990 1.00 . A A . 3 GLY O 1 1 16 6623 1 1 4 THR C C -11.147 1.362 1.495 1.00 . A A . 4 THR C 1 1 16 6624 1 1 4 THR CA C -12.249 0.814 2.400 1.00 . A A . 4 THR CA 1 1 16 6625 1 1 4 THR CB C -11.757 0.623 3.842 1.00 . A A . 4 THR CB 1 1 16 6626 1 1 4 THR CG2 C -11.339 1.954 4.474 1.00 . A A . 4 THR CG2 1 1 16 6627 1 1 4 THR H H -12.032 -1.244 1.982 1.00 . A A . 4 THR H 1 1 16 6628 1 1 4 THR HA H -13.086 1.514 2.423 1.00 . A A . 4 THR HA 1 1 16 6629 1 1 4 THR HB H -10.907 -0.059 3.849 1.00 . A A . 4 THR HB 1 1 16 6630 1 1 4 THR HG1 H -12.461 -0.096 5.508 1.00 . A A . 4 THR HG1 1 1 16 6631 1 1 4 THR HG21 H -12.176 2.653 4.463 1.00 . A A . 4 THR HG21 1 1 16 6632 1 1 4 THR HG22 H -11.027 1.788 5.505 1.00 . A A . 4 THR HG22 1 1 16 6633 1 1 4 THR HG23 H -10.505 2.386 3.924 1.00 . A A . 4 THR HG23 1 1 16 6634 1 1 4 THR N N -12.676 -0.471 1.872 1.00 . A A . 4 THR N 1 1 16 6635 1 1 4 THR O O -10.038 0.830 1.481 1.00 . A A . 4 THR O 1 1 16 6636 1 1 4 THR OG1 O -12.791 0.056 4.619 1.00 . A A . 4 THR OG1 1 1 16 6637 1 1 5 THR C C -9.249 3.522 0.587 1.00 . A A . 5 THR C 1 1 16 6638 1 1 5 THR CA C -10.509 3.080 -0.158 1.00 . A A . 5 THR CA 1 1 16 6639 1 1 5 THR CB C -11.213 4.263 -0.838 1.00 . A A . 5 THR CB 1 1 16 6640 1 1 5 THR CG2 C -10.349 4.894 -1.934 1.00 . A A . 5 THR CG2 1 1 16 6641 1 1 5 THR H H -12.387 2.801 0.779 1.00 . A A . 5 THR H 1 1 16 6642 1 1 5 THR HA H -10.214 2.357 -0.915 1.00 . A A . 5 THR HA 1 1 16 6643 1 1 5 THR HB H -11.446 5.025 -0.092 1.00 . A A . 5 THR HB 1 1 16 6644 1 1 5 THR HG1 H -12.230 3.145 -2.063 1.00 . A A . 5 THR HG1 1 1 16 6645 1 1 5 THR HG21 H -10.119 4.150 -2.695 1.00 . A A . 5 THR HG21 1 1 16 6646 1 1 5 THR HG22 H -10.895 5.716 -2.396 1.00 . A A . 5 THR HG22 1 1 16 6647 1 1 5 THR HG23 H -9.421 5.281 -1.515 1.00 . A A . 5 THR HG23 1 1 16 6648 1 1 5 THR N N -11.449 2.426 0.744 1.00 . A A . 5 THR N 1 1 16 6649 1 1 5 THR O O -8.134 3.290 0.119 1.00 . A A . 5 THR O 1 1 16 6650 1 1 5 THR OG1 O -12.427 3.820 -1.409 1.00 . A A . 5 THR OG1 1 1 16 6651 1 1 6 SER C C -7.366 3.542 2.994 1.00 . A A . 6 SER C 1 1 16 6652 1 1 6 SER CA C -8.376 4.631 2.619 1.00 . A A . 6 SER CA 1 1 16 6653 1 1 6 SER CB C -8.990 5.249 3.879 1.00 . A A . 6 SER CB 1 1 16 6654 1 1 6 SER H H -10.387 4.309 2.068 1.00 . A A . 6 SER H 1 1 16 6655 1 1 6 SER HA H -7.851 5.424 2.085 1.00 . A A . 6 SER HA 1 1 16 6656 1 1 6 SER HB2 H -9.447 4.473 4.493 1.00 . A A . 6 SER HB2 1 1 16 6657 1 1 6 SER HB3 H -8.211 5.744 4.461 1.00 . A A . 6 SER HB3 1 1 16 6658 1 1 6 SER HG H -9.571 6.885 2.998 1.00 . A A . 6 SER HG 1 1 16 6659 1 1 6 SER N N -9.440 4.145 1.755 1.00 . A A . 6 SER N 1 1 16 6660 1 1 6 SER O O -6.220 3.872 3.289 1.00 . A A . 6 SER O 1 1 16 6661 1 1 6 SER OG O -9.980 6.193 3.524 1.00 . A A . 6 SER OG 1 1 16 6662 1 1 7 GLU C C -5.709 1.083 2.387 1.00 . A A . 7 GLU C 1 1 16 6663 1 1 7 GLU CA C -6.899 1.154 3.346 1.00 . A A . 7 GLU CA 1 1 16 6664 1 1 7 GLU CB C -7.699 -0.157 3.372 1.00 . A A . 7 GLU CB 1 1 16 6665 1 1 7 GLU CD C -6.337 -1.190 5.248 1.00 . A A . 7 GLU CD 1 1 16 6666 1 1 7 GLU CG C -6.861 -1.359 3.824 1.00 . A A . 7 GLU CG 1 1 16 6667 1 1 7 GLU H H -8.714 2.040 2.703 1.00 . A A . 7 GLU H 1 1 16 6668 1 1 7 GLU HA H -6.531 1.345 4.354 1.00 . A A . 7 GLU HA 1 1 16 6669 1 1 7 GLU HB2 H -8.541 -0.044 4.056 1.00 . A A . 7 GLU HB2 1 1 16 6670 1 1 7 GLU HB3 H -8.085 -0.371 2.376 1.00 . A A . 7 GLU HB3 1 1 16 6671 1 1 7 GLU HG2 H -7.485 -2.253 3.786 1.00 . A A . 7 GLU HG2 1 1 16 6672 1 1 7 GLU HG3 H -6.026 -1.501 3.141 1.00 . A A . 7 GLU HG3 1 1 16 6673 1 1 7 GLU N N -7.770 2.263 2.987 1.00 . A A . 7 GLU N 1 1 16 6674 1 1 7 GLU O O -4.564 1.211 2.818 1.00 . A A . 7 GLU O 1 1 16 6675 1 1 7 GLU OE1 O -7.144 -1.397 6.179 1.00 . A A . 7 GLU OE1 1 1 16 6676 1 1 7 GLU OE2 O -5.139 -0.856 5.380 1.00 . A A . 7 GLU OE2 1 1 16 6677 1 1 8 TYR C C -4.225 2.097 -0.176 1.00 . A A . 8 TYR C 1 1 16 6678 1 1 8 TYR CA C -4.926 0.769 0.091 1.00 . A A . 8 TYR CA 1 1 16 6679 1 1 8 TYR CB C -5.447 0.135 -1.202 1.00 . A A . 8 TYR CB 1 1 16 6680 1 1 8 TYR CD1 C -5.769 1.923 -2.970 1.00 . A A . 8 TYR CD1 1 1 16 6681 1 1 8 TYR CD2 C -7.734 0.867 -1.999 1.00 . A A . 8 TYR CD2 1 1 16 6682 1 1 8 TYR CE1 C -6.592 2.642 -3.853 1.00 . A A . 8 TYR CE1 1 1 16 6683 1 1 8 TYR CE2 C -8.550 1.545 -2.920 1.00 . A A . 8 TYR CE2 1 1 16 6684 1 1 8 TYR CG C -6.338 1.020 -2.051 1.00 . A A . 8 TYR CG 1 1 16 6685 1 1 8 TYR CZ C -7.980 2.430 -3.848 1.00 . A A . 8 TYR CZ 1 1 16 6686 1 1 8 TYR H H -6.938 0.816 0.785 1.00 . A A . 8 TYR H 1 1 16 6687 1 1 8 TYR HA H -4.175 0.091 0.488 1.00 . A A . 8 TYR HA 1 1 16 6688 1 1 8 TYR HB2 H -4.583 -0.146 -1.807 1.00 . A A . 8 TYR HB2 1 1 16 6689 1 1 8 TYR HB3 H -5.976 -0.784 -0.954 1.00 . A A . 8 TYR HB3 1 1 16 6690 1 1 8 TYR HD1 H -4.697 2.063 -3.005 1.00 . A A . 8 TYR HD1 1 1 16 6691 1 1 8 TYR HD2 H -8.175 0.221 -1.257 1.00 . A A . 8 TYR HD2 1 1 16 6692 1 1 8 TYR HE1 H -6.156 3.346 -4.545 1.00 . A A . 8 TYR HE1 1 1 16 6693 1 1 8 TYR HE2 H -9.616 1.388 -2.915 1.00 . A A . 8 TYR HE2 1 1 16 6694 1 1 8 TYR HH H -8.291 3.663 -5.332 1.00 . A A . 8 TYR HH 1 1 16 6695 1 1 8 TYR N N -5.978 0.887 1.090 1.00 . A A . 8 TYR N 1 1 16 6696 1 1 8 TYR O O -3.066 2.082 -0.580 1.00 . A A . 8 TYR O 1 1 16 6697 1 1 8 TYR OH O -8.778 3.080 -4.745 1.00 . A A . 8 TYR OH 1 1 16 6698 1 1 9 SER C C -3.003 4.712 0.616 1.00 . A A . 9 SER C 1 1 16 6699 1 1 9 SER CA C -4.336 4.564 -0.125 1.00 . A A . 9 SER CA 1 1 16 6700 1 1 9 SER CB C -5.327 5.637 0.333 1.00 . A A . 9 SER CB 1 1 16 6701 1 1 9 SER H H -5.871 3.170 0.351 1.00 . A A . 9 SER H 1 1 16 6702 1 1 9 SER HA H -4.160 4.719 -1.189 1.00 . A A . 9 SER HA 1 1 16 6703 1 1 9 SER HB2 H -5.548 5.513 1.392 1.00 . A A . 9 SER HB2 1 1 16 6704 1 1 9 SER HB3 H -4.882 6.621 0.183 1.00 . A A . 9 SER HB3 1 1 16 6705 1 1 9 SER HG H -6.923 4.705 -0.291 1.00 . A A . 9 SER HG 1 1 16 6706 1 1 9 SER N N -4.908 3.231 0.047 1.00 . A A . 9 SER N 1 1 16 6707 1 1 9 SER O O -2.114 5.421 0.145 1.00 . A A . 9 SER O 1 1 16 6708 1 1 9 SER OG O -6.519 5.567 -0.421 1.00 . A A . 9 SER OG 1 1 16 6709 1 1 10 LYS C C -0.551 3.297 1.654 1.00 . A A . 10 LYS C 1 1 16 6710 1 1 10 LYS CA C -1.613 3.991 2.502 1.00 . A A . 10 LYS CA 1 1 16 6711 1 1 10 LYS CB C -1.827 3.311 3.859 1.00 . A A . 10 LYS CB 1 1 16 6712 1 1 10 LYS CD C -2.810 5.418 5.028 1.00 . A A . 10 LYS CD 1 1 16 6713 1 1 10 LYS CE C -3.418 6.365 3.981 1.00 . A A . 10 LYS CE 1 1 16 6714 1 1 10 LYS CG C -2.958 3.922 4.701 1.00 . A A . 10 LYS CG 1 1 16 6715 1 1 10 LYS H H -3.609 3.466 2.118 1.00 . A A . 10 LYS H 1 1 16 6716 1 1 10 LYS HA H -1.263 5.004 2.681 1.00 . A A . 10 LYS HA 1 1 16 6717 1 1 10 LYS HB2 H -2.060 2.257 3.699 1.00 . A A . 10 LYS HB2 1 1 16 6718 1 1 10 LYS HB3 H -0.904 3.370 4.433 1.00 . A A . 10 LYS HB3 1 1 16 6719 1 1 10 LYS HD2 H -3.347 5.591 5.962 1.00 . A A . 10 LYS HD2 1 1 16 6720 1 1 10 LYS HD3 H -1.760 5.660 5.194 1.00 . A A . 10 LYS HD3 1 1 16 6721 1 1 10 LYS HE2 H -2.837 6.384 3.062 1.00 . A A . 10 LYS HE2 1 1 16 6722 1 1 10 LYS HE3 H -4.433 6.049 3.740 1.00 . A A . 10 LYS HE3 1 1 16 6723 1 1 10 LYS HG2 H -3.920 3.741 4.227 1.00 . A A . 10 LYS HG2 1 1 16 6724 1 1 10 LYS HG3 H -2.960 3.380 5.648 1.00 . A A . 10 LYS HG3 1 1 16 6725 1 1 10 LYS HZ1 H -3.875 8.347 3.781 1.00 . A A . 10 LYS HZ1 1 1 16 6726 1 1 10 LYS HZ2 H -4.028 7.783 5.323 1.00 . A A . 10 LYS HZ2 1 1 16 6727 1 1 10 LYS HZ3 H -2.530 8.063 4.691 1.00 . A A . 10 LYS HZ3 1 1 16 6728 1 1 10 LYS N N -2.857 4.035 1.763 1.00 . A A . 10 LYS N 1 1 16 6729 1 1 10 LYS NZ N -3.467 7.748 4.483 1.00 . A A . 10 LYS NZ 1 1 16 6730 1 1 10 LYS O O 0.440 3.928 1.298 1.00 . A A . 10 LYS O 1 1 16 6731 1 1 11 TYR C C -0.025 1.496 -0.977 1.00 . A A . 11 TYR C 1 1 16 6732 1 1 11 TYR CA C 0.197 1.251 0.513 1.00 . A A . 11 TYR CA 1 1 16 6733 1 1 11 TYR CB C 0.153 -0.223 0.923 1.00 . A A . 11 TYR CB 1 1 16 6734 1 1 11 TYR CD1 C -1.766 -1.575 -0.055 1.00 . A A . 11 TYR CD1 1 1 16 6735 1 1 11 TYR CD2 C -1.852 -0.927 2.289 1.00 . A A . 11 TYR CD2 1 1 16 6736 1 1 11 TYR CE1 C -2.938 -2.334 0.113 1.00 . A A . 11 TYR CE1 1 1 16 6737 1 1 11 TYR CE2 C -3.010 -1.703 2.462 1.00 . A A . 11 TYR CE2 1 1 16 6738 1 1 11 TYR CG C -1.215 -0.874 1.035 1.00 . A A . 11 TYR CG 1 1 16 6739 1 1 11 TYR CZ C -3.537 -2.428 1.381 1.00 . A A . 11 TYR CZ 1 1 16 6740 1 1 11 TYR H H -1.668 1.615 1.397 1.00 . A A . 11 TYR H 1 1 16 6741 1 1 11 TYR HA H 1.201 1.602 0.752 1.00 . A A . 11 TYR HA 1 1 16 6742 1 1 11 TYR HB2 H 0.764 -0.781 0.219 1.00 . A A . 11 TYR HB2 1 1 16 6743 1 1 11 TYR HB3 H 0.633 -0.284 1.900 1.00 . A A . 11 TYR HB3 1 1 16 6744 1 1 11 TYR HD1 H -1.282 -1.561 -1.019 1.00 . A A . 11 TYR HD1 1 1 16 6745 1 1 11 TYR HD2 H -1.443 -0.389 3.131 1.00 . A A . 11 TYR HD2 1 1 16 6746 1 1 11 TYR HE1 H -3.372 -2.854 -0.729 1.00 . A A . 11 TYR HE1 1 1 16 6747 1 1 11 TYR HE2 H -3.490 -1.741 3.428 1.00 . A A . 11 TYR HE2 1 1 16 6748 1 1 11 TYR HH H -4.910 -3.277 2.477 1.00 . A A . 11 TYR HH 1 1 16 6749 1 1 11 TYR N N -0.759 2.027 1.283 1.00 . A A . 11 TYR N 1 1 16 6750 1 1 11 TYR O O -0.111 0.576 -1.787 1.00 . A A . 11 TYR O 1 1 16 6751 1 1 11 TYR OH O -4.629 -3.225 1.561 1.00 . A A . 11 TYR OH 1 1 16 6752 1 1 12 LEU C C 0.667 4.605 -2.693 1.00 . A A . 12 LEU C 1 1 16 6753 1 1 12 LEU CA C -0.200 3.340 -2.634 1.00 . A A . 12 LEU CA 1 1 16 6754 1 1 12 LEU CB C -1.678 3.600 -2.947 1.00 . A A . 12 LEU CB 1 1 16 6755 1 1 12 LEU CD1 C -1.056 4.076 -5.373 1.00 . A A . 12 LEU CD1 1 1 16 6756 1 1 12 LEU CD2 C -3.401 4.570 -4.500 1.00 . A A . 12 LEU CD2 1 1 16 6757 1 1 12 LEU CG C -1.904 4.517 -4.159 1.00 . A A . 12 LEU CG 1 1 16 6758 1 1 12 LEU H H -0.010 3.447 -0.552 1.00 . A A . 12 LEU H 1 1 16 6759 1 1 12 LEU HA H 0.177 2.593 -3.323 1.00 . A A . 12 LEU HA 1 1 16 6760 1 1 12 LEU HB2 H -2.164 2.636 -3.103 1.00 . A A . 12 LEU HB2 1 1 16 6761 1 1 12 LEU HB3 H -2.132 4.076 -2.081 1.00 . A A . 12 LEU HB3 1 1 16 6762 1 1 12 LEU HD11 H -1.292 5.048 -5.807 1.00 . A A . 12 LEU HD11 1 1 16 6763 1 1 12 LEU HD12 H -1.345 3.870 -6.403 1.00 . A A . 12 LEU HD12 1 1 16 6764 1 1 12 LEU HD13 H -1.571 3.116 -5.327 1.00 . A A . 12 LEU HD13 1 1 16 6765 1 1 12 LEU HD21 H -3.576 5.283 -5.306 1.00 . A A . 12 LEU HD21 1 1 16 6766 1 1 12 LEU HD22 H -3.967 4.889 -3.625 1.00 . A A . 12 LEU HD22 1 1 16 6767 1 1 12 LEU HD23 H -3.753 3.587 -4.813 1.00 . A A . 12 LEU HD23 1 1 16 6768 1 1 12 LEU HG H -1.611 5.522 -3.838 1.00 . A A . 12 LEU HG 1 1 16 6769 1 1 12 LEU N N -0.094 2.784 -1.306 1.00 . A A . 12 LEU N 1 1 16 6770 1 1 12 LEU O O 1.350 4.837 -3.688 1.00 . A A . 12 LEU O 1 1 16 6771 1 1 13 ASP C C 2.810 6.646 -1.879 1.00 . A A . 13 ASP C 1 1 16 6772 1 1 13 ASP CA C 1.357 6.642 -1.390 1.00 . A A . 13 ASP CA 1 1 16 6773 1 1 13 ASP CB C 1.213 7.010 0.096 1.00 . A A . 13 ASP CB 1 1 16 6774 1 1 13 ASP CG C 1.921 8.312 0.463 1.00 . A A . 13 ASP CG 1 1 16 6775 1 1 13 ASP H H 0.010 5.130 -0.863 1.00 . A A . 13 ASP H 1 1 16 6776 1 1 13 ASP HA H 0.866 7.416 -1.959 1.00 . A A . 13 ASP HA 1 1 16 6777 1 1 13 ASP HB2 H 0.152 7.113 0.329 1.00 . A A . 13 ASP HB2 1 1 16 6778 1 1 13 ASP HB3 H 1.609 6.198 0.706 1.00 . A A . 13 ASP HB3 1 1 16 6779 1 1 13 ASP N N 0.635 5.397 -1.611 1.00 . A A . 13 ASP N 1 1 16 6780 1 1 13 ASP O O 3.076 7.040 -3.013 1.00 . A A . 13 ASP O 1 1 16 6781 1 1 13 ASP OD1 O 1.623 9.332 -0.195 1.00 . A A . 13 ASP OD1 1 1 16 6782 1 1 13 ASP OD2 O 2.753 8.262 1.396 1.00 . A A . 13 ASP OD2 1 1 16 6783 1 1 14 SER C C 5.944 5.227 -0.612 1.00 . A A . 14 SER C 1 1 16 6784 1 1 14 SER CA C 5.183 6.407 -1.228 1.00 . A A . 14 SER CA 1 1 16 6785 1 1 14 SER CB C 5.662 7.778 -0.719 1.00 . A A . 14 SER CB 1 1 16 6786 1 1 14 SER H H 3.410 5.997 -0.095 1.00 . A A . 14 SER H 1 1 16 6787 1 1 14 SER HA H 5.385 6.369 -2.299 1.00 . A A . 14 SER HA 1 1 16 6788 1 1 14 SER HB2 H 5.437 7.888 0.342 1.00 . A A . 14 SER HB2 1 1 16 6789 1 1 14 SER HB3 H 6.738 7.874 -0.874 1.00 . A A . 14 SER HB3 1 1 16 6790 1 1 14 SER HG H 4.081 8.752 -1.312 1.00 . A A . 14 SER HG 1 1 16 6791 1 1 14 SER N N 3.746 6.279 -1.000 1.00 . A A . 14 SER N 1 1 16 6792 1 1 14 SER O O 5.770 4.104 -1.078 1.00 . A A . 14 SER O 1 1 16 6793 1 1 14 SER OG O 5.032 8.826 -1.425 1.00 . A A . 14 SER OG 1 1 16 6794 1 1 15 ARG C C 6.929 3.196 1.348 1.00 . A A . 15 ARG C 1 1 16 6795 1 1 15 ARG CA C 7.687 4.471 0.996 1.00 . A A . 15 ARG CA 1 1 16 6796 1 1 15 ARG CB C 8.385 5.077 2.226 1.00 . A A . 15 ARG CB 1 1 16 6797 1 1 15 ARG CD C 8.994 2.960 3.593 1.00 . A A . 15 ARG CD 1 1 16 6798 1 1 15 ARG CG C 9.495 4.205 2.843 1.00 . A A . 15 ARG CG 1 1 16 6799 1 1 15 ARG CZ C 9.889 1.297 5.213 1.00 . A A . 15 ARG CZ 1 1 16 6800 1 1 15 ARG H H 6.876 6.407 0.754 1.00 . A A . 15 ARG H 1 1 16 6801 1 1 15 ARG HA H 8.453 4.227 0.258 1.00 . A A . 15 ARG HA 1 1 16 6802 1 1 15 ARG HB2 H 8.855 6.009 1.908 1.00 . A A . 15 ARG HB2 1 1 16 6803 1 1 15 ARG HB3 H 7.650 5.321 2.994 1.00 . A A . 15 ARG HB3 1 1 16 6804 1 1 15 ARG HD2 H 8.130 3.220 4.207 1.00 . A A . 15 ARG HD2 1 1 16 6805 1 1 15 ARG HD3 H 8.713 2.182 2.886 1.00 . A A . 15 ARG HD3 1 1 16 6806 1 1 15 ARG HE H 10.938 2.859 4.451 1.00 . A A . 15 ARG HE 1 1 16 6807 1 1 15 ARG HG2 H 10.201 3.904 2.069 1.00 . A A . 15 ARG HG2 1 1 16 6808 1 1 15 ARG HG3 H 10.024 4.833 3.562 1.00 . A A . 15 ARG HG3 1 1 16 6809 1 1 15 ARG HH11 H 7.933 0.969 4.710 1.00 . A A . 15 ARG HH11 1 1 16 6810 1 1 15 ARG HH12 H 8.621 -0.181 5.831 1.00 . A A . 15 ARG HH12 1 1 16 6811 1 1 15 ARG HH21 H 11.807 1.332 5.916 1.00 . A A . 15 ARG HH21 1 1 16 6812 1 1 15 ARG HH22 H 10.813 0.024 6.515 1.00 . A A . 15 ARG HH22 1 1 16 6813 1 1 15 ARG N N 6.796 5.466 0.400 1.00 . A A . 15 ARG N 1 1 16 6814 1 1 15 ARG NE N 10.042 2.394 4.451 1.00 . A A . 15 ARG NE 1 1 16 6815 1 1 15 ARG NH1 N 8.717 0.644 5.256 1.00 . A A . 15 ARG NH1 1 1 16 6816 1 1 15 ARG NH2 N 10.920 0.848 5.941 1.00 . A A . 15 ARG NH2 1 1 16 6817 1 1 15 ARG O O 7.264 2.124 0.848 1.00 . A A . 15 ARG O 1 1 16 6818 1 1 16 ARG C C 4.506 1.405 1.519 1.00 . A A . 16 ARG C 1 1 16 6819 1 1 16 ARG CA C 5.101 2.211 2.679 1.00 . A A . 16 ARG CA 1 1 16 6820 1 1 16 ARG CB C 4.028 2.712 3.656 1.00 . A A . 16 ARG CB 1 1 16 6821 1 1 16 ARG CD C 2.042 4.233 4.029 1.00 . A A . 16 ARG CD 1 1 16 6822 1 1 16 ARG CG C 3.110 3.770 3.034 1.00 . A A . 16 ARG CG 1 1 16 6823 1 1 16 ARG CZ C 0.857 6.453 4.188 1.00 . A A . 16 ARG CZ 1 1 16 6824 1 1 16 ARG H H 5.691 4.245 2.556 1.00 . A A . 16 ARG H 1 1 16 6825 1 1 16 ARG HA H 5.755 1.542 3.241 1.00 . A A . 16 ARG HA 1 1 16 6826 1 1 16 ARG HB2 H 3.426 1.864 3.987 1.00 . A A . 16 ARG HB2 1 1 16 6827 1 1 16 ARG HB3 H 4.524 3.144 4.527 1.00 . A A . 16 ARG HB3 1 1 16 6828 1 1 16 ARG HD2 H 1.338 3.417 4.195 1.00 . A A . 16 ARG HD2 1 1 16 6829 1 1 16 ARG HD3 H 2.521 4.484 4.973 1.00 . A A . 16 ARG HD3 1 1 16 6830 1 1 16 ARG HE H 1.105 5.351 2.508 1.00 . A A . 16 ARG HE 1 1 16 6831 1 1 16 ARG HG2 H 3.693 4.636 2.725 1.00 . A A . 16 ARG HG2 1 1 16 6832 1 1 16 ARG HG3 H 2.627 3.341 2.160 1.00 . A A . 16 ARG HG3 1 1 16 6833 1 1 16 ARG HH11 H 1.509 5.837 6.030 1.00 . A A . 16 ARG HH11 1 1 16 6834 1 1 16 ARG HH12 H 0.683 7.374 6.000 1.00 . A A . 16 ARG HH12 1 1 16 6835 1 1 16 ARG HH21 H 0.064 7.355 2.536 1.00 . A A . 16 ARG HH21 1 1 16 6836 1 1 16 ARG HH22 H -0.142 8.228 4.036 1.00 . A A . 16 ARG HH22 1 1 16 6837 1 1 16 ARG N N 5.912 3.324 2.208 1.00 . A A . 16 ARG N 1 1 16 6838 1 1 16 ARG NE N 1.311 5.391 3.498 1.00 . A A . 16 ARG NE 1 1 16 6839 1 1 16 ARG NH1 N 1.034 6.562 5.513 1.00 . A A . 16 ARG NH1 1 1 16 6840 1 1 16 ARG NH2 N 0.207 7.424 3.533 1.00 . A A . 16 ARG NH2 1 1 16 6841 1 1 16 ARG O O 4.349 0.195 1.645 1.00 . A A . 16 ARG O 1 1 16 6842 1 1 17 ALA C C 4.763 0.531 -1.440 1.00 . A A . 17 ALA C 1 1 16 6843 1 1 17 ALA CA C 3.684 1.397 -0.796 1.00 . A A . 17 ALA CA 1 1 16 6844 1 1 17 ALA CB C 3.130 2.431 -1.777 1.00 . A A . 17 ALA CB 1 1 16 6845 1 1 17 ALA H H 4.372 3.052 0.332 1.00 . A A . 17 ALA H 1 1 16 6846 1 1 17 ALA HA H 2.862 0.744 -0.506 1.00 . A A . 17 ALA HA 1 1 16 6847 1 1 17 ALA HB1 H 2.513 3.143 -1.233 1.00 . A A . 17 ALA HB1 1 1 16 6848 1 1 17 ALA HB2 H 3.931 2.973 -2.271 1.00 . A A . 17 ALA HB2 1 1 16 6849 1 1 17 ALA HB3 H 2.534 1.928 -2.538 1.00 . A A . 17 ALA HB3 1 1 16 6850 1 1 17 ALA N N 4.194 2.060 0.392 1.00 . A A . 17 ALA N 1 1 16 6851 1 1 17 ALA O O 4.502 -0.627 -1.753 1.00 . A A . 17 ALA O 1 1 16 6852 1 1 18 GLN C C 7.398 -0.892 -1.334 1.00 . A A . 18 GLN C 1 1 16 6853 1 1 18 GLN CA C 7.071 0.314 -2.215 1.00 . A A . 18 GLN CA 1 1 16 6854 1 1 18 GLN CB C 8.329 1.174 -2.425 1.00 . A A . 18 GLN CB 1 1 16 6855 1 1 18 GLN CD C 7.064 2.604 -4.139 1.00 . A A . 18 GLN CD 1 1 16 6856 1 1 18 GLN CG C 8.096 2.572 -3.013 1.00 . A A . 18 GLN CG 1 1 16 6857 1 1 18 GLN H H 6.141 2.028 -1.335 1.00 . A A . 18 GLN H 1 1 16 6858 1 1 18 GLN HA H 6.739 -0.060 -3.186 1.00 . A A . 18 GLN HA 1 1 16 6859 1 1 18 GLN HB2 H 8.846 1.305 -1.473 1.00 . A A . 18 GLN HB2 1 1 16 6860 1 1 18 GLN HB3 H 8.993 0.625 -3.094 1.00 . A A . 18 GLN HB3 1 1 16 6861 1 1 18 GLN HE21 H 5.858 3.834 -3.055 1.00 . A A . 18 GLN HE21 1 1 16 6862 1 1 18 GLN HE22 H 5.262 3.414 -4.648 1.00 . A A . 18 GLN HE22 1 1 16 6863 1 1 18 GLN HG2 H 7.792 3.239 -2.209 1.00 . A A . 18 GLN HG2 1 1 16 6864 1 1 18 GLN HG3 H 9.044 2.944 -3.402 1.00 . A A . 18 GLN HG3 1 1 16 6865 1 1 18 GLN N N 5.973 1.074 -1.629 1.00 . A A . 18 GLN N 1 1 16 6866 1 1 18 GLN NE2 N 5.975 3.350 -3.936 1.00 . A A . 18 GLN NE2 1 1 16 6867 1 1 18 GLN O O 7.516 -2.009 -1.831 1.00 . A A . 18 GLN O 1 1 16 6868 1 1 18 GLN OE1 O 7.248 1.969 -5.174 1.00 . A A . 18 GLN OE1 1 1 16 6869 1 1 19 ASP C C 6.750 -2.777 0.923 1.00 . A A . 19 ASP C 1 1 16 6870 1 1 19 ASP CA C 7.814 -1.680 0.969 1.00 . A A . 19 ASP CA 1 1 16 6871 1 1 19 ASP CB C 7.893 -1.027 2.353 1.00 . A A . 19 ASP CB 1 1 16 6872 1 1 19 ASP CG C 8.223 -2.045 3.441 1.00 . A A . 19 ASP CG 1 1 16 6873 1 1 19 ASP H H 7.368 0.283 0.305 1.00 . A A . 19 ASP H 1 1 16 6874 1 1 19 ASP HA H 8.786 -2.120 0.739 1.00 . A A . 19 ASP HA 1 1 16 6875 1 1 19 ASP HB2 H 8.671 -0.262 2.340 1.00 . A A . 19 ASP HB2 1 1 16 6876 1 1 19 ASP HB3 H 6.943 -0.546 2.588 1.00 . A A . 19 ASP HB3 1 1 16 6877 1 1 19 ASP N N 7.524 -0.659 -0.024 1.00 . A A . 19 ASP N 1 1 16 6878 1 1 19 ASP O O 7.084 -3.958 0.882 1.00 . A A . 19 ASP O 1 1 16 6879 1 1 19 ASP OD1 O 9.432 -2.305 3.628 1.00 . A A . 19 ASP OD1 1 1 16 6880 1 1 19 ASP OD2 O 7.262 -2.545 4.065 1.00 . A A . 19 ASP OD2 1 1 16 6881 1 1 20 PHE C C 4.446 -4.107 -0.508 1.00 . A A . 20 PHE C 1 1 16 6882 1 1 20 PHE CA C 4.345 -3.283 0.778 1.00 . A A . 20 PHE CA 1 1 16 6883 1 1 20 PHE CB C 3.037 -2.488 0.839 1.00 . A A . 20 PHE CB 1 1 16 6884 1 1 20 PHE CD1 C 1.207 -3.658 -0.460 1.00 . A A . 20 PHE CD1 1 1 16 6885 1 1 20 PHE CD2 C 1.150 -3.736 1.973 1.00 . A A . 20 PHE CD2 1 1 16 6886 1 1 20 PHE CE1 C 0.013 -4.398 -0.512 1.00 . A A . 20 PHE CE1 1 1 16 6887 1 1 20 PHE CE2 C -0.052 -4.462 1.922 1.00 . A A . 20 PHE CE2 1 1 16 6888 1 1 20 PHE CG C 1.781 -3.334 0.782 1.00 . A A . 20 PHE CG 1 1 16 6889 1 1 20 PHE CZ C -0.618 -4.797 0.679 1.00 . A A . 20 PHE CZ 1 1 16 6890 1 1 20 PHE H H 5.272 -1.387 0.968 1.00 . A A . 20 PHE H 1 1 16 6891 1 1 20 PHE HA H 4.355 -3.961 1.632 1.00 . A A . 20 PHE HA 1 1 16 6892 1 1 20 PHE HB2 H 3.018 -1.929 1.774 1.00 . A A . 20 PHE HB2 1 1 16 6893 1 1 20 PHE HB3 H 3.014 -1.773 0.018 1.00 . A A . 20 PHE HB3 1 1 16 6894 1 1 20 PHE HD1 H 1.680 -3.332 -1.376 1.00 . A A . 20 PHE HD1 1 1 16 6895 1 1 20 PHE HD2 H 1.585 -3.482 2.930 1.00 . A A . 20 PHE HD2 1 1 16 6896 1 1 20 PHE HE1 H -0.427 -4.648 -1.466 1.00 . A A . 20 PHE HE1 1 1 16 6897 1 1 20 PHE HE2 H -0.540 -4.765 2.837 1.00 . A A . 20 PHE HE2 1 1 16 6898 1 1 20 PHE HZ H -1.541 -5.357 0.640 1.00 . A A . 20 PHE HZ 1 1 16 6899 1 1 20 PHE N N 5.474 -2.377 0.909 1.00 . A A . 20 PHE N 1 1 16 6900 1 1 20 PHE O O 4.123 -5.290 -0.493 1.00 . A A . 20 PHE O 1 1 16 6901 1 1 21 VAL C C 6.118 -5.309 -2.770 1.00 . A A . 21 VAL C 1 1 16 6902 1 1 21 VAL CA C 5.019 -4.249 -2.874 1.00 . A A . 21 VAL CA 1 1 16 6903 1 1 21 VAL CB C 5.197 -3.284 -4.061 1.00 . A A . 21 VAL CB 1 1 16 6904 1 1 21 VAL CG1 C 5.657 -4.011 -5.331 1.00 . A A . 21 VAL CG1 1 1 16 6905 1 1 21 VAL CG2 C 3.863 -2.589 -4.368 1.00 . A A . 21 VAL CG2 1 1 16 6906 1 1 21 VAL H H 5.170 -2.534 -1.601 1.00 . A A . 21 VAL H 1 1 16 6907 1 1 21 VAL HA H 4.095 -4.804 -3.023 1.00 . A A . 21 VAL HA 1 1 16 6908 1 1 21 VAL HB H 5.942 -2.528 -3.814 1.00 . A A . 21 VAL HB 1 1 16 6909 1 1 21 VAL HG11 H 6.667 -4.399 -5.204 1.00 . A A . 21 VAL HG11 1 1 16 6910 1 1 21 VAL HG12 H 4.976 -4.833 -5.552 1.00 . A A . 21 VAL HG12 1 1 16 6911 1 1 21 VAL HG13 H 5.662 -3.316 -6.171 1.00 . A A . 21 VAL HG13 1 1 16 6912 1 1 21 VAL HG21 H 3.141 -3.317 -4.737 1.00 . A A . 21 VAL HG21 1 1 16 6913 1 1 21 VAL HG22 H 3.455 -2.119 -3.475 1.00 . A A . 21 VAL HG22 1 1 16 6914 1 1 21 VAL HG23 H 4.015 -1.823 -5.129 1.00 . A A . 21 VAL HG23 1 1 16 6915 1 1 21 VAL N N 4.893 -3.511 -1.621 1.00 . A A . 21 VAL N 1 1 16 6916 1 1 21 VAL O O 5.879 -6.466 -3.106 1.00 . A A . 21 VAL O 1 1 16 6917 1 1 22 GLN C C 7.973 -6.994 -1.114 1.00 . A A . 22 GLN C 1 1 16 6918 1 1 22 GLN CA C 8.399 -5.873 -2.057 1.00 . A A . 22 GLN CA 1 1 16 6919 1 1 22 GLN CB C 9.602 -5.149 -1.445 1.00 . A A . 22 GLN CB 1 1 16 6920 1 1 22 GLN CD C 10.803 -4.608 -3.617 1.00 . A A . 22 GLN CD 1 1 16 6921 1 1 22 GLN CG C 10.157 -4.052 -2.350 1.00 . A A . 22 GLN CG 1 1 16 6922 1 1 22 GLN H H 7.440 -3.966 -2.020 1.00 . A A . 22 GLN H 1 1 16 6923 1 1 22 GLN HA H 8.690 -6.322 -3.006 1.00 . A A . 22 GLN HA 1 1 16 6924 1 1 22 GLN HB2 H 9.301 -4.696 -0.500 1.00 . A A . 22 GLN HB2 1 1 16 6925 1 1 22 GLN HB3 H 10.394 -5.872 -1.242 1.00 . A A . 22 GLN HB3 1 1 16 6926 1 1 22 GLN HE21 H 9.052 -4.461 -4.650 1.00 . A A . 22 GLN HE21 1 1 16 6927 1 1 22 GLN HE22 H 10.414 -5.091 -5.553 1.00 . A A . 22 GLN HE22 1 1 16 6928 1 1 22 GLN HG2 H 9.363 -3.363 -2.620 1.00 . A A . 22 GLN HG2 1 1 16 6929 1 1 22 GLN HG3 H 10.900 -3.509 -1.769 1.00 . A A . 22 GLN HG3 1 1 16 6930 1 1 22 GLN N N 7.307 -4.932 -2.288 1.00 . A A . 22 GLN N 1 1 16 6931 1 1 22 GLN NE2 N 10.026 -4.726 -4.696 1.00 . A A . 22 GLN NE2 1 1 16 6932 1 1 22 GLN O O 8.376 -8.142 -1.288 1.00 . A A . 22 GLN O 1 1 16 6933 1 1 22 GLN OE1 O 11.990 -4.924 -3.623 1.00 . A A . 22 GLN OE1 1 1 16 6934 1 1 23 TRP C C 5.799 -8.624 0.251 1.00 . A A . 23 TRP C 1 1 16 6935 1 1 23 TRP CA C 6.726 -7.599 0.898 1.00 . A A . 23 TRP CA 1 1 16 6936 1 1 23 TRP CB C 6.028 -6.831 2.020 1.00 . A A . 23 TRP CB 1 1 16 6937 1 1 23 TRP CD1 C 5.610 -8.576 3.785 1.00 . A A . 23 TRP CD1 1 1 16 6938 1 1 23 TRP CD2 C 3.727 -7.854 2.822 1.00 . A A . 23 TRP CD2 1 1 16 6939 1 1 23 TRP CE2 C 3.350 -8.848 3.768 1.00 . A A . 23 TRP CE2 1 1 16 6940 1 1 23 TRP CE3 C 2.713 -7.303 2.017 1.00 . A A . 23 TRP CE3 1 1 16 6941 1 1 23 TRP CG C 5.166 -7.680 2.886 1.00 . A A . 23 TRP CG 1 1 16 6942 1 1 23 TRP CH2 C 1.027 -8.677 3.123 1.00 . A A . 23 TRP CH2 1 1 16 6943 1 1 23 TRP CZ2 C 2.019 -9.253 3.932 1.00 . A A . 23 TRP CZ2 1 1 16 6944 1 1 23 TRP CZ3 C 1.375 -7.715 2.158 1.00 . A A . 23 TRP CZ3 1 1 16 6945 1 1 23 TRP H H 6.773 -5.719 -0.084 1.00 . A A . 23 TRP H 1 1 16 6946 1 1 23 TRP HA H 7.591 -8.116 1.316 1.00 . A A . 23 TRP HA 1 1 16 6947 1 1 23 TRP HB2 H 6.775 -6.328 2.634 1.00 . A A . 23 TRP HB2 1 1 16 6948 1 1 23 TRP HB3 H 5.384 -6.069 1.588 1.00 . A A . 23 TRP HB3 1 1 16 6949 1 1 23 TRP HD1 H 6.658 -8.743 3.968 1.00 . A A . 23 TRP HD1 1 1 16 6950 1 1 23 TRP HE1 H 4.589 -9.953 5.063 1.00 . A A . 23 TRP HE1 1 1 16 6951 1 1 23 TRP HE3 H 3.005 -6.579 1.269 1.00 . A A . 23 TRP HE3 1 1 16 6952 1 1 23 TRP HH2 H 0.000 -8.987 3.239 1.00 . A A . 23 TRP HH2 1 1 16 6953 1 1 23 TRP HZ2 H 1.761 -10.008 4.661 1.00 . A A . 23 TRP HZ2 1 1 16 6954 1 1 23 TRP HZ3 H 0.615 -7.300 1.514 1.00 . A A . 23 TRP HZ3 1 1 16 6955 1 1 23 TRP N N 7.158 -6.657 -0.113 1.00 . A A . 23 TRP N 1 1 16 6956 1 1 23 TRP NE1 N 4.539 -9.239 4.352 1.00 . A A . 23 TRP NE1 1 1 16 6957 1 1 23 TRP O O 6.062 -9.823 0.299 1.00 . A A . 23 TRP O 1 1 16 6958 1 1 24 LEU C C 4.407 -9.828 -2.104 1.00 . A A . 24 LEU C 1 1 16 6959 1 1 24 LEU CA C 3.734 -8.886 -1.104 1.00 . A A . 24 LEU CA 1 1 16 6960 1 1 24 LEU CB C 2.809 -7.888 -1.812 1.00 . A A . 24 LEU CB 1 1 16 6961 1 1 24 LEU CD1 C 0.743 -9.372 -1.739 1.00 . A A . 24 LEU CD1 1 1 16 6962 1 1 24 LEU CD2 C 0.867 -7.432 -3.313 1.00 . A A . 24 LEU CD2 1 1 16 6963 1 1 24 LEU CG C 1.676 -8.536 -2.624 1.00 . A A . 24 LEU CG 1 1 16 6964 1 1 24 LEU H H 4.592 -7.123 -0.319 1.00 . A A . 24 LEU H 1 1 16 6965 1 1 24 LEU HA H 3.157 -9.467 -0.385 1.00 . A A . 24 LEU HA 1 1 16 6966 1 1 24 LEU HB2 H 2.372 -7.230 -1.060 1.00 . A A . 24 LEU HB2 1 1 16 6967 1 1 24 LEU HB3 H 3.417 -7.278 -2.482 1.00 . A A . 24 LEU HB3 1 1 16 6968 1 1 24 LEU HD11 H -0.104 -9.723 -2.330 1.00 . A A . 24 LEU HD11 1 1 16 6969 1 1 24 LEU HD12 H 1.267 -10.242 -1.346 1.00 . A A . 24 LEU HD12 1 1 16 6970 1 1 24 LEU HD13 H 0.371 -8.768 -0.911 1.00 . A A . 24 LEU HD13 1 1 16 6971 1 1 24 LEU HD21 H 0.413 -6.781 -2.566 1.00 . A A . 24 LEU HD21 1 1 16 6972 1 1 24 LEU HD22 H 0.081 -7.875 -3.925 1.00 . A A . 24 LEU HD22 1 1 16 6973 1 1 24 LEU HD23 H 1.520 -6.840 -3.955 1.00 . A A . 24 LEU HD23 1 1 16 6974 1 1 24 LEU HG H 2.097 -9.177 -3.400 1.00 . A A . 24 LEU HG 1 1 16 6975 1 1 24 LEU N N 4.724 -8.124 -0.362 1.00 . A A . 24 LEU N 1 1 16 6976 1 1 24 LEU O O 3.972 -10.964 -2.275 1.00 . A A . 24 LEU O 1 1 16 6977 1 1 25 MET C C 6.958 -11.289 -3.036 1.00 . A A . 25 MET C 1 1 16 6978 1 1 25 MET CA C 6.245 -10.121 -3.717 1.00 . A A . 25 MET CA 1 1 16 6979 1 1 25 MET CB C 7.263 -9.219 -4.424 1.00 . A A . 25 MET CB 1 1 16 6980 1 1 25 MET CE C 6.716 -6.642 -7.678 1.00 . A A . 25 MET CE 1 1 16 6981 1 1 25 MET CG C 6.623 -8.419 -5.561 1.00 . A A . 25 MET CG 1 1 16 6982 1 1 25 MET H H 5.775 -8.407 -2.526 1.00 . A A . 25 MET H 1 1 16 6983 1 1 25 MET HA H 5.564 -10.529 -4.466 1.00 . A A . 25 MET HA 1 1 16 6984 1 1 25 MET HB2 H 7.712 -8.542 -3.700 1.00 . A A . 25 MET HB2 1 1 16 6985 1 1 25 MET HB3 H 8.053 -9.840 -4.848 1.00 . A A . 25 MET HB3 1 1 16 6986 1 1 25 MET HE1 H 6.591 -7.480 -8.363 1.00 . A A . 25 MET HE1 1 1 16 6987 1 1 25 MET HE2 H 5.738 -6.307 -7.335 1.00 . A A . 25 MET HE2 1 1 16 6988 1 1 25 MET HE3 H 7.218 -5.825 -8.196 1.00 . A A . 25 MET HE3 1 1 16 6989 1 1 25 MET HG2 H 6.342 -9.113 -6.354 1.00 . A A . 25 MET HG2 1 1 16 6990 1 1 25 MET HG3 H 5.719 -7.926 -5.204 1.00 . A A . 25 MET HG3 1 1 16 6991 1 1 25 MET N N 5.474 -9.349 -2.752 1.00 . A A . 25 MET N 1 1 16 6992 1 1 25 MET O O 6.750 -12.439 -3.419 1.00 . A A . 25 MET O 1 1 16 6993 1 1 25 MET SD S 7.720 -7.160 -6.262 1.00 . A A . 25 MET SD 1 1 16 6994 1 1 26 ASN C C 7.712 -13.069 -0.700 1.00 . A A . 26 ASN C 1 1 16 6995 1 1 26 ASN CA C 8.599 -11.999 -1.342 1.00 . A A . 26 ASN CA 1 1 16 6996 1 1 26 ASN CB C 9.510 -11.339 -0.296 1.00 . A A . 26 ASN CB 1 1 16 6997 1 1 26 ASN CG C 10.809 -10.821 -0.914 1.00 . A A . 26 ASN CG 1 1 16 6998 1 1 26 ASN H H 7.913 -10.027 -1.763 1.00 . A A . 26 ASN H 1 1 16 6999 1 1 26 ASN HA H 9.234 -12.504 -2.073 1.00 . A A . 26 ASN HA 1 1 16 7000 1 1 26 ASN HB2 H 8.982 -10.532 0.215 1.00 . A A . 26 ASN HB2 1 1 16 7001 1 1 26 ASN HB3 H 9.783 -12.087 0.450 1.00 . A A . 26 ASN HB3 1 1 16 7002 1 1 26 ASN HD21 H 9.875 -9.202 -1.723 1.00 . A A . 26 ASN HD21 1 1 16 7003 1 1 26 ASN HD22 H 11.592 -9.328 -2.048 1.00 . A A . 26 ASN HD22 1 1 16 7004 1 1 26 ASN N N 7.805 -10.994 -2.041 1.00 . A A . 26 ASN N 1 1 16 7005 1 1 26 ASN ND2 N 10.752 -9.693 -1.623 1.00 . A A . 26 ASN ND2 1 1 16 7006 1 1 26 ASN O O 8.038 -14.252 -0.766 1.00 . A A . 26 ASN O 1 1 16 7007 1 1 26 ASN OD1 O 11.859 -11.437 -0.754 1.00 . A A . 26 ASN OD1 1 1 16 7008 1 1 27 THR C C 4.921 -14.405 -0.531 1.00 . A A . 27 THR C 1 1 16 7009 1 1 27 THR CA C 5.650 -13.577 0.531 1.00 . A A . 27 THR CA 1 1 16 7010 1 1 27 THR CB C 4.675 -12.807 1.433 1.00 . A A . 27 THR CB 1 1 16 7011 1 1 27 THR CG2 C 5.415 -12.180 2.617 1.00 . A A . 27 THR CG2 1 1 16 7012 1 1 27 THR H H 6.382 -11.672 -0.066 1.00 . A A . 27 THR H 1 1 16 7013 1 1 27 THR HA H 6.205 -14.271 1.166 1.00 . A A . 27 THR HA 1 1 16 7014 1 1 27 THR HB H 3.933 -13.506 1.822 1.00 . A A . 27 THR HB 1 1 16 7015 1 1 27 THR HG1 H 4.641 -11.117 0.466 1.00 . A A . 27 THR HG1 1 1 16 7016 1 1 27 THR HG21 H 5.935 -12.954 3.180 1.00 . A A . 27 THR HG21 1 1 16 7017 1 1 27 THR HG22 H 6.142 -11.443 2.276 1.00 . A A . 27 THR HG22 1 1 16 7018 1 1 27 THR HG23 H 4.690 -11.692 3.265 1.00 . A A . 27 THR HG23 1 1 16 7019 1 1 27 THR N N 6.596 -12.660 -0.088 1.00 . A A . 27 THR N 1 1 16 7020 1 1 27 THR O O 4.876 -15.629 -0.438 1.00 . A A . 27 THR O 1 1 16 7021 1 1 27 THR OG1 O 4.004 -11.791 0.718 1.00 . A A . 27 THR OG1 1 1 16 7022 1 1 28 NH2 HN1 H 4.395 -12.740 -1.586 1.00 . A A . 28 NH2 HN1 1 1 16 7023 1 1 28 NH2 HN2 H 3.872 -14.265 -2.268 1.00 . A A . 28 NH2 HN2 1 1 16 7024 1 1 28 NH2 N N 4.351 -13.750 -1.545 1.00 . A A . 28 NH2 N 1 1 stop_ save_
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